smiles	zinc_id	inchikey	mwt	logp	reactive	purchasable	tranche_name	features
Cc1nc(CS[C@H](C)c2ccccc2[N+](=O)[O-])sc1C	88309646	QUNYZWBLWAUNPT-LLVKDONJSA-N	308.428	4.663	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H](C)c2sccc2C)cc1[N+](=O)[O-]	90217586	UVNAFSULBASPHS-OLZOCXBDSA-N	304.415	4.685	5	20	DJBD	
O=[N+]([O-])c1ccc(NCc2cc3ccccc3o2)c2ncccc12	301075225	FSOMVWOXEIMLJD-UHFFFAOYSA-N	319.320	4.501	5	20	DJBD	
COc1ccccc1[C@@H](C)SCc1c(F)cccc1[N+](=O)[O-]	463192008	KCWYBIIKRUSKCI-LLVKDONJSA-N	321.373	4.737	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(C(C)(C)C)s1	477500312	FMVSTRHCURNHFM-UHFFFAOYSA-N	318.398	4.515	5	20	DJBD	
O=[N+]([O-])c1cccc2c1ccn2Cc1cccc(C(F)F)c1	478809617	FOADUYNOPPHOOL-UHFFFAOYSA-N	302.280	4.535	5	20	DJBD	
CC[C@@H](C)N(Cc1ccccc1)Cc1c(F)cccc1[N+](=O)[O-]	505786427	ZZYNPLTVLCQFQV-CQSZACIVSA-N	316.376	4.535	5	20	DJBD	
C[C@]1(CNCc2c3ccccc3cc3ccccc23)CCOC1	733327238	BZNYETLHEHFMAR-OAQYLSRUSA-N	305.421	4.509	5	20	DJBD	
CCCCCN(C(=O)c1ccc([N+](=O)[O-])cc1F)[C@H](C)CCC	63328166	QZGVPIOBLYKNQZ-CYBMUJFWSA-N	324.396	4.555	5	20	DJBD	
C[C@@H](N[C@H](CC(F)F)c1ccccc1)c1cccc([N+](=O)[O-])c1	421877903	MPNFRWHHWOKZSX-MLGOLLRUSA-N	320.339	4.642	5	20	DJBD	
CC(C)Sc1ccc([C@H](C)Nc2ncc([N+](=O)[O-])s2)cc1	443512084	RWORWNMRJRASDQ-JTQLQIEISA-N	323.443	4.725	5	20	DJBD	
Cc1ccc(NCc2ccc([N+](=O)[O-])c(Cl)c2)cc1Cl	864018842	YYXAYNODLKHYNQ-UHFFFAOYSA-N	311.168	4.822	5	20	DJBD	
C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H]1c1cccs1	72556889	QGAYVQXWCDQSCT-IUODEOHRSA-N	302.399	4.554	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1CNc1ccc(F)c(Cl)c1	160649100	JHQOORZTLFPCBD-UHFFFAOYSA-N	315.131	4.653	5	20	DJBD	
Cc1ccc([C@H](NCc2ccc([N+](=O)[O-])cc2)C2CCC2)cc1	427718352	LZDGURMHZVMQOO-LJQANCHMSA-N	310.397	4.534	5	20	DJBD	
Cc1c(CSCCCCOC(C)(C)C)cccc1[N+](=O)[O-]	473789408	YEHPAIWVDCIRFK-UHFFFAOYSA-N	311.447	4.732	5	20	DJBD	
CC[C@H](N[C@H](C)CCCC(F)(F)F)c1cccc([N+](=O)[O-])c1	480179882	MAPFGYRCWROJLD-RISCZKNCSA-N	318.339	4.757	5	20	DJBD	
CCCCCN(C(=O)c1cccc([N+](=O)[O-])c1C)[C@@H](C)CCC	513445315	SGSSGOONOPPEDY-AWEZNQCLSA-N	320.433	4.724	5	20	DJBD	
C[C@H](Nc1cccc(Br)c1)c1ccc([N+](=O)[O-])cc1	37176943	RESXQFCCTPBPPE-JTQLQIEISA-N	321.174	4.530	5	20	DJBD	
CCC(CC)S[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1	131808905	DFNAPXJRCCUMFS-JTQLQIEISA-N	321.402	4.628	5	20	DJBD	
CC(C)[C@H]1C[C@@H](NCc2cccc([N+](=O)[O-])c2)c2ccccc21	447989593	PMTKLTIRFHDDPP-RTBURBONSA-N	310.397	4.569	5	20	DJBD	
CC[C@@H](c1ccccc1)N(CC)Cc1c(F)cccc1[N+](=O)[O-]	505802127	LUUZWOYUPUAZFK-KRWDZBQOSA-N	316.376	4.707	5	20	DJBD	
CSCc1cccc(N[C@@H](C)c2cccc([N+](=O)[O-])c2C)c1	537531464	PLKFWNSDEZEBLK-ZDUSSCGKSA-N	316.426	4.939	5	20	DJBD	
O=C(OCC1CCOCC1)c1c2ccccc2cc2ccccc12	733006395	RCGDOOBLKUSOMT-UHFFFAOYSA-N	320.388	4.576	5	20	DJBD	
CC[C@H](NCc1cc([N+](=O)[O-])ccc1Cl)c1cccc(C)c1	796838641	KHYNXSDRAYEJBB-KRWDZBQOSA-N	318.804	4.798	5	20	DJBD	
Cc1cc(SC2CCC(C(F)(F)F)CC2)ncc1[N+](=O)[O-]	450871320	MYHWJYQNTOEJIV-UHFFFAOYSA-N	320.336	4.511	5	20	DJBD	
C[C@H](NC1(c2ccccc2Cl)CC1)c1cccc([N+](=O)[O-])c1	592391934	YLSOATVXZCFRBO-LBPRGKRZSA-N	316.788	4.588	5	20	DJBD	
C[C@@H](N[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccsc1	619754109	CRFMOKBOACXGSC-BDJLRTHQSA-N	316.426	4.730	5	20	DJBD	
Cc1ccc([C@H](C)Nc2nc3ccc([N+](=O)[O-])cc3s2)s1	731208691	FFGPMGMNNXLPBR-VIFPVBQESA-N	319.411	4.748	5	20	DJBD	
Ic1cccc2ccc3ccccc3c12	1857776199	WDBTZLVACYTFSK-UHFFFAOYSA-N	304.130	4.598	5	20	DJBD	
Cc1ccsc1/C=C(\Cl)c1nc2cc([N+](=O)[O-])ccc2[nH]1	11332381	MHBFQJUUBYOBLV-YFHOEESVSA-N	319.773	4.578	5	20	DJBD	
C[C@H](SCCOc1ccccc1F)c1ccccc1[N+](=O)[O-]	437277264	PXXGFLBRPATBLA-LBPRGKRZSA-N	321.373	4.607	5	20	DJBD	
C[C@@H](Sc1cccc([N+](=O)[O-])c1)c1nc2ccccc2o1	509090456	SGGWDQXLOXJBNX-SNVBAGLBSA-N	300.339	4.589	5	20	DJBD	
Cc1ccc([C@H](C)N(C)Cc2ccc(Cl)cc2[N+](=O)[O-])cc1	523840194	YXPKYVCEOBWXNE-ZDUSSCGKSA-N	318.804	4.750	5	20	DJBD	
C[C@H](c1ccccc1F)N(C)Cc1ccc(Cl)cc1[N+](=O)[O-]	523841104	KXRXCPIVMQSTET-LLVKDONJSA-N	322.767	4.580	5	20	DJBD	
O=[N+]([O-])c1cccc(Cl)c1CN1[C@H]2CC[C@H]1c1ccccc12	483072833	GUTMVDBWZVYIQR-HOTGVXAUSA-N	314.772	4.640	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2ncnc3ccsc23)c2ccccc12	532308677	CZOGNAGIGUJMGP-UHFFFAOYSA-N	323.333	4.545	5	20	DJBD	
O=[N+]([O-])c1ccc(CN2CCC[C@H]2c2cccc(Cl)c2)cc1	603855261	LLDWYIKPRIXBLP-KRWDZBQOSA-N	316.788	4.585	5	20	DJBD	
CC[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1F	180246992	YLENORYDLDPYGP-SJCJKPOMSA-N	302.349	4.536	5	20	DJBD	
Cc1c(CN[C@H](C)c2c(F)cccc2Cl)cccc1[N+](=O)[O-]	181752660	UFVCRWYVILPOBW-LLVKDONJSA-N	322.767	4.547	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H](C)c2ccc(F)c(F)c2)cc1[N+](=O)[O-]	192724767	DSRLSZXEYVXZMZ-RYUDHWBXSA-N	320.339	4.593	5	20	DJBD	
COc1ccc2cc(NCc3cccc([N+](=O)[O-])c3C)ccc2c1	795286482	NSCURDDLEIQTDK-UHFFFAOYSA-N	322.364	4.677	5	20	DJBD	
CCC(CC)[C@H](NCc1csc([N+](=O)[O-])c1)c1ccccc1	236704411	FFZKAEZRFDBTJC-KRWDZBQOSA-N	318.442	4.923	5	20	DJBD	
O=[N+]([O-])c1ccc(CNc2ccccc2Cc2ccccc2)cc1	323899896	YORWPDDEOCQGLG-UHFFFAOYSA-N	318.376	4.798	5	20	DJBD	
O=[N+]([O-])c1ccc(N[C@H]2C[C@H](c3ccccc3)C2)c2ccncc12	435593040	OOFCXNZMTKBIIH-SHTZXODSSA-N	319.364	4.501	5	20	DJBD	
O=[N+]([O-])c1ccc2c(c1)[C@@H](N[C@H]1CCCc3ccccc31)CCC2	447517807	UMFONYNIDNPXON-PMACEKPBSA-N	322.408	4.639	5	20	DJBD	
Cc1ccc([C@H]2CCCN2c2ccc([N+](=O)[O-])c(C)c2)s1	514082338	HFGMINULCNNUHX-OAHLLOKOSA-N	302.399	4.615	5	20	DJBD	
COc1ccc(CSc2ccccc2Cl)cc1[N+](=O)[O-]	514434614	ZCRGSVSTINVSEB-UHFFFAOYSA-N	309.774	4.549	5	20	DJBD	
CC[C@H](NCc1cc2cc(C)ccc2o1)c1cccc([N+](=O)[O-])c1	561534060	LBIKNNCLFCHSFX-SFHVURJKSA-N	324.380	4.890	5	20	DJBD	
CCCCOc1cccc(NCc2cc(F)ccc2[N+](=O)[O-])c1	742259398	XTRBMAXBEMCBMR-UHFFFAOYSA-N	318.348	4.525	5	20	DJBD	
Cc1ccc(/C=C\c2nc3cc([N+](=O)[O-])ccc3s2)s1	96767236	HCDOOUWHYAGEBK-ALCCZGGFSA-N	302.380	4.745	5	20	DJBD	
CCC(CC)N(C(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1)C1CC1	525881808	GQGATZSHHPNHDX-UHFFFAOYSA-N	318.417	4.511	5	20	DJBD	
Cc1ccc(CN[C@@H]2CCC(C)(C)c3ccccc32)cc1[N+](=O)[O-]	609223640	VYQHSQWQHSKFPK-GOSISDBHSA-N	324.424	4.806	5	20	DJBD	
Cc1cc([C@@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)c(C)s1	37122802	IRDOZOTWNXUFER-VXGBXAGGSA-N	304.415	4.685	5	20	DJBD	
CC[C@@H](N[C@@H](c1ccccc1)C1CC1)c1cccc([N+](=O)[O-])c1	195614322	WNTYHWOGRVJMSH-MOPGFXCFSA-N	310.397	4.787	5	20	DJBD	
CCC[C@H](Nc1ccccc1OC)c1cccc([N+](=O)[O-])c1	314279835	BGDUDWCIBKOOHY-HNNXBMFYSA-N	300.358	4.557	5	20	DJBD	
CC(=O)c1ccc2cc(OCc3ccccc3[N+](=O)[O-])ccc2c1	482744869	NNLNGGIJGYXIAD-UHFFFAOYSA-N	321.332	4.530	5	20	DJBD	
CC[C@H](Nc1ccccc1[N+](=O)[O-])c1ccccc1OC(F)F	498820527	YXEDUJFMADHALZ-LBPRGKRZSA-N	322.311	4.759	5	20	DJBD	
CCOCc1ccc(N[C@@H](CC)c2cccc([N+](=O)[O-])c2)cc1	537449115	FTJALPMSIXMUBL-SFHVURJKSA-N	314.385	4.695	5	20	DJBD	
C[C@H]1C[C@H]1c1ccc(CNc2ccc([N+](=O)[O-])cc2Cl)o1	36971048	RGNHHCDQFGPTGZ-JOYOIKCWSA-N	306.749	4.577	5	20	DJBD	
Cc1cccc2c1[C@H](C)C[C@H]2NCc1cccc([N+](=O)[O-])c1C	478499968	TUHNAXQGPJYQFZ-CXAGYDPISA-N	310.397	4.550	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)c1c(C)cccc1C	546223830	KRMBQUNRFCEYSR-HOTGVXAUSA-N	312.413	4.932	5	20	DJBD	
CC(C)c1ccc(C(C)(C)NCc2ccc([N+](=O)[O-])cc2)cc1	609223683	FABXVCBLYVKCQN-UHFFFAOYSA-N	312.413	4.743	5	20	DJBD	
c1ccc2c(CNCCOC3CCC3)c3ccccc3cc2c1	742387360	SBZCDOIKLIGFLX-UHFFFAOYSA-N	305.421	4.652	5	20	DJBD	
Cc1ccc(N[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1-c1ncco1	180007648	UKLYGWRNEBCIHI-ZDUSSCGKSA-N	323.352	4.731	5	20	DJBD	
C/C(=C\c1ccc(-c2ccccc2[N+](=O)[O-])s1)c1cnccn1	187648575	UUUWOZUTYHUELA-ZRDIBKRKSA-N	323.377	4.674	5	20	DJBD	
C[C@H](N[C@H](c1ccccc1)C1CCC1)c1cccc([N+](=O)[O-])c1	531960960	JYSBCQMFMQLZFB-IFXJQAMLSA-N	310.397	4.787	5	20	DJBD	
C/C(=C\c1nc(-c2ccc([N+](=O)[O-])cc2C)no1)c1ccccc1	545695896	RXBVGRIHWYICOI-VAWYXSNFSA-N	321.336	4.514	5	20	DJBD	
O=[N+]([O-])c1cccc(-c2csc(-c3cccc(F)c3)n2)c1	7846014	XRAGGRUJFPLGSY-UHFFFAOYSA-N	300.314	4.524	5	20	DJBD	
CSCc1cccc(N[C@H](C)c2cc([N+](=O)[O-])ccc2C)c1	540834895	AQKMMBZQJBDXPU-CYBMUJFWSA-N	316.426	4.939	5	20	DJBD	
O=[N+]([O-])c1ccccc1CNc1ccccc1Cc1ccccc1	323864694	PTXHMQOIXWPJOK-UHFFFAOYSA-N	318.376	4.798	5	20	DJBD	
CC[C@@H](NCc1c(F)cccc1Cl)c1cccc([N+](=O)[O-])c1	532463851	QJBSRXGWKYIMHR-MRXNPFEDSA-N	322.767	4.628	5	20	DJBD	
CCC[C@H](N[C@H](CC)c1ccncc1)c1cccc([N+](=O)[O-])c1	163721229	OQPZYCOPHUCYPZ-MSOLQXFVSA-N	313.401	4.572	5	20	DJBD	
CC(C)n1ncc2ccc(N[C@H](C)c3cccc([N+](=O)[O-])c3)cc21	183006738	IJAOYCXXNOYGDK-CYBMUJFWSA-N	324.384	4.699	5	20	DJBD	
Cc1cc(N[C@H](C)c2ccccc2OC(F)F)ccc1[N+](=O)[O-]	390553190	KSCXDKOZXOYNAV-LLVKDONJSA-N	322.311	4.678	5	20	DJBD	
O=[N+]([O-])c1ccc(-c2ccc(-c3nc4cnccc4s3)o2)cc1	513860184	UYSIBJMDSYSOHS-UHFFFAOYSA-N	323.333	4.527	5	20	DJBD	
C[C@H](N[C@@H]1c2ccccc2CC[C@H]1C)c1ccc([N+](=O)[O-])cc1	560910579	UQMDSBAOHZHZCH-TYILLQQXSA-N	310.397	4.569	5	20	DJBD	
Cc1cccc(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1	600850015	KYYVEFUWBQVNKF-UHFFFAOYSA-N	310.275	4.534	5	20	DJBD	
Cc1c(CNc2cccc(Cl)c2Cl)cccc1[N+](=O)[O-]	35648838	LFOFCYUCEKFRDC-UHFFFAOYSA-N	311.168	4.822	5	20	DJBD	
CSc1ccccc1CN(C)[C@H](C)c1ccccc1[N+](=O)[O-]	471026289	VXVPWSOMQUWRKM-CYBMUJFWSA-N	316.426	4.510	5	20	DJBD	
CCOc1ccc([N+](=O)[O-])cc1NCc1cccc(C(F)F)c1	486171895	PCOHRCCUJUYNCO-UHFFFAOYSA-N	322.311	4.543	5	20	DJBD	
Cc1ccc([C@@H](N[C@@H](C)c2ccc([N+](=O)[O-])cc2)C2CC2)cc1	531688618	RGMBLIBQOFPJMP-IFXJQAMLSA-N	310.397	4.705	5	20	DJBD	
Cc1ccc(-c2ccc([C@@H](N)CC(F)(F)F)cc2)cc1[N+](=O)[O-]	600792143	WNUYCQYZGHDCQM-AWEZNQCLSA-N	324.302	4.522	5	20	DJBD	
C[C@H](SCc1ccccc1[N+](=O)[O-])c1ccc(F)c(F)c1	609237668	JYCFTAVSSZOKKN-JTQLQIEISA-N	309.337	4.867	5	20	DJBD	
CC(C)Oc1ccc(N[C@@H](C)c2ccc([N+](=O)[O-])cc2)c(F)c1	777290850	KYORGNPUJUOQLC-LBPRGKRZSA-N	318.348	4.694	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1ccc(C(C)C)s1	185537479	WYIMLXFYUKCWFH-UHFFFAOYSA-N	318.398	4.649	5	20	DJBD	
CSc1ccccc1[C@@H](C)N[C@@H](C)c1ccccc1[N+](=O)[O-]	409894128	BIVYROLSAFDUDA-QWHCGFSZSA-N	316.426	4.729	5	20	DJBD	
O=[N+]([O-])c1cc(/C=C\c2nc(-c3ccccc3)cs2)ccc1O	436797145	MKSNVNLZAWLBAP-CLFYSBASSA-N	324.361	4.594	5	20	DJBD	
CC(C)(C)[C@H](NCCc1ccc([N+](=O)[O-])cc1)c1ccccc1	604306361	QTUVCLPYEXXQNE-GOSISDBHSA-N	312.413	4.514	5	20	DJBD	
CC(C)(C)c1ccccc1NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1	5443248	YDMCZNWKYVGFOA-JLHYYAGUSA-N	324.380	4.544	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1N[C@@H]1CSc2ccccc21	83748551	FIZIOCONDJFAKU-GFCCVEGCSA-N	306.774	4.507	5	20	DJBD	
C[C@@H](c1ccccc1[N+](=O)[O-])N(C)Cc1ccc(Cl)s1	487522927	FABLMLULUXIGTQ-JTQLQIEISA-N	310.806	4.503	5	20	DJBD	
O=[N+]([O-])c1ccc(-c2nc(CSCCCCCF)co2)cc1	556295900	UWOBBEIYSQTJKA-UHFFFAOYSA-N	324.377	4.623	5	20	DJBD	
CCOCc1ccc(N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1	540753490	PQELIYDKVFZWQI-AWEZNQCLSA-N	314.385	4.613	5	20	DJBD	
O=[N+]([O-])c1cccc(Cl)c1OCc1ccc(C(F)F)cc1	460803820	HDYZXFZQRALUQV-UHFFFAOYSA-N	313.687	4.765	5	20	DJBD	
CCC(=O)c1ccc(Oc2ccc3ncccc3c2)c([N+](=O)[O-])c1	479946228	KOLVIKMLDGOYCL-UHFFFAOYSA-N	322.320	4.528	5	20	DJBD	
Cc1ccc2c(c1)[C@H](Nc1ccc([N+](=O)[O-])c3cccnc13)CC2	609288199	GSDSGHVTTQCUEK-MRXNPFEDSA-N	319.364	4.551	5	20	DJBD	
CC[C@H](Nc1cccc(F)c1[N+](=O)[O-])c1ccc(F)cc1F	737414228	GOHDZCSAVXLYFU-ZDUSSCGKSA-N	310.275	4.575	5	20	DJBD	
CC(C)(C)c1nnc(-c2cc3ccccc3c3cccnc23)o1	1118132262	PQIJVBIBHQDLSM-UHFFFAOYSA-N	303.365	4.736	5	20	DJBD	
CC(=O)c1ccc(N[C@H](C)c2cc3ccccc3o2)c([N+](=O)[O-])c1	7365757	UXXTXDGQGMHOGY-LLVKDONJSA-N	324.336	4.717	5	20	DJBD	
C[C@H](Nc1cccc(Br)c1)c1cccc([N+](=O)[O-])c1	20090416	MBRZFYUBLFQXTJ-JTQLQIEISA-N	321.174	4.530	5	20	DJBD	
CCC[C@@H](N[C@H]1CCCc2occc21)c1cccc([N+](=O)[O-])c1	120788502	DCOKRVOFEUHVIG-SJORKVTESA-N	314.385	4.696	5	20	DJBD	
c1ccc2c(CNCCc3ccncc3)c3ccccc3cc2c1	169414694	YHUQZJJBFJJXOT-UHFFFAOYSA-N	312.416	4.720	5	20	DJBD	
Cc1ccc(CN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1Cl	443995655	RKBBKOHDZJPIIZ-ZDUSSCGKSA-N	318.804	4.716	5	20	DJBD	
O=[N+]([O-])c1cccc(Cl)c1CSc1nc2ccccc2o1	487663903	ACJBGHZSDMZLCJ-UHFFFAOYSA-N	320.757	4.682	5	20	DJBD	
O=[N+]([O-])c1cccc(-c2ccc(-c3nc4cnccc4s3)o2)c1	513859848	QLZWRSYGFLTNLN-UHFFFAOYSA-N	323.333	4.527	5	20	DJBD	
CCC[C@@H](N[C@H](C)c1cnc(C)s1)c1cccc([N+](=O)[O-])c1	601298656	PYSPRIMWMVSZOQ-IAQYHMDHSA-N	319.430	4.552	5	20	DJBD	
CC[C@H](N[C@H]1CCc2ccc(C)cc21)c1cccc([N+](=O)[O-])c1	610831224	UTCYMGOCXCHZCI-OALUTQOASA-N	310.397	4.631	5	20	DJBD	
CCOc1cc(CNc2ccc(C(F)F)cc2)ccc1[N+](=O)[O-]	901441560	IAPVBZUSSKWQFN-UHFFFAOYSA-N	322.311	4.543	5	20	DJBD	
CC[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1cccc(F)c1	186842547	AXVMSVIXLWDSJS-YVEFUNNKSA-N	302.349	4.536	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1CSc1ncccc1Cl	501140832	GOQLMXOQHFRLAO-UHFFFAOYSA-N	315.181	4.589	5	20	DJBD	
CC[C@@H](N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1cccc(F)c1	525868733	BXUDNHQIGKDXIY-CXAGYDPISA-N	316.376	4.844	5	20	DJBD	
CCOCc1cccc(N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1	182943812	CYFVQXZAJQSHRX-CQSZACIVSA-N	314.385	4.613	5	20	DJBD	
CC(C)Oc1ccc([C@H](C)Nc2ccc([N+](=O)[O-])s2)cc1	604409277	MTMJJVOSJHFTGY-NSHDSACASA-N	306.387	4.617	5	20	DJBD	
CC/C=C(\C)C(=O)OCc1nc2ccccc2c2ccccc12	920509161	OELDIMVYGYYMHO-RIYZIHGNSA-N	305.377	4.788	5	20	DJBD	
CC(C)OCc1ccc(N[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1	178649898	KZCMYRLLXNCWRD-AWEZNQCLSA-N	314.385	4.693	5	20	DJBD	
C[C@H](N[C@@H](C)c1c(F)cccc1Cl)c1ccc([N+](=O)[O-])cc1	178661469	YINMQJMUDZREHJ-QWRGUYRKSA-N	322.767	4.799	5	20	DJBD	
CCc1ccc([C@@H](C)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1	195613682	NRWBZGPLUYVICE-CABCVRRESA-N	312.413	4.877	5	20	DJBD	
CCOc1cc(C)ccc1NCc1ccc(Cl)cc1[N+](=O)[O-]	864006615	WTUBHXXWAXVDQK-UHFFFAOYSA-N	320.776	4.567	5	20	DJBD	
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1sccc1C	872027318	KTBWGFISHURDEH-NSHDSACASA-N	322.455	4.537	5	20	DJBD	
CC(C)Oc1cc(F)ccc1N[C@@H](C)c1ccccc1[N+](=O)[O-]	484967018	BIVNPYPMGDUTGZ-LBPRGKRZSA-N	318.348	4.694	5	20	DJBD	
Cc1cccc(C)c1[C@H](C)NCc1c(Cl)cccc1[N+](=O)[O-]	494660022	DJGFOTZQGXWKIC-ZDUSSCGKSA-N	318.804	4.716	5	20	DJBD	
Cc1cccc2c1CC[C@H]2N[C@@H]1CCCc2ccc([N+](=O)[O-])cc21	562603589	SUUDMYIZLIEGRU-WOJBJXKFSA-N	322.408	4.558	5	20	DJBD	
O=[N+]([O-])c1ccccc1CNc1cccc(Oc2ccccc2)c1	324401514	PINWHIJGMKTJRT-UHFFFAOYSA-N	320.348	4.999	5	20	DJBD	
O=[N+]([O-])c1ccc(N[C@H](c2ccccc2)c2ccc(F)cc2)cc1	392150839	ZMEJEJWDFGIMOR-LJQANCHMSA-N	322.339	4.935	5	20	DJBD	
O=[N+]([O-])c1ccsc1Oc1ccc(F)c(C(F)(F)F)c1	615498599	ZGMOKDRLNRJMAM-UHFFFAOYSA-N	307.224	4.607	5	20	DJBD	
C[C@H](NCc1ccc([N+](=O)[O-])cc1)c1csc2ccccc12	731452433	YHHASWKMTXQOQS-LBPRGKRZSA-N	312.394	4.660	5	20	DJBD	
CC(C)Oc1ccccc1[C@@H](C)Nc1cccc(F)c1[N+](=O)[O-]	919963854	MLBXSPSYWZDODH-GFCCVEGCSA-N	318.348	4.694	5	20	DJBD	
C[C@H](N[C@@H](C)c1ccc(Cl)c(F)c1)c1cccc([N+](=O)[O-])c1	317211144	GIZVWQQJTUTHQZ-QWRGUYRKSA-N	322.767	4.799	5	20	DJBD	
CC(/C=C/c1nc2ccccc2o1)=C\c1cccc([N+](=O)[O-])c1	469111771	WLQMTZQBJIPBTG-SNMPHBPQSA-N	306.321	4.853	5	20	DJBD	
Cc1cc(C)c([C@H](C)Sc2ncccc2[N+](=O)[O-])c(C)c1	520088117	ZMGPDLQEQYMQTL-ZDUSSCGKSA-N	302.399	4.768	5	20	DJBD	
C[C@H](SCc1nc(C2CC2)cs1)c1cccc([N+](=O)[O-])c1	541294491	DJFNBMXTNYJTQS-JTQLQIEISA-N	320.439	4.923	5	20	DJBD	
Cc1c(CN(C2CC2)[C@@H](C)c2ccccc2)cccc1[N+](=O)[O-]	746115046	HGTPLHWCTPFJEY-HNNXBMFYSA-N	310.397	4.629	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H]2CCCc3ccc([N+](=O)[O-])cc32)s1	774141544	VEORLVQEMIGYIR-WBMJQRKESA-N	316.426	4.693	5	20	DJBD	
CC(C)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)c1	15740973	GHHUXWLLOWUOIE-UHFFFAOYSA-N	318.760	4.624	5	20	DJBD	
Cc1sc(-c2ccc([N+](=O)[O-])cc2)nc1-c1ccc(F)cc1	71971763	JQEWEQWRVQSCJP-UHFFFAOYSA-N	314.341	4.833	5	20	DJBD	
C[C@H](Nc1ncc([N+](=O)[O-])s1)c1cccc(Cl)c1Cl	443519066	NCVJIOSDIBSZLR-LURJTMIESA-N	318.185	4.531	5	20	DJBD	
Cc1cc(NCc2ccc([N+](=O)[O-])cc2F)ccc1C1CC1	479405116	CKZMCJPGUMNSBR-UHFFFAOYSA-N	300.333	4.532	5	20	DJBD	
Cc1cccc([C@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2C)c1C	531711318	OROCDDDYXIRKPD-HOTGVXAUSA-N	312.413	4.932	5	20	DJBD	
CC(C)[C@@H](C)C(=O)OCc1nc2ccccc2c2ccccc12	733576066	GSCAIOIYMYOPIM-CQSZACIVSA-N	307.393	4.723	5	20	DJBD	
Cc1noc(C)c1NC(=O)c1c2ccccc2cc2ccccc12	746518477	UPSUEYIYQJHBGH-UHFFFAOYSA-N	316.360	4.850	5	20	DJBD	
O=[N+]([O-])c1cccc(NC(=S)Nc2ccc3ccccc3c2)c1	13799282	YHFCLXKNXNTVAD-UHFFFAOYSA-N	323.377	4.557	5	20	DJBD	
C[C@H](Nc1ccccc1[N+](=O)[O-])c1ccc(C(F)(F)F)cc1	220300386	MOJVAHIQIGLWOA-JTQLQIEISA-N	310.275	4.787	5	20	DJBD	
Cc1cc(N[C@H](C)c2ccc(OC(C)C)cc2)ccc1[N+](=O)[O-]	321270150	GNSANMDJYUWYNR-CQSZACIVSA-N	314.385	4.864	5	20	DJBD	
O=[N+]([O-])c1cnc(Oc2ccc(Cl)c(C(F)(F)F)c2)s1	443411504	RWKZIQJNCCUULO-UHFFFAOYSA-N	324.667	4.516	5	20	DJBD	
CC[C@@]1(C)CCN(C(=O)c2cc3ccccc3c3cccnc23)C1	468259871	IRQMTGYQDBOYET-NRFANRHFSA-N	318.420	4.650	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1CN[C@@H](c1cccs1)C1CC1	544398060	POHFUYGFGQNAAH-OAHLLOKOSA-N	322.817	4.551	5	20	DJBD	
COC(=O)[C@@](C)(F)c1c(F)cc2c(ccc3ccccc32)c1F	98178040	KGNLZSMOKWUTPM-SFHVURJKSA-N	318.294	4.629	5	20	DJBD	
O=C(Nc1ccccc1-c1cccs1)c1cccc([N+](=O)[O-])c1	198180882	GNIMNVRLUCLWID-UHFFFAOYSA-N	324.361	4.576	5	20	DJBD	
Cc1ccc(CNC(C)(C)c2ccc(Cl)cc2)cc1[N+](=O)[O-]	237730029	CYKZEIUZTLHYSX-UHFFFAOYSA-N	318.804	4.582	5	20	DJBD	
CCC[C@H](NCc1ccc(F)cc1F)c1cccc([N+](=O)[O-])c1	320707321	ZIEBVTSARMFICJ-KRWDZBQOSA-N	320.339	4.504	5	20	DJBD	
CC(C)[C@@H](N[C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(F)cc1	390483849	MEPYYFZTZORCON-FZKQIMNGSA-N	316.376	4.782	5	20	DJBD	
C[C@H](Cc1ccccc1[N+](=O)[O-])Nc1cccc(C(F)F)c1	449052638	DZIYTFVCSATZSL-LLVKDONJSA-N	306.312	4.576	5	20	DJBD	
CC[C@@H](Nc1ccc([N+](=O)[O-])c(N)c1F)c1ccc(Cl)cc1	471249690	IXQMICUEEAFOIR-LLVKDONJSA-N	323.755	4.533	5	20	DJBD	
Cc1cc(C)c(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c(C)c1	514560688	QRJVZFXIZJVZPS-UHFFFAOYSA-N	324.336	4.519	5	20	DJBD	
CCC[C@@H](N[C@@H](CC)c1ccncc1)c1cccc([N+](=O)[O-])c1	163721120	OQPZYCOPHUCYPZ-ZWKOTPCHSA-N	313.401	4.572	5	20	DJBD	
CCN(Cc1c[nH]c2ccccc12)[C@H](C)c1ccccc1[N+](=O)[O-]	442885847	MKLAAAICDZYBDV-CQSZACIVSA-N	323.396	4.659	5	20	DJBD	
CCC[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccsc1	453250026	XLCUJDCROUDVCW-BLLLJJGKSA-N	304.415	4.848	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc2cccnc2c1	480557089	SOTYNGYUUOJXEX-UHFFFAOYSA-N	300.701	4.589	5	20	DJBD	
CCOCc1ccc(N[C@H](CC)c2cccc([N+](=O)[O-])c2)cc1	537449102	FTJALPMSIXMUBL-GOSISDBHSA-N	314.385	4.695	5	20	DJBD	
Cc1cccc(C2(NCc3ccc(C)c([N+](=O)[O-])c3)CCCC2)c1	608983079	BYVQHIZTYRBLQS-UHFFFAOYSA-N	324.424	4.771	5	20	DJBD	
CC(C)N(Cc1ccc([N+](=O)[O-])c(F)c1)[C@H](C)c1ccccc1	794681659	BPUNHMHTBKLVQU-CQSZACIVSA-N	316.376	4.706	5	20	DJBD	
O=C(Nc1ccc([N+](=O)[O-])cc1)c1ccc(-c2ccccc2)s1	1115813817	MELATPXMTIGLMH-UHFFFAOYSA-N	324.361	4.576	5	20	DJBD	
Cc1ccc(C(F)(F)F)cc1NCc1csc([N+](=O)[O-])c1	91477791	VWPVQWOQIWMYOH-UHFFFAOYSA-N	316.304	4.596	5	20	DJBD	
Cc1cc(C)cc([C@H](C)Nc2ccc([N+](=O)[O-])c3cnccc23)c1	501298801	PAVJBGOFHHLPFS-AWEZNQCLSA-N	321.380	4.933	5	20	DJBD	
Cc1ccccc1[C@@H](NCc1cccc([N+](=O)[O-])c1C)C(C)C	540360795	BYOYVHVSTAITLL-IBGZPJMESA-N	312.413	4.699	5	20	DJBD	
Cc1ccc([C@@H](C)Nc2ccccc2OC(F)F)cc1[N+](=O)[O-]	390330033	ZLWPWCJICDMPBY-LLVKDONJSA-N	322.311	4.678	5	20	DJBD	
CCC[C@H](NCc1coc2ccccc12)c1cccc([N+](=O)[O-])c1	578972444	SZLPAYPFBUTFPV-SFHVURJKSA-N	324.380	4.972	5	20	DJBD	
Cc1c(CN(C)[C@@H](C)c2ccccc2Cl)cccc1[N+](=O)[O-]	603856621	MRRPKHGFOQRBPR-ZDUSSCGKSA-N	318.804	4.750	5	20	DJBD	
C[C@H](N[C@H](C)c1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1	20545597	KRNGZNCKUMEFER-NEPJUHHUSA-N	304.777	4.660	5	20	DJBD	
CCc1ccc([C@H](C)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1	195613687	NRWBZGPLUYVICE-LSDHHAIUSA-N	312.413	4.877	5	20	DJBD	
C[C@H](NCc1ccccc1[N+](=O)[O-])c1ccc(F)c2ccccc12	551063072	ITCSWOKMOPCMEN-ZDUSSCGKSA-N	324.355	4.738	5	20	DJBD	
CC(C)(C)[C@@H](NCCc1ccc([N+](=O)[O-])cc1)c1ccccc1	604306364	QTUVCLPYEXXQNE-SFHVURJKSA-N	312.413	4.514	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)cc1CSc1nc2ccccc2o1	746390368	DLURFQDWIHENDL-UHFFFAOYSA-N	320.757	4.682	5	20	DJBD	
C[C@H](Nc1ccc([N+](=O)[O-])cc1)c1ccc(C(F)(F)F)cc1	220300533	DWZNZUZRNUOLFN-JTQLQIEISA-N	310.275	4.787	5	20	DJBD	
CC(C)c1ccc([C@H]2CCCN2c2ncc([N+](=O)[O-])s2)cc1	409719490	YWLKYCDYTWVGEI-CQSZACIVSA-N	317.414	4.516	5	20	DJBD	
CC[C@H](Nc1ccc2scnc2c1)c1cccc([N+](=O)[O-])c1	488493046	GBBGKTYWXUMFHP-AWEZNQCLSA-N	313.382	4.768	5	20	DJBD	
C[C@@H](N[C@H](C)c1ccc(Cl)s1)c1ccc([N+](=O)[O-])cc1	36992058	URWOYAFYKXHHCG-NXEZZACHSA-N	310.806	4.722	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2ccc3ncccc3c2)c(Cl)c1	60160119	DEOGVUAMANPUQJ-UHFFFAOYSA-N	300.701	4.589	5	20	DJBD	
COc1ccc([N+](=O)[O-])cc1CSc1ccc(Cl)cc1	248141501	PYUOWUCXOHAVCE-UHFFFAOYSA-N	309.774	4.549	5	20	DJBD	
Cc1cc(CNC(C)(C)c2ccccc2[N+](=O)[O-])ccc1Cl	492049103	QXFCNFFAEHGFOK-UHFFFAOYSA-N	318.804	4.582	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)Nc1ccc2ccn(C)c2c1	526948908	DMBTZSQITUYZFY-CYBMUJFWSA-N	309.369	4.568	5	20	DJBD	
CC(C)Oc1cc(F)ccc1N[C@@H](C)c1ccc([N+](=O)[O-])cc1	484948509	TUIQVWMQZOKHAD-LBPRGKRZSA-N	318.348	4.694	5	20	DJBD	
C[C@@H]1C[C@@H](C)CN(C(=O)c2cc3ccccc3c3cccnc23)C1	642518976	OMLOOLPELCRPDF-HUUCEWRRSA-N	318.420	4.506	5	20	DJBD	
COc1ccccc1SCc1ccc(Cl)c([N+](=O)[O-])c1	41030438	TXLHXNQMGCDVBP-UHFFFAOYSA-N	309.774	4.549	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2cccc(Cl)c2)c2ccncc12	69294906	YKPMHOQILSWPGX-UHFFFAOYSA-N	300.701	4.589	5	20	DJBD	
C[C@@H](NC/C=C/c1ccccc1[N+](=O)[O-])c1cc2ccccc2o1	237390218	BQLZDDFOPRYHKB-VIIAAUOXSA-N	322.364	4.705	5	20	DJBD	
CCN(CC(C)C)C(=O)c1cc2ccccc2c2cccnc12	192571753	NPQYOZAOJOGDJT-UHFFFAOYSA-N	306.409	4.506	5	20	DJBD	
C[C@@H](c1cccc(Cl)c1)N(C)Cc1c(F)cccc1[N+](=O)[O-]	505818914	DINLGZPRNJIHMQ-NSHDSACASA-N	322.767	4.580	5	20	DJBD	
CC(C)N(C/C=C\c1ccccc1)Cc1ccc([N+](=O)[O-])cc1	518565193	JFEHGPJPFFSHNW-TWGQIWQCSA-N	310.397	4.519	5	20	DJBD	
CCC[C@@H](NCc1coc2ccccc12)c1cccc([N+](=O)[O-])c1	578972443	SZLPAYPFBUTFPV-GOSISDBHSA-N	324.380	4.972	5	20	DJBD	
CC[C@H](Nc1cccc(SC)c1)c1cccc([N+](=O)[O-])c1	36721072	XMHQTWMEKVRRGA-INIZCTEOSA-N	302.399	4.880	5	20	DJBD	
C/C(=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1cnccn1	126568117	BYFIKWXBZOPNTL-BENRWUELSA-N	323.377	4.674	5	20	DJBD	
CC(C)Oc1ccc([C@H](C)Nc2ccc([N+](=O)[O-])cc2)cc1	315256744	WPPOAWKMLNFQDN-ZDUSSCGKSA-N	300.358	4.555	5	20	DJBD	
O=[N+]([O-])c1ccc(CNc2cccc3ccsc23)c(F)c1	386480747	WNBJNKKDOUFUCM-UHFFFAOYSA-N	302.330	4.561	5	20	DJBD	
Cc1ccc(CNC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1Cl	444004604	RIJWVDIDCKPQGQ-UHFFFAOYSA-N	318.804	4.582	5	20	DJBD	
CC[C@@H](OC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccccc1	733491638	NHSVJYZKPLXPEJ-CQSZACIVSA-N	319.744	4.556	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H](C)c1cccc(F)c1F	179557822	QJTJEEMYRHRFEB-VXGBXAGGSA-N	320.339	4.593	5	20	DJBD	
CSCc1cccc(N[C@H](C)c2cccc([N+](=O)[O-])c2C)c1	537531460	PLKFWNSDEZEBLK-CYBMUJFWSA-N	316.426	4.939	5	20	DJBD	
Cc1noc(CS[C@@H](C)c2cccc(Cl)c2)c1[N+](=O)[O-]	596333733	JWRKQJCZGBIEOP-VIFPVBQESA-N	312.778	4.539	5	20	DJBD	
O=[N+]([O-])c1ncccc1SCc1c(Cl)cccc1Cl	604508567	QDUQBQZGOIZUBA-UHFFFAOYSA-N	315.181	4.589	5	20	DJBD	
Cc1cc([C@@H](C)NCc2cccc([N+](=O)[O-])c2C)cc(C)c1F	553010405	HWHDMVLYAKZDLE-CQSZACIVSA-N	316.376	4.510	5	20	DJBD	
O=[N+]([O-])c1sccc1NCc1cccc(Cl)c1Cl	604492042	ARKIXCMGCZVXTP-UHFFFAOYSA-N	303.170	4.575	5	20	DJBD	
Cc1ccc(CN[C@H](C)c2c(F)cccc2Cl)cc1[N+](=O)[O-]	748098783	NZUKWWMDZWNIBO-LLVKDONJSA-N	322.767	4.547	5	20	DJBD	
O=[N+]([O-])c1cc(-c2nnc(-c3ccc4ccccc4c3)o2)cs1	1256037579	HQWUVEPMQINWSH-UHFFFAOYSA-N	323.333	4.527	5	20	DJBD	
Cc1occc1C(=O)OCc1nc2ccccc2c2ccccc12	17276838	GZWGYUUOWLNUGG-UHFFFAOYSA-N	317.344	4.646	5	20	DJBD	
O=[N+]([O-])c1ccc(SCc2ccc(Br)cc2)cc1	42203461	GVXVUSZJYBIGON-UHFFFAOYSA-N	324.199	4.650	5	20	DJBD	
O=[N+]([O-])c1ccc(N[C@H]2CCCOc3ccccc32)c(Cl)c1	504177846	VRSFQYFBJREGTB-AWEZNQCLSA-N	318.760	4.574	5	20	DJBD	
Cc1ccc(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c(C)c1	600849000	ASGRYXIBNISWGE-UHFFFAOYSA-N	324.302	4.843	5	20	DJBD	
C/C(=C/Cl)CSCc1coc(-c2ccc([N+](=O)[O-])cc2)n1	797812600	MOJPMIYZQKTOMK-POHAHGRESA-N	324.789	4.626	5	20	DJBD	
Cc1c([C@H](C)NCc2cccc(C(F)F)c2)cccc1[N+](=O)[O-]	1255461006	MISSTXWAMLGISA-LBPRGKRZSA-N	320.339	4.692	5	20	DJBD	
CC(C)c1ccccc1NC(=S)Nc1ccc([N+](=O)[O-])cc1	13789382	PZZSVXKLYJSHBF-UHFFFAOYSA-N	315.398	4.527	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H](C)c2c(F)cccc2F)cc1[N+](=O)[O-]	79723070	KGPAQHMSYXIRCE-VXGBXAGGSA-N	320.339	4.593	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)c1ccc(F)cc1F	153560617	VEOCAUKIEWFMQJ-NEPJUHHUSA-N	320.339	4.593	5	20	DJBD	
CCSc1ccc([C@@H](C)Nc2cc(C)c([N+](=O)[O-])cn2)cc1	301451780	UNVCZLQHNBXIEI-GFCCVEGCSA-N	317.414	4.583	5	20	DJBD	
Cc1ccc(N[C@H](C)c2ccc([N+](=O)[O-])cc2)c2cccnc12	320111618	WVRFOGKCUPOWJJ-CYBMUJFWSA-N	307.353	4.625	5	20	DJBD	
CCC[C@H](CC)SCCC(=O)Nc1ccc([N+](=O)[O-])cc1C	477065428	CZTRUXGJJMEGQC-AWEZNQCLSA-N	324.446	4.544	5	20	DJBD	
CCOc1cc(OCc2ccc(C(F)F)cc2)ccc1[N+](=O)[O-]	478721403	UBSUWSPYYFYIKR-UHFFFAOYSA-N	323.295	4.510	5	20	DJBD	
CCOc1cc(CNc2cccc3ccccc23)ccc1[N+](=O)[O-]	492630133	LZWOBJNHBDJMLG-UHFFFAOYSA-N	322.364	4.759	5	20	DJBD	
CC[C@H](NCc1ccc(Cl)cc1[N+](=O)[O-])c1ccc(C)cc1	539262937	PIXDFRNVZKMSQJ-INIZCTEOSA-N	318.804	4.798	5	20	DJBD	
CCC[C@H](NC1CCC(F)(F)CC1)c1cccc([N+](=O)[O-])c1	540150183	CFCYDRIIBICPON-HNNXBMFYSA-N	312.360	4.604	5	20	DJBD	
C[C@@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])c1cc2ccccc2o1	577886683	RRFLRSBZPQAMGS-WBMJQRKESA-N	322.364	4.679	5	20	DJBD	
CCCC(=CC(=O)Nc1c(F)ccc([N+](=O)[O-])c1C)CCC	800148950	UAGKAJSYKRHGQD-UHFFFAOYSA-N	308.353	4.507	5	20	DJBD	
C[C@@H](Nc1cccc2ccccc12)c1ccc(N)c([N+](=O)[O-])c1	815610694	RFLHRJFDFXLHPP-GFCCVEGCSA-N	307.353	4.503	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H](C)c2cccc(Cl)c2)cc1[N+](=O)[O-]	219863746	QQJBKTFDFCWNPS-OLZOCXBDSA-N	318.804	4.968	5	20	DJBD	
Cc1c(COc2cnccc2-c2ccccc2)cccc1[N+](=O)[O-]	434729078	LDVNZSSCJRSCST-UHFFFAOYSA-N	320.348	4.544	5	20	DJBD	
Cc1ccc(SCc2nc3cc([N+](=O)[O-])ccc3o2)c(C)c1	434812913	HXOIOKWUVBVUGA-UHFFFAOYSA-N	314.366	4.645	5	20	DJBD	
CCN(Cc1cccc([N+](=O)[O-])c1)[C@H](C)c1cc2ccccc2o1	513398197	QNXSOTXYSOBLQC-CQSZACIVSA-N	324.380	4.924	5	20	DJBD	
O=[N+]([O-])c1cc2c(Oc3ccc4ccccc4c3)ncnc2s1	553229899	ZXYLKNSEYPLLJT-UHFFFAOYSA-N	323.333	4.545	5	20	DJBD	
CC[C@H](C)Oc1ccc(N[C@H](C)c2ccccc2[N+](=O)[O-])cc1	743473381	WGRBQRZAZOWFOY-UONOGXRCSA-N	314.385	4.945	5	20	DJBD	
C[C@H](NCc1cc(F)ccc1[N+](=O)[O-])c1cccc2ccccc12	181655618	JBOQQASTIVJNLP-ZDUSSCGKSA-N	324.355	4.738	5	20	DJBD	
Cc1c([C@@H](C)N[C@@H](C)c2ccccc2Cl)cccc1[N+](=O)[O-]	479766602	QEDHCRBSICNNRK-OLZOCXBDSA-N	318.804	4.968	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1cccc(C(F)F)c1	1343273350	PIBYHSYXLIRQQI-LBPRGKRZSA-N	320.339	4.692	5	20	DJBD	
CC(C)[C@@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1	378920257	YBEKBNSJFSNCGS-QGZVFWFLSA-N	318.804	4.735	5	20	DJBD	
Cc1ccc2[nH]c(CN[C@@H](C)c3ccccc3[N+](=O)[O-])cc2c1C	472038211	MNRCECMTUUJKHK-AWEZNQCLSA-N	323.396	4.544	5	20	DJBD	
C/C=C\c1ccc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1	569524529	PKRQUQHPXDDWFK-PLNGDYQASA-N	324.380	4.544	5	20	DJBD	
CCC[C@H](CC)NC(=O)c1cc2ccccc2c2cccnc12	572229480	GILXGLGIJFNQFW-HNNXBMFYSA-N	306.409	4.697	5	20	DJBD	
Cc1c(CSc2c(F)cc(F)cc2F)cccc1[N+](=O)[O-]	603939142	XKMBJPBDLJILQR-UHFFFAOYSA-N	313.300	4.613	5	20	DJBD	
COc1ccc(CS[C@H](C)c2cccs2)cc1[N+](=O)[O-]	737402422	LUYNDSVGCAJHOT-SNVBAGLBSA-N	309.412	4.659	5	20	DJBD	
C[C@H](SCCOc1cccc([N+](=O)[O-])c1)c1cccs1	737403504	CHDRRRDCABYCTR-NSHDSACASA-N	309.412	4.530	5	20	DJBD	
Cc1cc([C@@H](C)NCc2cc(Cl)ccc2[N+](=O)[O-])ccc1F	830366840	OVFYDWIKHIMMCH-LLVKDONJSA-N	322.767	4.547	5	20	DJBD	
C[C@H](Nc1cccc(F)c1[N+](=O)[O-])c1nc(C(C)(C)C)cs1	301165053	BWYJZNZBYRKRPJ-VIFPVBQESA-N	323.393	4.661	5	20	DJBD	
Cc1cc(C)cc([C@@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2C)c1	482658334	PUAVSTCDXIFXLZ-HZPDHXFCSA-N	312.413	4.932	5	20	DJBD	
C[C@H](c1ccco1)N(Cc1c(Cl)cccc1[N+](=O)[O-])C1CC1	492060101	INMFJDNCVHSCKL-LLVKDONJSA-N	320.776	4.567	5	20	DJBD	
Cc1ccsc1/C=C(\c1ccncc1)c1ccc([N+](=O)[O-])cc1	514765522	SKTMZDBRKBEYHO-ATVHPVEESA-N	322.389	4.949	5	20	DJBD	
COc1ccc(F)cc1[C@H](C)Nc1ccc(Cl)cc1[N+](=O)[O-]	603866806	DBTLCNCFSFBPOM-VIFPVBQESA-N	324.739	4.569	5	20	DJBD	
C[C@@H](SCc1ncc(Cl)s1)c1ccccc1[N+](=O)[O-]	478914927	YTXXKGIOGRRJAX-MRVPVSSYSA-N	314.819	4.699	5	20	DJBD	
Cc1ccc(-c2ncco2)cc1N[C@H](C)c1ccccc1[N+](=O)[O-]	533954234	ZUYSOMCJVCKPIW-CYBMUJFWSA-N	323.352	4.731	5	20	DJBD	
C[C@@H](Nc1cccc2ccsc12)c1ccc(N)c([N+](=O)[O-])c1	815614670	YBSAFBBHRBKHGN-SNVBAGLBSA-N	313.382	4.565	5	20	DJBD	
Cc1cc(N[C@H](c2ccccc2)C2CCCC2)ncc1[N+](=O)[O-]	470874078	SFVIZCZLKJXBJY-GOSISDBHSA-N	311.385	4.642	5	20	DJBD	
CC(=O)c1ccc(SCCCc2ccccc2)c([N+](=O)[O-])c1	517664791	AXXMJLWRVNVVNO-UHFFFAOYSA-N	315.394	4.522	5	20	DJBD	
C/C=C/c1ccc(NCc2c(F)cc([N+](=O)[O-])cc2F)cc1	580360022	SMYOZWGUFZFCAJ-NSCUHMNNSA-N	304.296	4.518	5	20	DJBD	
COc1ccccc1[C@H](C)SCc1cc(F)ccc1[N+](=O)[O-]	742454793	GPBIVTLTSSXIRH-NSHDSACASA-N	321.373	4.737	5	20	DJBD	
Cc1c(CN2CCCCC[C@H]2c2ccco2)cccc1[N+](=O)[O-]	78830412	DEVIUJWGUDTUHD-KRWDZBQOSA-N	314.385	4.614	5	20	DJBD	
CC[C@@H](N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccsc1	453154126	RFGCUWRGLXFMKD-SWLSCSKDSA-N	304.415	4.767	5	20	DJBD	
CC(C)Oc1ccc([N+](=O)[O-])cc1CNc1ccc(Cl)cc1	462203432	PNQMMPXAVDFQTF-UHFFFAOYSA-N	320.776	4.648	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H](c2cccs2)C2CC2)cc1[N+](=O)[O-]	480233069	PIPJQZGRWMHXHX-SJCJKPOMSA-N	316.426	4.767	5	20	DJBD	
CCOc1ccccc1[C@@H](CC)Nc1ccccc1[N+](=O)[O-]	507028188	SWLLJMKJHIIVLU-CQSZACIVSA-N	300.358	4.557	5	20	DJBD	
CC(C)c1ccc(CN[C@@H](C)Cc2ccsc2)cc1[N+](=O)[O-]	604282937	QWMSAWXJQJUXHG-ZDUSSCGKSA-N	318.442	4.501	5	20	DJBD	
C[C@H](Nc1ccc(F)cc1[N+](=O)[O-])c1cc2ccccc2o1	26759517	MPOONXFKHDYPOM-JTQLQIEISA-N	300.289	4.653	5	20	DJBD	
O=Cc1cccc(Oc2c(Cl)cc([N+](=O)[O-])cc2Cl)c1	69327071	WEKYNYFFPZPBAP-UHFFFAOYSA-N	312.108	4.506	5	20	DJBD	
CC[C@H](N[C@H]1CCCc2sccc21)c1cccc([N+](=O)[O-])c1	90918490	HSTAMSJLYNSWDV-HOTGVXAUSA-N	316.426	4.775	5	20	DJBD	
O=[N+]([O-])c1ccc(/C(=C/c2cccs2)c2ccncc2)cc1	125856477	FQHICCUCEDFJKH-ATVHPVEESA-N	308.362	4.640	5	20	DJBD	
Cc1ccc([C@H]2CCCCCN2Cc2ccc([N+](=O)[O-])cc2)o1	303734874	GCRCRYJLQRXOBW-QGZVFWFLSA-N	314.385	4.614	5	20	DJBD	
CCSc1ccc([C@@H](C)Nc2ncc(C)cc2[N+](=O)[O-])cc1	463053744	KFAWDHXSOCHVPS-GFCCVEGCSA-N	317.414	4.583	5	20	DJBD	
Cc1ccc([C@@H](C)Nc2ccc3scnc3c2)cc1[N+](=O)[O-]	488477476	JNVIIBQUZWJNHZ-LLVKDONJSA-N	313.382	4.686	5	20	DJBD	
Cc1ccccc1[C@H]1CCCN1Cc1cccc([N+](=O)[O-])c1C	603857573	YAGIQCJOQXDIBM-LJQANCHMSA-N	310.397	4.549	5	20	DJBD	
CC(C)c1ccc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1	109738431	AIJCALGZPHWSIZ-UHFFFAOYSA-N	318.760	4.624	5	20	DJBD	
O=[N+]([O-])c1ccc(OCc2ccc(Cl)s2)cc1Cl	109793202	XLQLUGQMOGMUQB-UHFFFAOYSA-N	304.154	4.542	5	20	DJBD	
CC[C@H](NCc1ccc([C@@H]2C[C@H]2C)o1)c1cccc([N+](=O)[O-])c1	246404134	GFHXVOJHUWZQIO-JLZZUVOBSA-N	314.385	4.552	5	20	DJBD	
CSc1ccccc1[C@H](C)N[C@H](C)c1ccc([N+](=O)[O-])cc1	440620547	ZUYKPPBBILAJIE-OLZOCXBDSA-N	316.426	4.729	5	20	DJBD	
CC[C@H](C)c1nnc(-c2cc3ccccc3c3cccnc23)o1	1345513183	MMRUZNJJLXKZDF-LBPRGKRZSA-N	303.365	4.952	5	20	DJBD	
Cc1c(NC(=O)CCCC2CCCCC2)cccc1[N+](=O)[O-]	8267732	SCEQUJLTRIGPJF-UHFFFAOYSA-N	304.390	4.592	5	20	DJBD	
Oc1nc(-c2c[nH]c3ccccc23)nc2cc3ccccc3cc12	479773124	PDEFWWBEWPTDFR-UHFFFAOYSA-N	311.344	4.637	5	20	DJBD	
C[C@H](SCc1c(F)cccc1[N+](=O)[O-])c1ccc(F)cc1	504508391	UKZAGBZITLUXNP-JTQLQIEISA-N	309.337	4.867	5	20	DJBD	
C[C@@H](c1ccco1)N(Cc1ccc([N+](=O)[O-])cc1Cl)C1CC1	541537142	KZLCNACRVSRQQH-NSHDSACASA-N	320.776	4.567	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H](C)c2cc3ccccc3[nH]2)cc1[N+](=O)[O-]	775630364	HOSUNGZTQNLLJG-ZIAGYGMSSA-N	323.396	4.796	5	20	DJBD	
CCOc1cc(NCc2cccc(C(F)F)c2)ccc1[N+](=O)[O-]	1325948646	WDCMXCIOCXFHRZ-UHFFFAOYSA-N	322.311	4.543	5	20	DJBD	
O=Cc1ccc(Oc2ccc([N+](=O)[O-])cc2Cl)c(Cl)c1	49390064	GTQCBKODMOPWCS-UHFFFAOYSA-N	312.108	4.506	5	20	DJBD	
C[C@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)c1c(F)cccc1Cl	178661480	YINMQJMUDZREHJ-MNOVXSKESA-N	322.767	4.799	5	20	DJBD	
CCCOc1ccccc1N[C@@H](C)c1ccc([N+](=O)[O-])cc1	315760127	RBERTCNVQHQVFY-ZDUSSCGKSA-N	300.358	4.557	5	20	DJBD	
C[C@H](N[C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(Cl)c(F)c1	539296197	YRMPRQPIAAVSBQ-WDEREUQCSA-N	322.767	4.799	5	20	DJBD	
Cc1c(CNC(C)(C)c2ccc(Cl)cc2)cccc1[N+](=O)[O-]	551350749	XQOFTOAGQXLEOM-UHFFFAOYSA-N	318.804	4.582	5	20	DJBD	
O=[N+]([O-])c1ccc(N[C@@H]2CCSc3ccccc32)c(Cl)c1	22805163	DCNNLQIPWOSJMU-CYBMUJFWSA-N	320.801	4.897	5	20	DJBD	
CCC[C@@H](NCc1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1	314044032	FMKVGZXDKNKERW-QGZVFWFLSA-N	318.804	4.879	5	20	DJBD	
CC(=O)c1ccc(Oc2ccc([N+](=O)[O-])cc2Cl)c(C)c1	476522645	WYJHTMDZRVSGDL-UHFFFAOYSA-N	305.717	4.552	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](CC(F)(F)F)C(C)C	527100169	PELQPSPFYDCUHC-SMDDNHRTSA-N	318.339	4.531	5	20	DJBD	
C[C@H](c1cc2ccccc2o1)N(C)Cc1ccccc1[N+](=O)[O-]	139615215	WSUDZRFWAWZIOI-CYBMUJFWSA-N	310.353	4.534	5	20	DJBD	
CC(C)[C@H](N[C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(F)cc1	390483847	MEPYYFZTZORCON-ACJLOTCBSA-N	316.376	4.782	5	20	DJBD	
Cc1ccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1C	516716314	LLVVJBPGQJOISM-UHFFFAOYSA-N	319.748	4.509	5	20	DJBD	
COc1ccc(SCc2cc([N+](=O)[O-])ccc2Cl)cc1	37404391	SOUPKQMNOCWQDB-UHFFFAOYSA-N	309.774	4.549	5	20	DJBD	
CC[C@@H](Nc1ccc([N+](=O)[O-])cc1F)c1cc(F)ccc1F	303782653	DCMNAFMALRUPOA-CQSZACIVSA-N	310.275	4.575	5	20	DJBD	
CSc1cccc(C)c1NCc1cccc([N+](=O)[O-])c1C	471987243	XCKSSNTWPVICEC-UHFFFAOYSA-N	302.399	4.546	5	20	DJBD	
Cc1c(CNc2ccc(-c3ccccn3)cc2)cccc1[N+](=O)[O-]	576274078	WZKQOHLACGRQML-UHFFFAOYSA-N	319.364	4.577	5	20	DJBD	
O=[N+]([O-])c1ccc2nc(NCc3coc4ccccc34)ccc2c1	511672929	FFZFYSZFLCZWLE-UHFFFAOYSA-N	319.320	4.501	5	20	DJBD	
CC(C)c1ccc(CN[C@H](c2ccccc2)C2CC2)cc1[N+](=O)[O-]	588330049	ZTQBSZWOISUESU-HXUWFJFHSA-N	324.424	4.959	5	20	DJBD	
CC(C)(C)CCC(=O)N(c1cccc([N+](=O)[O-])c1)C1CCCC1	609970995	YGNPAIWGEMEUIM-UHFFFAOYSA-N	318.417	4.697	5	20	DJBD	
CC(C)n1c(-c2ccc(Cl)c([N+](=O)[O-])c2)nc2ccccc21	916854697	NPLHTGBTFLKGSU-UHFFFAOYSA-N	315.760	4.846	5	20	DJBD	
CCc1ccc([C@@H](C)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1	195613685	NRWBZGPLUYVICE-HUUCEWRRSA-N	312.413	4.877	5	20	DJBD	
O=[N+]([O-])c1cc(NCc2cc(Cl)ccc2Cl)ccc1F	230572530	BOLQWIHFRBMFDE-UHFFFAOYSA-N	315.131	4.653	5	20	DJBD	
C[C@@H](c1ccccc1[N+](=O)[O-])N1C[C@@H](c2ccccc2)C[C@H]1C	441399104	UOKCDYHUYZVBAH-VYDXJSESSA-N	310.397	4.534	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](c1cccs1)C1CC1	531944248	NDMXRIKZSRHPSR-YVEFUNNKSA-N	316.426	4.767	5	20	DJBD	
O=[N+]([O-])c1ccccc1CN1CCC[C@@H]1c1ccc(Cl)cc1	23075526	KJNMFCAQFJZMMA-MRXNPFEDSA-N	316.788	4.585	5	20	DJBD	
C[C@H](N[C@H](C)c1ccc(Cl)s1)c1cccc([N+](=O)[O-])c1	37508484	CRKCOBHLYOIZLK-VHSXEESVSA-N	310.806	4.722	5	20	DJBD	
Cc1ccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c(C)c1	139784823	IDTWICIYJWNJBZ-UHFFFAOYSA-N	319.748	4.509	5	20	DJBD	
Cc1ccc(CN[C@@H](c2ccccc2)C(C)(C)C)cc1[N+](=O)[O-]	237751603	ZLZPNTTWSJARNP-SFHVURJKSA-N	312.413	4.780	5	20	DJBD	
Cc1ccccc1[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)C(C)C	467863679	MAIQEBKHUUHRIY-KXBFYZLASA-N	312.413	4.951	5	20	DJBD	
CC[C@@H](Nc1cc(F)c(OC)cc1C)c1cccc([N+](=O)[O-])c1	775562174	CFBMXVWHZJCXOV-OAHLLOKOSA-N	318.348	4.614	5	20	DJBD	
O=[N+]([O-])c1ccc(NCc2ccc(Cl)s2)c(Cl)c1	26727088	AGEYBMOEAOTJRN-UHFFFAOYSA-N	303.170	4.575	5	20	DJBD	
CSc1ccc([C@@H](C)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1	315640779	ZCITXCLBZQUDJC-QWHCGFSZSA-N	316.426	4.729	5	20	DJBD	
CC(=O)c1ccc2cc(Oc3ccccc3[N+](=O)[O-])ccc2c1	484815040	BWWZGOGUXLPQGF-UHFFFAOYSA-N	307.305	4.743	5	20	DJBD	
CCC(CC)SCc1coc(-c2ccc([N+](=O)[O-])cc2)n1	534056641	FGZKQKPCIZVSMP-UHFFFAOYSA-N	306.387	4.672	5	20	DJBD	
C[C@H](c1ccccc1[N+](=O)[O-])N1CC(C)(C)[C@H]1c1cccs1	561964948	WRHKQZPRXGGKMY-MLGOLLRUSA-N	316.426	4.800	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1	49159196	UVNXDXDXINMCTR-STQMWFEESA-N	304.415	4.685	5	20	DJBD	
Cc1ccc([C@H](C)NCc2ccc(F)c(Cl)c2)cc1[N+](=O)[O-]	122555192	PDCBGELPYMASLL-NSHDSACASA-N	322.767	4.547	5	20	DJBD	
O=[N+]([O-])c1ccc(SCc2cc(-c3ccccc3)no2)cc1	261466035	IDFPRVBLTSOGRO-UHFFFAOYSA-N	312.350	4.542	5	20	DJBD	
CC[C@H](NCc1ccc2occc2c1)c1cccc([N+](=O)[O-])c1	352758500	YYBLFYCPKLMQAE-KRWDZBQOSA-N	310.353	4.582	5	20	DJBD	
Cc1ccc(-c2csc(-c3ccc([N+](=O)[O-])cc3)n2)s1	71971757	JULGUJVBDHZROT-UHFFFAOYSA-N	302.380	4.755	5	20	DJBD	
Cc1cccc(-c2cccc(CNc3ccc([N+](=O)[O-])cn3)c2)c1	303118740	DYUFPKREMACOGJ-UHFFFAOYSA-N	319.364	4.577	5	20	DJBD	
CSc1ccc(C)c(N[C@H](C)c2cccc([N+](=O)[O-])c2)c1	553928937	HJUUJGVWAHINBB-GFCCVEGCSA-N	302.399	4.798	5	20	DJBD	
Cc1cccc(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1C	600849026	BVYMSUIEOPOMPG-UHFFFAOYSA-N	324.302	4.843	5	20	DJBD	
CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)c1ccsc1	872068964	KGQGUBLNFVCPKB-MNOVXSKESA-N	322.455	4.790	5	20	DJBD	
O=[N+]([O-])c1ccc(NC(=S)Nc2ccc3ccccc3c2)cc1	13799278	FXTWBUPPUULTAN-UHFFFAOYSA-N	323.377	4.557	5	20	DJBD	
O=[N+]([O-])c1cccc2nc(/C=C\c3c(F)cccc3F)ccc12	213646648	UPWGMSIDOWRYTM-CLFYSBASSA-N	312.275	4.592	5	20	DJBD	
CCCCOc1cccc(N[C@@H](C)c2ccccc2[N+](=O)[O-])c1	439561444	HZQIFIYORILJAK-AWEZNQCLSA-N	314.385	4.947	5	20	DJBD	
COc1ccccc1SCc1ccc(Cl)cc1[N+](=O)[O-]	522495089	QFNVGQBGASROCI-UHFFFAOYSA-N	309.774	4.549	5	20	DJBD	
COc1ccc(CS[C@@H](C)c2ccccc2F)cc1[N+](=O)[O-]	64376670	FISXGLRSEYXAHB-NSHDSACASA-N	321.373	4.737	5	20	DJBD	
Cc1ccc2c(c1)[C@H](Nc1ccc3cc([N+](=O)[O-])ccc3n1)CC2	609288472	ZDLHIUYSNJIJCZ-GOSISDBHSA-N	319.364	4.551	5	20	DJBD	
CC(C)[C@H](NCc1csc([N+](=O)[O-])c1)c1ccc(Cl)cc1	37562835	SKENEVLMEFPFCM-HNNXBMFYSA-N	324.833	4.797	5	20	DJBD	
CC(C)(NCc1cccc2ccccc12)c1ccccc1[N+](=O)[O-]	429224466	ARYPSIAPRMTDPR-UHFFFAOYSA-N	320.392	4.773	5	20	DJBD	
CCC(CC)(CC)NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1	525527866	QXJCNCWDSYXMFH-UHFFFAOYSA-N	320.414	4.508	5	20	DJBD	
C[C@@H](Nc1ccc([N+](=O)[O-])s1)c1nc(C(C)(C)C)cs1	1319389566	UXEONSIYSGWPRV-MRVPVSSYSA-N	311.432	4.583	5	20	DJBD	
O=C(Nc1cccc([N+](=O)[O-])c1)c1sccc1-c1ccccc1	15629287	SUZDXAZQBNCICU-UHFFFAOYSA-N	324.361	4.576	5	20	DJBD	
C[C@H](Nc1cccc(F)c1[N+](=O)[O-])c1cc2ccccc2o1	301074042	GDXAMTYAFQSRQC-JTQLQIEISA-N	300.289	4.653	5	20	DJBD	
Cc1c(CN[C@H](c2ccccc2)C2CCC2)cccc1[N+](=O)[O-]	532687821	DTHOXJQBYLBUHV-LJQANCHMSA-N	310.397	4.534	5	20	DJBD	
CCC[C@H](CC)NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1	609223355	JGWMHRXYYMDLQC-AWEZNQCLSA-N	302.374	4.523	5	20	DJBD	
O=[N+]([O-])c1c(Cl)cccc1OCc1cccc(C(F)F)c1	814774861	HPXSFYZYNATFEF-UHFFFAOYSA-N	313.687	4.765	5	20	DJBD	
CCCCOc1ccccc1NCc1ccc(C)c([N+](=O)[O-])c1	864025591	ZXGJVFANLYEFFX-UHFFFAOYSA-N	314.385	4.694	5	20	DJBD	
CSc1ccc([C@H](C)N[C@H](C)c2ccccc2[N+](=O)[O-])cc1	315381508	DLPMSQMQAHNZJF-QWHCGFSZSA-N	316.426	4.729	5	20	DJBD	
C[C@@H]1CC[C@H](N(C)C(=O)c2cc3ccccc3c3cccnc23)C1	464477293	DHFMBVIVBXDAMR-ZBFHGGJFSA-N	318.420	4.649	5	20	DJBD	
C[C@@H](NCc1c(F)cccc1[N+](=O)[O-])c1cccc2ccccc12	181664939	BWDRXRGNQDMYIR-CYBMUJFWSA-N	324.355	4.738	5	20	DJBD	
CCC(=O)c1ccc(NCc2ccc(Cl)s2)c([N+](=O)[O-])c1	479933642	VAJPPHFSAOPBKD-UHFFFAOYSA-N	324.789	4.515	5	20	DJBD	
CCOc1ccccc1[C@H](CC)Nc1ccccc1[N+](=O)[O-]	507028187	SWLLJMKJHIIVLU-AWEZNQCLSA-N	300.358	4.557	5	20	DJBD	
Cc1ccc2c(c1)CC[C@@H]2Nc1ccc([N+](=O)[O-])c2cnccc12	511698228	NMSNTZLQXKDSOX-KRWDZBQOSA-N	319.364	4.551	5	20	DJBD	
CCC[C@@H](C)CC(=O)N(c1cccc([N+](=O)[O-])c1)C1CCCC1	522873272	SKHQOUOBSUNHSN-CQSZACIVSA-N	318.417	4.697	5	20	DJBD	
C/C(=C/c1nc(-c2ccc([N+](=O)[O-])cc2C)no1)c1ccccc1	545695894	RXBVGRIHWYICOI-QXMHVHEDSA-N	321.336	4.514	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@H]1c1cccc(F)c1	611516419	SYWPLXHGVBLCFM-UGSOOPFHSA-N	314.360	4.550	5	20	DJBD	
C[C@H](SCCCOc1ccc([N+](=O)[O-])cc1)c1cccs1	737404955	KGRFUFGXRKXZRH-LBPRGKRZSA-N	323.439	4.920	5	20	DJBD	
C[C@@H](Sc1c(F)cc([N+](=O)[O-])cc1F)c1cccs1	749320570	ZCMFRGABFHOUKQ-SSDOTTSWSA-N	301.339	4.788	5	20	DJBD	
CC[C@](C)(NCc1ccc([N+](=O)[O-])c(Cl)c1)c1ccccc1	761526543	ORNWWMNVRZOBDY-KRWDZBQOSA-N	318.804	4.663	5	20	DJBD	
CC[C@@H](C)CCCCC(=O)Nc1c(F)ccc([N+](=O)[O-])c1C	800144550	WINMLUFWLCVKJA-LLVKDONJSA-N	310.369	4.587	5	20	DJBD	
O=[N+]([O-])c1c(F)cccc1N[C@@H]1CCSc2c(F)cccc21	301076640	HHERENNRNPIJFS-GFCCVEGCSA-N	322.336	4.522	5	20	DJBD	
C[C@H](N[C@H](C)c1ccc(C2CC2)cc1)c1ccccc1[N+](=O)[O-]	417356292	PASRIKHKZBNJRX-KGLIPLIRSA-N	310.397	4.884	5	20	DJBD	
CCC[C@@H](CC)SCCC(=O)Nc1ccc([N+](=O)[O-])cc1C	477065429	CZTRUXGJJMEGQC-CQSZACIVSA-N	324.446	4.544	5	20	DJBD	
Cc1c([C@H](C)N[C@@H]2CCCc3ccccc32)cccc1[N+](=O)[O-]	531677925	XYJCASMELPHVIK-KBXCAEBGSA-N	310.397	4.631	5	20	DJBD	
C[C@@H](SCc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F	609238096	TUYPZCZYGYHAMZ-SNVBAGLBSA-N	309.337	4.867	5	20	DJBD	
CCC(C)(C)C(=O)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-]	726860022	WMCPUEYBIGTCJE-UHFFFAOYSA-N	313.353	4.603	5	20	DJBD	
Cc1cc(Oc2ccc3c(c2)[nH]c2ccccc23)ncc1[N+](=O)[O-]	746389554	MEWLGYSUFYEIQG-UHFFFAOYSA-N	319.320	4.725	5	20	DJBD	
CCC[C@@H](C)c1noc([C@H](C)Sc2ccc([N+](=O)[O-])cc2)n1	761842161	ITAIYJRIVVAGSK-MNOVXSKESA-N	321.402	4.735	5	20	DJBD	
CC1(C)CN(Cc2c3ccccc3cc3ccccc23)CC[C@H]1O	783728789	JKNKJZYBIMEVEP-OAQYLSRUSA-N	319.448	4.586	5	20	DJBD	
CSc1ccccc1[C@@H](C)Nc1cccc(F)c1[N+](=O)[O-]	799966969	OXJCGIMJDMUOIZ-SNVBAGLBSA-N	306.362	4.629	5	20	DJBD	
CC(C)Oc1ccccc1[C@H](C)Nc1cccc(F)c1[N+](=O)[O-]	919963855	MLBXSPSYWZDODH-LBPRGKRZSA-N	318.348	4.694	5	20	DJBD	
CCOCc1cccc(N[C@@H](CC)c2cccc([N+](=O)[O-])c2)c1	182952740	FUQATBPNSYJHCA-SFHVURJKSA-N	314.385	4.695	5	20	DJBD	
Cc1cc([C@H](C)Nc2ccc([N+](=O)[O-])c3cccnc23)c(C)o1	301088353	FFQOPNRJAAUSSX-NSHDSACASA-N	311.341	4.526	5	20	DJBD	
Cc1ccc([C@H](C)N(C)c2ccc([N+](=O)[O-])c3cnccc23)cc1	303545378	IPCILTGOCXSAKP-AWEZNQCLSA-N	321.380	4.649	5	20	DJBD	
Cc1c(N[C@@H](C)c2ccccc2[N+](=O)[O-])cccc1-c1ncco1	427458960	OVAOEZLDKZOGDI-ZDUSSCGKSA-N	323.352	4.731	5	20	DJBD	
Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccc(C(C)C)s1	546859471	LLUOFHFVEXBANC-UHFFFAOYSA-N	318.398	4.649	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)c(CN2CCC[C@@H]2c2cccs2)c1	735493512	ZWLOGIXXRXJOOF-CQSZACIVSA-N	322.817	4.647	5	20	DJBD	
C[C@@H](SCCOc1cccc([N+](=O)[O-])c1)c1cccs1	737403503	CHDRRRDCABYCTR-LLVKDONJSA-N	309.412	4.530	5	20	DJBD	
Cc1cccc([C@@H](C)NCc2ccc([N+](=O)[O-])c(Cl)c2)c1C	783627445	VACYQVSKBWFODI-CYBMUJFWSA-N	318.804	4.716	5	20	DJBD	
CCCCC[C@H](CC)C(=O)Nc1c(F)ccc([N+](=O)[O-])c1C	800143695	DOPJYAPEVHUHBC-LBPRGKRZSA-N	310.369	4.587	5	20	DJBD	
C[C@@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc(-c2ccccc2)o1	89513223	LSAWCYGPXYLKHI-CQSZACIVSA-N	322.364	4.706	5	20	DJBD	
CCC(CC)n1ccc(CSCc2ccc([N+](=O)[O-])cc2)n1	513814622	COSPNSJSTHPTRA-UHFFFAOYSA-N	319.430	4.586	5	20	DJBD	
Cc1ccc2c(c1)CC[C@H]2N[C@H](C)c1cc([N+](=O)[O-])ccc1C	539042155	VWDQSIKVVRPIQH-AUUYWEPGSA-N	310.397	4.550	5	20	DJBD	
CC(=O)c1cc(N[C@H](C)c2c(C)cccc2C)ccc1[N+](=O)[O-]	575080575	UEPMOEKYFWWMGV-CYBMUJFWSA-N	312.369	4.587	5	20	DJBD	
O=[N+]([O-])c1ccc(N[C@H]2CCSc3c(F)cccc32)c(F)c1	301102963	UMZWFTVQAJCBMG-ZDUSSCGKSA-N	322.336	4.522	5	20	DJBD	
Cc1nc2ccc(N[C@H](C)c3ccccc3[N+](=O)[O-])cc2s1	315397548	GAMCMEKYAYDPPQ-SNVBAGLBSA-N	313.382	4.686	5	20	DJBD	
Cc1ccc(-c2ncc(/C=C\c3ccc([N+](=O)[O-])cn3)s2)cc1	439528404	QOBVNHWGFDZONM-CLFYSBASSA-N	323.377	4.592	5	20	DJBD	
COCCCC[C@@H](Nc1ccc([N+](=O)[O-])cc1)c1ccccc1	480574117	CSMZHPNEMIPMPO-GOSISDBHSA-N	314.385	4.565	5	20	DJBD	
CCN(Cc1cccc([N+](=O)[O-])c1C)[C@H](C)c1ccc(F)cc1	507719516	SVMQYIQAJUSLON-CQSZACIVSA-N	316.376	4.625	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)Nc1ccccc1OC(F)F	554354762	IGPJOLQMXUSTAR-NSHDSACASA-N	322.311	4.678	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1CNc1ccc(Cl)c(F)c1	50443706	ZNUZAHOQQFTZIB-UHFFFAOYSA-N	315.131	4.653	5	20	DJBD	
C[C@@H](SCCOc1cccc(F)c1)c1ccccc1[N+](=O)[O-]	437264718	FYWSGUVWJYMMIN-GFCCVEGCSA-N	321.373	4.607	5	20	DJBD	
Cc1c([C@@H](C)N[C@@H](C)c2c(F)cccc2F)cccc1[N+](=O)[O-]	480911208	OZAVNNCNPYNGCF-NEPJUHHUSA-N	320.339	4.593	5	20	DJBD	
CCc1ccc(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1	600849816	HAQDSJDQRHGFPJ-UHFFFAOYSA-N	324.302	4.788	5	20	DJBD	
Cc1cc(SCc2cccc3ccccc23)ncc1[N+](=O)[O-]	610430850	AGDPBEGABOFMMI-UHFFFAOYSA-N	310.378	4.744	5	20	DJBD	
COc1ccc2cc(N[C@@H](C)c3ccccc3[N+](=O)[O-])ccc2c1	795325866	PVOWAXBCLDLPTQ-ZDUSSCGKSA-N	322.364	4.930	5	20	DJBD	
CC(/C=C\c1nc2ccccc2o1)=C\c1cccc([N+](=O)[O-])c1	469111181	WLQMTZQBJIPBTG-AZQRDTPRSA-N	306.321	4.853	5	20	DJBD	
C/C(=C\c1cccc([N+](=O)[O-])c1)CNc1cccc2cc[nH]c12	527302888	NEFQUSOUIDMHHK-JLHYYAGUSA-N	307.353	4.592	5	20	DJBD	
C[C@H](N[C@H]1c2ccccc2CC[C@H]1C)c1cccc([N+](=O)[O-])c1	541846872	DXUSZBBZJDREQW-BIENJYKASA-N	310.397	4.569	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2C)s1	765303216	FMGHXPZMQFGPSE-CHWSQXEVSA-N	304.415	4.685	5	20	DJBD	
O=[N+]([O-])c1ccc2nc(Oc3cccc(Cl)c3)sc2c1	111194427	XNZASBDRKATWHT-UHFFFAOYSA-N	306.730	4.650	5	20	DJBD	
C[C@H](N[C@H](C)c1cccc(C2CC2)c1)c1cccc([N+](=O)[O-])c1	550620376	ZWQWLNIWSXNHNG-KGLIPLIRSA-N	310.397	4.884	5	20	DJBD	
CC(C)c1cccc(Oc2ncnc3sc([N+](=O)[O-])cc23)c1	568674651	KMOBXALTEXRHTL-UHFFFAOYSA-N	315.354	4.515	5	20	DJBD	
C[C@H](NCc1ccc2sccc2c1)c1ccc([N+](=O)[O-])cc1	577564344	AZJCMZURLZRKFB-LBPRGKRZSA-N	312.394	4.660	5	20	DJBD	
CC(C)(C)OCc1ccccc1NCc1csc([N+](=O)[O-])c1	902218363	LRZSXNSCERRZKX-UHFFFAOYSA-N	320.414	4.584	5	20	DJBD	
O=[N+]([O-])c1cccc2ccc(/C=C/c3ccc(F)c(F)c3)nc12	36739935	LNCUSEJHTJODGF-QPJJXVBHSA-N	312.275	4.592	5	20	DJBD	
C[C@@H](N[C@H](C)c1c(F)cccc1Cl)c1cccc([N+](=O)[O-])c1	90180323	IQNVDGSVTOIGBY-GHMZBOCLSA-N	322.767	4.799	5	20	DJBD	
Cc1c([C@H](C)NCc2ccccc2[N+](=O)[O-])oc2ccccc12	120082293	KOMJXHSTBYCLRV-ZDUSSCGKSA-N	310.353	4.500	5	20	DJBD	
COc1ccc2cc(CNc3ccc([N+](=O)[O-])c(C)c3)ccc2c1	324646341	YNATYHIRPFJOOD-UHFFFAOYSA-N	322.364	4.677	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H](CC(F)(F)F)C(C)C)cc1[N+](=O)[O-]	437098966	YAZXBMRTBWPASX-YPMHNXCESA-N	318.339	4.531	5	20	DJBD	
C[C@H](Sc1ncccc1[N+](=O)[O-])c1cccc(Cl)c1F	478910496	KWYKXDNBNIMPBR-QMMMGPOBSA-N	312.753	4.636	5	20	DJBD	
O=[N+]([O-])c1ccc(CN[C@@H](c2cccs2)C2CC2)c(Cl)c1	544349643	IOORNSKQLKOWAJ-OAHLLOKOSA-N	322.817	4.551	5	20	DJBD	
O=[N+]([O-])c1ccc(-c2nc(CSc3cccs3)co2)cc1	89684440	ZPAFHKOEEVWAPK-UHFFFAOYSA-N	318.379	4.604	5	20	DJBD	
CCc1ccc([C@@H](NCc2csc([N+](=O)[O-])c2)C(C)C)cc1	236968180	MSAGQTASSHIDEZ-KRWDZBQOSA-N	318.442	4.706	5	20	DJBD	
Cc1cccc2c1CC[C@@H]2N[C@H](C)c1cccc([N+](=O)[O-])c1C	540178956	JXBLUGCIXLKXEX-KDOFPFPSSA-N	310.397	4.550	5	20	DJBD	
CC(C)Oc1ccccc1[C@@H](C)Nc1ccc(F)cc1[N+](=O)[O-]	603861892	FEJICLUDOOTGJL-GFCCVEGCSA-N	318.348	4.694	5	20	DJBD	
O=[N+]([O-])c1ccccc1NC(c1ccccc1)c1ccccc1	8177680	FRCABCLMWCRKCK-UHFFFAOYSA-N	304.349	4.796	5	20	DJBD	
Cc1cc([C@@H](C)Nc2ccc3ncccc3c2[N+](=O)[O-])c(C)o1	320812998	LSADXCHREOYDPE-LLVKDONJSA-N	311.341	4.526	5	20	DJBD	
C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC(c2ccccc2)CC1	441194212	YVORUXICSBZZDH-HNNXBMFYSA-N	310.397	4.535	5	20	DJBD	
CC(=O)c1cc(N[C@@H]2CCCc3ccc(C)cc32)ccc1[N+](=O)[O-]	488767870	LEOCRITWYPOYIA-GOSISDBHSA-N	324.380	4.595	5	20	DJBD	
CC(C)Oc1cccc([C@H](C)Nc2ccsc2[N+](=O)[O-])c1	63262422	JALFGBVRBAGIHH-NSHDSACASA-N	306.387	4.617	5	20	DJBD	
Cc1ccccc1[C@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)C1CC1	532510981	BFVFHSIOPRKZKE-IFXJQAMLSA-N	310.397	4.705	5	20	DJBD	
C[C@H](Nc1cccc2ccccc12)c1ccc(N)c([N+](=O)[O-])c1	815610695	RFLHRJFDFXLHPP-LBPRGKRZSA-N	307.353	4.503	5	20	DJBD	
Cc1cc(N[C@H]2CCSc3ccccc32)ccc1[N+](=O)[O-]	42247772	JRVCZRNEWQPPII-AWEZNQCLSA-N	300.383	4.552	5	20	DJBD	
C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H]1c1ccsc1	72577798	VYRFGVXJMFLYME-IUODEOHRSA-N	302.399	4.554	5	20	DJBD	
O=[N+]([O-])c1ccc(CNc2cccc(C3CCC3)c2)c(F)c1	462867115	RRRBQFRWOFHEEP-UHFFFAOYSA-N	300.333	4.614	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N(C)Cc1cccc2[nH]ccc12	494000175	OTPYVPAZAKHCJW-CQSZACIVSA-N	323.396	4.578	5	20	DJBD	
O=[N+]([O-])c1ccc2nc(Oc3ccc(Cl)cc3)sc2c1	731205835	OJNOACSOCMYDJR-UHFFFAOYSA-N	306.730	4.650	5	20	DJBD	
CCSc1cccc(F)c1NCc1ccc(C)c([N+](=O)[O-])c1	864013615	YOMJGXVFNFPHJE-UHFFFAOYSA-N	320.389	4.766	5	20	DJBD	
CC[C@H](NCc1ccc(C)c([N+](=O)[O-])c1)c1cccc(Cl)c1	236934163	DHTKJWQZVGEOGX-INIZCTEOSA-N	318.804	4.798	5	20	DJBD	
Cc1ccccc1C1(N[C@H](C)c2cccc([N+](=O)[O-])c2C)CC1	592391814	MPNVBBJIBRGFQH-OAHLLOKOSA-N	310.397	4.552	5	20	DJBD	
CCC(CC)(CC)SCC(=O)Nc1cc([N+](=O)[O-])ccc1C	762971733	STMFHGZQNGDQCG-UHFFFAOYSA-N	324.446	4.544	5	20	DJBD	
O=[N+]([O-])c1cccc(-c2nnc(-c3ccc(C4CCC4)cc3)o2)c1	1257792025	PGIMQSAUNSEHKX-UHFFFAOYSA-N	321.336	4.579	5	20	DJBD	
Cc1ccc(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)cc1	562675	FARHZRJMLNOGFX-UHFFFAOYSA-N	308.337	4.775	5	20	DJBD	
O=[N+]([O-])c1cc(NCc2ccc(Cl)cc2Cl)ccc1F	35047059	DETKUTOTTMHYLI-UHFFFAOYSA-N	315.131	4.653	5	20	DJBD	
Cc1ccc(N[C@@H](C)c2ccccc2[N+](=O)[O-])cc1OC(F)F	525756735	WRGJGKHKQQDHOV-NSHDSACASA-N	322.311	4.678	5	20	DJBD	
CC(C)OCc1cccc(N[C@H](C)c2ccccc2[N+](=O)[O-])c1	525761191	BONUIOTXJDOOOE-CQSZACIVSA-N	314.385	4.693	5	20	DJBD	
O=[N+]([O-])c1ccc(Sc2ccc(F)cc2F)c2ccncc12	18058977	KGEDMKGNSMWPMI-UHFFFAOYSA-N	318.304	4.572	5	20	DJBD	
O=[N+]([O-])c1cc(C(F)(F)F)ccc1SCCC(F)(F)F	480777432	UMSLFKWZBLVMDT-UHFFFAOYSA-N	319.226	4.658	5	20	DJBD	
CCc1ccc([C@@H](C)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1	536911355	VDOXPSDTLXNVSO-CHWSQXEVSA-N	318.442	4.939	5	20	DJBD	
CC(=O)c1cc(N[C@@H]2CC(C)(C)c3ccccc32)ccc1[N+](=O)[O-]	569914258	CFDMMXCHRMAODR-QGZVFWFLSA-N	324.380	4.632	5	20	DJBD	
CCCCc1nc(CSCc2cccc([N+](=O)[O-])c2)cs1	195594625	VRPZIZFWNSLBJW-UHFFFAOYSA-N	322.455	4.827	5	20	DJBD	
Cc1nc(N[C@H](C)c2oc3ccccc3c2C)ccc1[N+](=O)[O-]	301670535	YSQQKVYRDANHRY-GFCCVEGCSA-N	311.341	4.526	5	20	DJBD	
Cc1cc(CNC(C)(C)c2ccc([N+](=O)[O-])cc2)ccc1Cl	503550809	IWXOZBWMGAAEGJ-UHFFFAOYSA-N	318.804	4.582	5	20	DJBD	
C[C@H](Nc1ncc([N+](=O)[O-])s1)c1ccc(F)c2ccccc12	574717797	HFQRPIKIAQLOQQ-VIFPVBQESA-N	317.345	4.517	5	20	DJBD	
CCC[C@H](Nc1ccc(SC)cn1)c1cccc([N+](=O)[O-])c1	579101738	INODFQOJCVOOSG-HNNXBMFYSA-N	317.414	4.665	5	20	DJBD	
O=[N+]([O-])c1cc(C(F)F)ccc1N1Cc2cccc(Cl)c2C1	864018181	OHWBSQLQCWDOCN-UHFFFAOYSA-N	324.714	4.706	5	20	DJBD	
CC[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F	160789842	RWDXQCCZRYWLAA-DIFFPNOSSA-N	320.339	4.675	5	20	DJBD	
Cc1ccc(N[C@H](C)c2ccccc2[N+](=O)[O-])cc1OC(F)F	525756734	WRGJGKHKQQDHOV-LLVKDONJSA-N	322.311	4.678	5	20	DJBD	
O=[N+]([O-])c1ccc(SCc2csc(-c3ccoc3)n2)cc1	108419887	QOPODRWKFDQNRF-UHFFFAOYSA-N	318.379	4.604	5	20	DJBD	
Cc1ccc(/C=C(/c2ccncc2)c2ccc([N+](=O)[O-])cc2)s1	215737352	XFFQHXOVTSMVNN-LDADJPATSA-N	322.389	4.949	5	20	DJBD	
O=[N+]([O-])c1ccc(CNc2ccccc2-c2ccccc2)cc1	319773533	FKWVCBGLOSDAHS-UHFFFAOYSA-N	304.349	4.874	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1C	538020600	HCTZGVYVTBKXPO-CVEARBPZSA-N	312.413	4.932	5	20	DJBD	
O=[N+]([O-])c1cccc(F)c1Oc1cncc(-c2ccccc2)c1	566534466	CUPVQTXBQQUGCA-UHFFFAOYSA-N	310.284	4.588	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2ccc(-c3cscn3)cc2)c(F)c1	610515880	CJMNTNUKJYELOW-UHFFFAOYSA-N	316.313	4.650	5	20	DJBD	
O=[N+]([O-])c1ccc(CNCc2ccccc2-c2ccccc2)cc1	917395236	HPFIBCWSPQSGEK-UHFFFAOYSA-N	318.376	4.552	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2ccc(Cl)cc2F)c2ccncc12	301066130	PNTNBMVFTDIEFU-UHFFFAOYSA-N	318.691	4.728	5	20	DJBD	
CN(CC1CCCC1)C(=O)c1cc2ccccc2c2cccnc12	521178876	MEPSUUGFYWQQLL-UHFFFAOYSA-N	318.420	4.650	5	20	DJBD	
Cc1cccc([C@@H](NCc2ccccc2[N+](=O)[O-])C(C)(C)C)c1	521479841	IPYAFMVSOWZUKE-GOSISDBHSA-N	312.413	4.780	5	20	DJBD	
C[C@H](N[C@H](C)c1ccccc1[N+](=O)[O-])c1cc2ccccc2o1	122079678	UTLLVNHIFWUXEC-OLZOCXBDSA-N	310.353	4.753	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)c1	321698765	ZQXMBMWHRFSAAE-HZPDHXFCSA-N	312.413	4.932	5	20	DJBD	
C[C@@H]1C[C@@H]1[C@@H](Nc1ncc([N+](=O)[O-])s1)c1ccc(Cl)cc1	443523515	PITPPKWEPVJREV-WLTAIBSBSA-N	323.805	4.514	5	20	DJBD	
CCC(=O)c1ccc(Oc2cc(C)c([N+](=O)[O-])cc2F)c(F)c1	461959017	OILZIGGFORYLPN-UHFFFAOYSA-N	321.279	4.566	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)c1c(F)cccc1F	492727977	LZROMRSMSPZYOA-NWDGAFQWSA-N	320.339	4.593	5	20	DJBD	
CCCCS[C@H](C)c1nc(-c2ccc([N+](=O)[O-])cc2C)no1	544784713	GWHRBPFCMXSIRR-LLVKDONJSA-N	321.402	4.548	5	20	DJBD	
C[C@H](N[C@@H]1CCc2c(Cl)cccc21)c1ccc([N+](=O)[O-])cc1	178649450	LKYHVBIAYCVJQX-APPDUMDISA-N	316.788	4.586	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H](C)c2cccc(Cl)c2)cc1[N+](=O)[O-]	219863613	QQJBKTFDFCWNPS-QWHCGFSZSA-N	318.804	4.968	5	20	DJBD	
Cc1cc(C)c([C@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)c(C)c1	321939921	DXEMBHAUHCRPSC-CVEARBPZSA-N	312.413	4.932	5	20	DJBD	
Cc1cnc(SCc2nc3ccccc3c3ccccc23)nc1	520687475	OODMISNSKYQTEP-UHFFFAOYSA-N	317.417	4.779	5	20	DJBD	
O=[N+]([O-])c1ncccc1Oc1cc(Cl)c(Cl)cc1Cl	603836584	JCVLCUJNOSFEQV-UHFFFAOYSA-N	319.531	4.742	5	20	DJBD	
CCOc1cc(N[C@@H]2CCCc3sccc32)ccc1[N+](=O)[O-]	301201388	QJLSINJFXSJGBE-CYBMUJFWSA-N	318.398	4.545	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)c(Oc2ccc(Cl)nc2)c(Cl)c1	302264092	DXBBKDTXCRWPHB-UHFFFAOYSA-N	319.531	4.742	5	20	DJBD	
C[C@@H](Sc1ncccc1[N+](=O)[O-])c1cccc2ccccc12	65692353	BXEQGCSJPUTOQF-GFCCVEGCSA-N	310.378	4.996	5	20	DJBD	
Cc1ccc2c(c1)CC[C@H]2Nc1ccc2ncccc2c1[N+](=O)[O-]	511710967	BOOUXBZRGYKPOM-QGZVFWFLSA-N	319.364	4.551	5	20	DJBD	
Cc1cc(C)cc([C@H](C)NCc2cc(Cl)ccc2[N+](=O)[O-])c1	775387183	KALCHYMERHWCDO-ZDUSSCGKSA-N	318.804	4.716	5	20	DJBD	
c1cncc(-c2nnc(-c3cc4ccccc4c4cccnc34)o2)c1	1118086163	PPUSOWJPSQHHQX-UHFFFAOYSA-N	324.343	4.500	5	20	DJBD	
C[C@@H](Nc1ccccc1[N+](=O)[O-])c1ccc(C(F)(F)F)cc1	220300318	MOJVAHIQIGLWOA-SNVBAGLBSA-N	310.275	4.787	5	20	DJBD	
Cc1ccc([C@H]2CCCCCN2Cc2cccc([N+](=O)[O-])c2)o1	303756259	NCYZZZFNOWJICV-QGZVFWFLSA-N	314.385	4.614	5	20	DJBD	
C[C@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(F)cc1Cl	451108677	SZERNBNIHYKDOD-QWRGUYRKSA-N	322.767	4.799	5	20	DJBD	
CSc1cccc(C)c1NCc1c(F)cc([N+](=O)[O-])cc1F	506259375	OUNHWMUZXDBVJB-UHFFFAOYSA-N	324.352	4.515	5	20	DJBD	
Cc1cccc([C@@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2C)c1C	531711319	OROCDDDYXIRKPD-HZPDHXFCSA-N	312.413	4.932	5	20	DJBD	
Cc1cc2cc([C@@H](C)NCc3ccc([N+](=O)[O-])cc3)oc2cc1C	537991899	QHTZARDGYQXDJP-CQSZACIVSA-N	324.380	4.809	5	20	DJBD	
CCc1ccc([C@@H](C)NCc2cc([N+](=O)[O-])ccc2Cl)s1	773041620	ROEFTCPGLGJKBA-SNVBAGLBSA-N	324.833	4.723	5	20	DJBD	
CCC[C@@H](NCc1ccc(Cl)s1)c1cccc([N+](=O)[O-])c1	71307605	CSEYKKPQLWTVNI-CQSZACIVSA-N	324.833	4.941	5	20	DJBD	
O=[N+]([O-])c1sccc1N1Cc2ccccc2-c2ccccc2C1	608788482	PJABEGZUPRUZNN-UHFFFAOYSA-N	322.389	4.844	5	20	DJBD	
C[C@@H](Sc1ccc([N+](=O)[O-])cc1F)c1c(F)cccc1F	63267131	SNAFJHAWBKBCNZ-MRVPVSSYSA-N	313.300	4.865	5	20	DJBD	
O=[N+]([O-])c1ccc2oc(/C(Cl)=C/c3ccccc3F)nc2c1	83536658	DSJLMWJVQXBFAW-XFFZJAGNSA-N	318.691	4.612	5	20	DJBD	
CCCc1cccc(C(C)C)c1NC(=O)c1ccc([N+](=O)[O-])o1	191555944	HISPZNFIDSCCJO-UHFFFAOYSA-N	316.357	4.516	5	20	DJBD	
CC[C@](C)(NCc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1	730817784	VMAUCUARQXGVAN-KRWDZBQOSA-N	318.804	4.663	5	20	DJBD	
CC(=O)c1ccc(Sc2ccccc2Cl)c([N+](=O)[O-])c1	8148742	NWJBUYIAHCYOIF-UHFFFAOYSA-N	307.758	4.602	5	20	DJBD	
Cc1ccc(CN(Cc2cccc([N+](=O)[O-])c2C)C(C)C)s1	65162669	REAIGHYICIRVNA-UHFFFAOYSA-N	318.442	4.684	5	20	DJBD	
O=[N+]([O-])c1ccc2c(c1)[C@@H](NCc1cc3ccccc3o1)CCC2	192718563	PGADOWHEDPFNPJ-SFHVURJKSA-N	322.364	4.508	5	20	DJBD	
O=[N+]([O-])c1ccc(N[C@H](c2ccc(Cl)cc2)C2CCC2)nc1	303150785	CPKYASFZKUAPIZ-INIZCTEOSA-N	317.776	4.597	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2cccc(NCCCCF)c2)cc1	506308505	KACSBXKWENEZLR-UHFFFAOYSA-N	304.321	4.549	5	20	DJBD	
C[C@@H](N[C@H](C)c1nccc2ccccc12)c1cccc([N+](=O)[O-])c1	562082645	SNJDSUWZWXJHPC-ZIAGYGMSSA-N	321.380	4.555	5	20	DJBD	
CC(=O)c1ccc(N[C@@H](C)c2ccccc2Cl)c([N+](=O)[O-])c1	8054107	HZPGVEPJOFUUTL-JTQLQIEISA-N	318.760	4.624	5	20	DJBD	
CC(=O)c1ccc(Sc2ccc(C)c(C)c2)c([N+](=O)[O-])c1	15164383	DTMVBHZTDKOPBH-UHFFFAOYSA-N	301.367	4.565	5	20	DJBD	
Cc1cc([C@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc(C)c1F	536807219	RQOZZYHECDKSNL-KBPBESRZSA-N	316.376	4.763	5	20	DJBD	
Cc1ccc2ccccc2c1CN[C@@H](C)c1cccc([N+](=O)[O-])c1	540377623	RAOALEMRVQTILG-HNNXBMFYSA-N	320.392	4.907	5	20	DJBD	
C[C@@H](N[C@@H](CC(F)F)c1ccccc1)c1cccc([N+](=O)[O-])c1	421877905	MPNFRWHHWOKZSX-WBMJQRKESA-N	320.339	4.642	5	20	DJBD	
CCSc1cccc(CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1	426333736	JCHDERMUYAMESU-ZDUSSCGKSA-N	316.426	4.558	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1CN(C1CCCCC1)C1CC1	609705260	MZLJOWYWVQHWCF-UHFFFAOYSA-N	308.809	4.545	5	20	DJBD	
CC[C@H](NCc1c(F)cccc1[N+](=O)[O-])c1cccc(Cl)c1	611378459	RHPUDJBCVNGSGU-HNNXBMFYSA-N	322.767	4.628	5	20	DJBD	
CC(C)[C@H](C)SCc1coc(-c2ccc([N+](=O)[O-])cc2)n1	534057720	QRISIQGHHNBTSX-NSHDSACASA-N	306.387	4.528	5	20	DJBD	
O=[N+]([O-])c1ccc(/C=C\Sc2nc(-c3ccccc3)co2)o1	789981642	ASOFBWHBSXDCHU-HJWRWDBZSA-N	314.322	4.606	5	20	DJBD	
O=[N+]([O-])c1ccc(/C=C/Sc2nc3cc(Cl)ccc3o2)o1	825206701	SPCZTVSABROBKA-AATRIKPKSA-N	322.729	4.745	5	20	DJBD	
C[C@H](NC1(c2cccc(Cl)c2)CC1)c1cccc([N+](=O)[O-])c1	173439246	JOODFXCTJMBBMC-LBPRGKRZSA-N	316.788	4.588	5	20	DJBD	
CCC(C)(C)c1ccc(NC(=O)c2ccccc2[N+](=O)[O-])cc1	469052718	RIVUXVRKHMUPIH-UHFFFAOYSA-N	312.369	4.535	5	20	DJBD	
CCCCCC[C@H](C)CC(=O)N(C)Cc1ccccc1[N+](=O)[O-]	727664107	NRANLGFLIWCKCF-HNNXBMFYSA-N	320.433	4.550	5	20	DJBD	
C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H]1c1cccs1	72556888	QGAYVQXWCDQSCT-SWLSCSKDSA-N	302.399	4.554	5	20	DJBD	
Cc1cc(C)c([C@@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c(C)c1	321939935	DXEMBHAUHCRPSC-JKSUJKDBSA-N	312.413	4.932	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H]2C[C@H](c3ccccc3)C2)cc1[N+](=O)[O-]	436292210	MPLQOIFUPCNGOW-WBAXXEDZSA-N	310.397	4.500	5	20	DJBD	
Cc1c(NCc2csc(C3CCCC3)n2)cccc1[N+](=O)[O-]	444418828	LVSTUGFTQRIVIA-UHFFFAOYSA-N	317.414	4.629	5	20	DJBD	
CC[C@@](C)(NCc1ccc([N+](=O)[O-])c(Cl)c1)c1ccccc1	761526545	ORNWWMNVRZOBDY-QGZVFWFLSA-N	318.804	4.663	5	20	DJBD	
O=[N+]([O-])c1ccc(CNCc2cc(-c3ccccc3)cs2)cc1	77290354	WUOGUELHQAOSDK-UHFFFAOYSA-N	324.405	4.613	5	20	DJBD	
Cc1ccc(N[C@@H](C)c2ncc(-c3ccccc3)o2)c([N+](=O)[O-])c1	301806305	FETVJHFEVRVBAO-ZDUSSCGKSA-N	323.352	4.731	5	20	DJBD	
CCCCOc1cccc(NCc2cccc([N+](=O)[O-])c2C)c1	462233651	DXKSRXLFWRQYOZ-UHFFFAOYSA-N	314.385	4.694	5	20	DJBD	
CC(C)c1nc(CSc2ccc([N+](=O)[O-])cc2F)cs1	613527021	SIIUHKDZXRJJMO-UHFFFAOYSA-N	312.391	4.606	5	20	DJBD	
O=[N+]([O-])c1cc(CN2CCC[C@H]2c2cccs2)ccc1Cl	761245906	KJYKLTOYIPJYOU-ZDUSSCGKSA-N	322.817	4.647	5	20	DJBD	
C[C@@H](Sc1ccc([N+](=O)[O-])cc1)c1nc2ccccc2o1	183454526	PVZQCZUDMBPLHE-SNVBAGLBSA-N	300.339	4.589	5	20	DJBD	
CCC[C@H](Nc1ccc(F)c(OC)c1)c1cccc([N+](=O)[O-])c1	323626235	DORFDOOYHQRMFY-INIZCTEOSA-N	318.348	4.696	5	20	DJBD	
CC(C)N(CCCCC(F)(F)F)Cc1ccc([N+](=O)[O-])cc1	443627530	QGCSAKPEMGHYHH-UHFFFAOYSA-N	318.339	4.538	5	20	DJBD	
Cc1ccc([C@@H]2CCCN2Cc2cccc([N+](=O)[O-])c2C)cc1	514245413	XJQNSZCYYINKSY-IBGZPJMESA-N	310.397	4.549	5	20	DJBD	
CSc1cccc(N[C@H](C)c2ccc([N+](=O)[O-])cc2)c1C	539680629	PUYRXYWYISZVAW-GFCCVEGCSA-N	302.399	4.798	5	20	DJBD	
Cc1ccc(-c2ccc([C@H](N)CC(F)(F)F)cc2)cc1[N+](=O)[O-]	600792145	WNUYCQYZGHDCQM-CQSZACIVSA-N	324.302	4.522	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H](C)c2cccc(Cl)c2)cc1[N+](=O)[O-]	219863663	QQJBKTFDFCWNPS-STQMWFEESA-N	318.804	4.968	5	20	DJBD	
Cc1ccc(C)c(NCc2cc([N+](=O)[O-])ccc2OC(C)C)c1	462211002	MMNPDHNQZMRHPP-UHFFFAOYSA-N	314.385	4.611	5	20	DJBD	
Cc1ccc2c(c1)[C@@H](Nc1ccc([N+](=O)[O-])c3cccnc13)CC2	609288196	GSDSGHVTTQCUEK-INIZCTEOSA-N	319.364	4.551	5	20	DJBD	
CCc1c([C@H](C)NCc2ccccc2[N+](=O)[O-])oc2ccccc12	324288473	RFPUWOZLJBVRTI-ZDUSSCGKSA-N	324.380	4.754	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H]1CCCc2ccccc21	532442734	URIJFDGNIZUSGY-KUHUBIRLSA-N	310.397	4.631	5	20	DJBD	
Cc1cc([C@H](C)NCc2cccc([N+](=O)[O-])c2C)cc(C)c1F	553010404	HWHDMVLYAKZDLE-AWEZNQCLSA-N	316.376	4.510	5	20	DJBD	
CC(=O)c1cc(NCc2cccc(C(C)C)c2)ccc1[N+](=O)[O-]	561305514	VBEYXEGSAIXXJR-UHFFFAOYSA-N	312.369	4.533	5	20	DJBD	
Cc1c([C@@H](C)NCc2cccc(Cl)c2F)cccc1[N+](=O)[O-]	1319766860	PIABOSRIWXWORE-LLVKDONJSA-N	322.767	4.547	5	20	DJBD	
Cc1ccc([C@H](C)Nc2ccc3ccn(C)c3c2)cc1[N+](=O)[O-]	443091714	IEULPMQMFLDWIS-ZDUSSCGKSA-N	309.369	4.568	5	20	DJBD	
CCC[C@H](NCc1ccc(F)c(C)c1)c1cccc([N+](=O)[O-])c1	480255342	BPIHLTBYWOXPLU-SFHVURJKSA-N	316.376	4.673	5	20	DJBD	
C[C@@H](N[C@H]1CC(C)(C)c2ccccc21)c1cccc([N+](=O)[O-])c1	540117286	BYNXWZZMRXESAJ-ACJLOTCBSA-N	310.397	4.668	5	20	DJBD	
O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CC=CCC3)s2)cc1	609902191	CLZTULORLIHIJT-AWEZNQCLSA-N	314.410	4.522	5	20	DJBD	
Cc1ccc(C2=CCN([C@@H](C)c3ccccc3[N+](=O)[O-])CC2)cc1	743836366	UYDLILPJACIEDS-INIZCTEOSA-N	322.408	4.754	5	20	DJBD	
O=[N+]([O-])c1c(F)cccc1NCc1csc2ccccc12	919963965	YCJWBWAYOQKKIW-UHFFFAOYSA-N	302.330	4.561	5	20	DJBD	
CC[C@H](Nc1ncc(C)cc1[N+](=O)[O-])c1ccc(Cl)cc1	463052458	IDPNAHYQDIUONU-ZDUSSCGKSA-N	305.765	4.515	5	20	DJBD	
C[C@H](CC(F)(F)F)Nc1ccc([N+](=O)[O-])c(OC(C)(C)C)c1	463745758	LUVHYMMOIYSHCA-SECBINFHSA-N	320.311	4.525	5	20	DJBD	
Cc1cccc2c1[C@H](C)C[C@@H]2NCc1cccc([N+](=O)[O-])c1C	478499969	TUHNAXQGPJYQFZ-DYVFJYSZSA-N	310.397	4.550	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H](C)c2cc(C)c(C)o2)cc1[N+](=O)[O-]	502467977	ZSSGLBRALSPPTC-OLZOCXBDSA-N	302.374	4.525	5	20	DJBD	
CCc1ccc([C@H](C)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1	536911382	VDOXPSDTLXNVSO-STQMWFEESA-N	318.442	4.939	5	20	DJBD	
C[C@@H](SCCOc1ccc([N+](=O)[O-])cc1)c1cccs1	737406955	SQXNFDCZOHTZJF-LLVKDONJSA-N	309.412	4.530	5	20	DJBD	
CC[C@H](c1ccccc1)N(CC)Cc1cc(F)ccc1[N+](=O)[O-]	746145000	QGWHQOYEKZTGAY-QGZVFWFLSA-N	316.376	4.707	5	20	DJBD	
Cc1cc(NCc2ccc(Cl)cc2[N+](=O)[O-])ccc1Cl	864031786	QFCFXGXWYICMSW-UHFFFAOYSA-N	311.168	4.822	5	20	DJBD	
O=[N+]([O-])c1ccc(Sc2cc(F)ccc2F)c2ccncc12	18061170	MZYNAYYOLBKWDW-UHFFFAOYSA-N	318.304	4.572	5	20	DJBD	
Cc1cc(N[C@@H]2CCSc3ccccc32)ccc1[N+](=O)[O-]	42247768	JRVCZRNEWQPPII-CQSZACIVSA-N	300.383	4.552	5	20	DJBD	
C[C@H](N[C@H](CC(F)F)c1ccccc1)c1cccc([N+](=O)[O-])c1	421877897	MPNFRWHHWOKZSX-BLLLJJGKSA-N	320.339	4.642	5	20	DJBD	
C[C@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc(F)c2ccccc12	551063138	KWVDTICFMWOFOF-ZDUSSCGKSA-N	324.355	4.738	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H](C)CCCC(F)(F)F	572191530	GLUBTNIIAZQHQW-VXGBXAGGSA-N	318.339	4.675	5	20	DJBD	
CC(C)Oc1ccccc1[C@H](C)Nc1ccc([N+](=O)[O-])cc1F	603861952	IGHCLMARNCBLOC-LBPRGKRZSA-N	318.348	4.694	5	20	DJBD	
CC(C)c1ccc(CNCc2ccc([N+](=O)[O-])c(Cl)c2)cc1	761520577	CEDUXOACOXYABD-UHFFFAOYSA-N	318.804	4.661	5	20	DJBD	
C[C@H](NC(=O)c1c2ccccc2cc2ccccc12)C(F)(F)F	809300499	OPNFGYRPFXOLLR-NSHDSACASA-N	317.310	4.674	5	20	DJBD	
CCc1ccc([N+](=O)[O-])cc1NC(=O)c1ccccc1C(C)C	857621435	DUKZBVKTPBBMCI-UHFFFAOYSA-N	312.369	4.533	5	20	DJBD	
Cc1ccc([C@@H](C)Nc2ccc([N+](=O)[O-])c3cnccc23)s1	53582354	ICRLFXWRUOTSFY-LLVKDONJSA-N	313.382	4.686	5	20	DJBD	
CC(C)c1nc([C@@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)cs1	173429848	PCUDARXLGBYDLI-VXGBXAGGSA-N	319.430	4.587	5	20	DJBD	
Cc1c([C@H](C)NCc2csc([N+](=O)[O-])c2)oc2ccccc12	191723830	QBJPFFRZLLQCEB-NSHDSACASA-N	316.382	4.562	5	20	DJBD	
CC[C@@H](Nc1cccc(F)c1[N+](=O)[O-])c1ccc(F)cc1F	737414223	GOHDZCSAVXLYFU-CYBMUJFWSA-N	310.275	4.575	5	20	DJBD	
CCOc1ccc(NCc2cccc([N+](=O)[O-])c2C)cc1Cl	742258800	QBAOSURMKGWSKQ-UHFFFAOYSA-N	320.776	4.567	5	20	DJBD	
CC(C)c1ccccc1OC(=O)c1ccc(Cl)cc1[N+](=O)[O-]	897893601	TURRDYQHAABGFN-UHFFFAOYSA-N	319.744	4.591	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H](C)c2cc(F)cc(F)c2)cc1[N+](=O)[O-]	90217580	SQTBYOOERCBAKK-VXGBXAGGSA-N	320.339	4.593	5	20	DJBD	
CCc1ccc([C@H](NCc2csc([N+](=O)[O-])c2)C(C)C)cc1	236987045	MSAGQTASSHIDEZ-QGZVFWFLSA-N	318.442	4.706	5	20	DJBD	
O=[N+]([O-])c1ccc(/C(=C\c2cccs2)c2ccncc2)cc1	255896789	FQHICCUCEDFJKH-SFQUDFHCSA-N	308.362	4.640	5	20	DJBD	
CCC(CC)c1cc(CNc2cc(C)c([N+](=O)[O-])cc2F)on1	461969552	BTWUUZQPNKXPAK-UHFFFAOYSA-N	321.352	4.546	5	20	DJBD	
CCCC(CCC)S[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-]	521799401	FHUABNCDAKCJSZ-LBPRGKRZSA-N	324.446	4.624	5	20	DJBD	
O=[N+]([O-])c1ccccc1CNc1ccc(CCC(F)(F)F)cc1	552204791	DARRKSMXCRBOSW-UHFFFAOYSA-N	324.302	4.702	5	20	DJBD	
CCC[C@H](N[C@@H](C)c1cnc(C)s1)c1cccc([N+](=O)[O-])c1	601298657	PYSPRIMWMVSZOQ-NHYWBVRUSA-N	319.430	4.552	5	20	DJBD	
C[C@@H](NCc1ccccc1[N+](=O)[O-])c1csc2ccccc12	754737330	LODZSTJCXDGFSO-GFCCVEGCSA-N	312.394	4.660	5	20	DJBD	
CC(=O)CCCOC(=O)c1c2ccccc2cc2ccccc12	894136934	IBYARTHLQICQEM-UHFFFAOYSA-N	306.361	4.519	5	20	DJBD	
C[C@H](NCc1ccccc1[N+](=O)[O-])c1ccc(-c2ccccc2)o1	89511932	YQNLQCQSDDMCIQ-AWEZNQCLSA-N	322.364	4.706	5	20	DJBD	
C/C(=C/c1ccc(-c2ccccc2[N+](=O)[O-])s1)c1cnccn1	126545122	UUUWOZUTYHUELA-BENRWUELSA-N	323.377	4.674	5	20	DJBD	
C[C@@H]1CC[C@H](N[C@H](C)c2cccc([N+](=O)[O-])c2)c2ccccc21	322132113	YVOZDBSXTWHVQA-LPMFXHHGSA-N	310.397	4.884	5	20	DJBD	
Cc1ccc(CN[C@@H](CC(C)C)c2ccccc2)cc1[N+](=O)[O-]	390376836	SXKIIRUYFJMLQI-SFHVURJKSA-N	312.413	4.780	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1CN[C@H](c1cccs1)C1CC1	544398059	POHFUYGFGQNAAH-HNNXBMFYSA-N	322.817	4.551	5	20	DJBD	
C[C@H](Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1	37131325	QOFIZONHFICBCB-JTQLQIEISA-N	321.174	4.530	5	20	DJBD	
Cc1ccc2c(c1)[C@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)CCC2	426288313	IQROXICVPKTBQN-AUUYWEPGSA-N	310.397	4.631	5	20	DJBD	
C/C(=C\c1cccc([N+](=O)[O-])c1)CNc1ccc2nc(C)oc2c1	469098461	UOFMZNIZCVQGDH-XYOKQWHBSA-N	323.352	4.560	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1CCc2c(C)cccc21	540179568	XLMKWJBCDVFVKB-IFXJQAMLSA-N	310.397	4.550	5	20	DJBD	
Cc1noc(CS[C@H](C)c2cccc(Cl)c2)c1[N+](=O)[O-]	596333732	JWRKQJCZGBIEOP-SECBINFHSA-N	312.778	4.539	5	20	DJBD	
O=[N+]([O-])c1ccc(CN2CCC[C@@H]2c2ccc(Cl)cc2)cc1	603497573	BKZDOOZHQYNBOH-QGZVFWFLSA-N	316.788	4.585	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)s1	774141541	VEORLVQEMIGYIR-MLGOLLRUSA-N	316.426	4.693	5	20	DJBD	
CC(C)c1nnc(-c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)o1	1322284776	YTTJZABBHNBKDE-UHFFFAOYSA-N	324.340	4.512	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)c(CSc2ccc(Cl)cn2)c1	79422280	WFCQMHBDFZXLHG-UHFFFAOYSA-N	315.181	4.589	5	20	DJBD	
CC(C)n1ncc2ccc(N[C@@H](C)c3cccc([N+](=O)[O-])c3)cc21	183006718	IJAOYCXXNOYGDK-ZDUSSCGKSA-N	324.384	4.699	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H](C)c2ccccc2Cl)cc1[N+](=O)[O-]	219863434	CWOAXNDBXRCANB-CHWSQXEVSA-N	318.804	4.968	5	20	DJBD	
Cc1ccc2c(c1)CC[C@H]2NCc1ccc(C(C)C)c([N+](=O)[O-])c1	521830373	XLDCCSTUGGLSPC-LJQANCHMSA-N	324.424	4.804	5	20	DJBD	
CC[C@H](CC(F)(F)F)NCc1ccc(C(C)C)c([N+](=O)[O-])c1	546879112	TYCDTXLUTHWIEI-GFCCVEGCSA-N	318.339	4.539	5	20	DJBD	
CC(C)(C)Sc1ccc(Nc2ccc([N+](=O)[O-])cn2)cc1	726786477	BGRHGEZGDXJUSG-UHFFFAOYSA-N	303.387	4.624	5	20	DJBD	
CCC(CC)(CC)S[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-]	762969392	KFHMEXTYLQXSPA-GFCCVEGCSA-N	324.446	4.624	5	20	DJBD	
O=[N+]([O-])c1ccc2sc(/C=C\c3ccc(F)c(F)c3)nc2c1	211814521	PYQIUFAWCXWLCO-KXFIGUGUSA-N	318.304	4.653	5	20	DJBD	
CCOc1ccc(Cl)c(NCc2cccc([N+](=O)[O-])c2C)c1	864029875	ULQWCFHPDJNLHO-UHFFFAOYSA-N	320.776	4.567	5	20	DJBD	
CCc1ccc([C@H](NCc2cccc([N+](=O)[O-])c2)C(C)C)cc1	61030895	FZESLISTHQUDCM-LJQANCHMSA-N	312.413	4.644	5	20	DJBD	
C[C@H](NCc1ccc(-c2ccccc2)o1)c1cccc([N+](=O)[O-])c1	194061463	MXCHMJACGXCPEW-AWEZNQCLSA-N	322.364	4.706	5	20	DJBD	
C[C@@H](N[C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(F)cc1Cl	451111419	SZERNBNIHYKDOD-GHMZBOCLSA-N	322.767	4.799	5	20	DJBD	
C[C@@H](SCCOc1ccccc1[N+](=O)[O-])c1cccc(F)c1	517178033	OYUNOQBUAMSISY-GFCCVEGCSA-N	321.373	4.607	5	20	DJBD	
Cc1c([C@H](C)NCc2ccc3ccccc3c2)cccc1[N+](=O)[O-]	537937914	FRSKZQDLDGLGMR-HNNXBMFYSA-N	320.392	4.907	5	20	DJBD	
C[C@H](NC1CCC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1	540168360	HDDAMSKIGKHJHM-NSHDSACASA-N	302.399	4.526	5	20	DJBD	
c1ccc2c(c1)nc(CSC[C@H]1CCCO1)c1ccccc12	562337590	VAVYFKJKUSVHPD-CQSZACIVSA-N	309.434	4.800	5	20	DJBD	
CSc1cccc(N[C@H]2CCCc3ccc([N+](=O)[O-])cc32)c1	569672357	QJPFDPKLDJFASG-KRWDZBQOSA-N	314.410	4.806	5	20	DJBD	
CCOc1ccc(NCc2ccc(C(C)C)c([N+](=O)[O-])c2)cc1	726693101	QQWIPANDZDUPGN-UHFFFAOYSA-N	314.385	4.729	5	20	DJBD	
O=[N+]([O-])c1ccc(CSc2ccccc2Br)cc1	71810242	WHMFLXGQRSNWJG-UHFFFAOYSA-N	324.199	4.650	5	20	DJBD	
CSc1cccc(N[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1C	539680630	PUYRXYWYISZVAW-LBPRGKRZSA-N	302.399	4.798	5	20	DJBD	
CC(C)Oc1ccccc1[C@@H](C)Nc1ccc([N+](=O)[O-])s1	604409316	XDRHPCCNNOTLFF-LLVKDONJSA-N	306.387	4.617	5	20	DJBD	
CCCCC[C@H](NC(=O)c1cc(C)ccc1[N+](=O)[O-])C(C)(C)C	741931374	FSILVQGTEABQKZ-INIZCTEOSA-N	320.433	4.628	5	20	DJBD	
C[C@@H](c1ccco1)N(Cc1ccc([N+](=O)[O-])c(Cl)c1)C1CC1	761505926	IQUFIKXJTQHVBK-NSHDSACASA-N	320.776	4.567	5	20	DJBD	
Cc1cc(NCc2nc(C(C)C)c(C)s2)c(F)cc1[N+](=O)[O-]	461959752	OYGJPHFLQYZYIO-UHFFFAOYSA-N	323.393	4.543	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H]1C[C@H](c2ccccc2)C1	574509553	CTTJUTHDWPQSMU-DJIMGWMZSA-N	310.397	4.500	5	20	DJBD	
O=[N+]([O-])c1ccccc1NCCCCCOC1CCCCC1	609514695	WEHAAXCDGVBZQH-UHFFFAOYSA-N	306.406	4.526	5	20	DJBD	
O=[N+]([O-])c1ccccc1SCc1ccc(Br)cc1	42203458	RZDKGXXATDQQAT-UHFFFAOYSA-N	324.199	4.650	5	20	DJBD	
CC(C)[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1	319770426	XEOIGLRCYHPCOU-SCLBCKFNSA-N	316.376	4.782	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H](c2ccccc2)C(C)C)cc1[N+](=O)[O-]	319840295	OFXJWIGUJWZIAN-BEFAXECRSA-N	312.413	4.951	5	20	DJBD	
O=[N+]([O-])c1ccc(/C=C/c2nc(-c3ccccc3)cs2)cc1O	498296272	OFEQXWPYLQHKGF-VQHVLOKHSA-N	324.361	4.594	5	20	DJBD	
CSc1cccc(N[C@@H](C)c2ccccc2[N+](=O)[O-])c1C	538097540	NKIBNRBLFUDWNH-LBPRGKRZSA-N	302.399	4.798	5	20	DJBD	
C[C@H](CSCc1ccc([N+](=O)[O-])cc1Cl)C(F)(F)F	543860993	ZXHXEEFATGMBFI-SSDOTTSWSA-N	313.728	4.680	5	20	DJBD	
C[C@H](N[C@@H]1CCc2sc(Cl)cc21)c1ccc([N+](=O)[O-])cc1	571486378	CIPYBJHVXGIJNS-TVQRCGJNSA-N	322.817	4.648	5	20	DJBD	
C[C@@H](c1ccccc1)c1ccc(Oc2ncccc2[N+](=O)[O-])cc1	609143816	XPJVUSLAKISRGT-AWEZNQCLSA-N	320.348	4.934	5	20	DJBD	
O=[N+]([O-])c1cnc(N[C@@H](c2ccc(F)cc2)C2CCCC2)s1	443514474	GVWAJJVFRAUEHE-CQSZACIVSA-N	321.377	4.534	5	20	DJBD	
O=[N+]([O-])c1cccc(Cl)c1CN1CCCC[C@@H]1c1ccco1	492977456	STZYFELZTKEUBJ-OAHLLOKOSA-N	320.776	4.568	5	20	DJBD	
C[C@H](c1cccc(Cl)c1)N(C)Cc1c(F)cccc1[N+](=O)[O-]	505818913	DINLGZPRNJIHMQ-LLVKDONJSA-N	322.767	4.580	5	20	DJBD	
Cc1ccc2c(c1)CC[C@@H]2Nc1ccc2ncccc2c1[N+](=O)[O-]	511710966	BOOUXBZRGYKPOM-KRWDZBQOSA-N	319.364	4.551	5	20	DJBD	
CN(Cc1ccoc1)C(=O)c1c2ccccc2cc2ccccc12	1322237324	UIDGYEJMPHTOAH-UHFFFAOYSA-N	315.372	4.858	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2cccc(Oc3ccccc3)c2)nc1	14807945	CUNWWETVNRWUIB-UHFFFAOYSA-N	308.293	4.574	5	20	DJBD	
Cc1cc([C@H](C)Nc2nc3ccc([N+](=O)[O-])cc3s2)c(C)o1	111190640	IGPQHCWSGIEVRN-VIFPVBQESA-N	317.370	4.587	5	20	DJBD	
COc1ccc(CSc2ccc(Cl)cc2)cc1[N+](=O)[O-]	603722897	WDWVHAZOHOJCIO-UHFFFAOYSA-N	309.774	4.549	5	20	DJBD	
O=C(Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-])[C@@H]1CC=CCC1	920330307	XJBCLATWFMXXDD-OAHLLOKOSA-N	323.348	4.524	5	20	DJBD	
C[C@H](Nc1ccc([N+](=O)[O-])cc1)c1ccc(Br)cc1	23745285	GCAFJLHTWFPGLU-JTQLQIEISA-N	321.174	4.530	5	20	DJBD	
CCC[C@H](N[C@@H](C)c1ccsc1)c1cccc([N+](=O)[O-])c1	61361083	QFOKHTHCPKSUKB-LRDDRELGSA-N	304.415	4.848	5	20	DJBD	
Cc1cc([C@H](C)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)o1	124888677	LQYFDMCECOWTBS-STQMWFEESA-N	302.374	4.525	5	20	DJBD	
C[C@@H](Nc1ccc([N+](=O)[O-])cc1)c1cc2cccc(F)c2o1	473917658	HHVPTELIMZGUBI-SNVBAGLBSA-N	300.289	4.653	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)CCCC(F)(F)F	572191529	GLUBTNIIAZQHQW-RYUDHWBXSA-N	318.339	4.675	5	20	DJBD	
O=[N+]([O-])c1ccc(N[C@@H]2CCCc3c(F)cc(F)cc32)c(F)c1	864019231	VSXUGFLPGQMHNT-OAHLLOKOSA-N	322.286	4.502	5	20	DJBD	
C[C@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)s1	36992056	URWOYAFYKXHHCG-ZJUUUORDSA-N	310.806	4.722	5	20	DJBD	
O=[N+]([O-])c1cc(C(F)(F)F)ccc1Oc1cccc(F)c1	57366712	DEIZBNDCEUIZOU-UHFFFAOYSA-N	301.195	4.545	5	20	DJBD	
O=C(Nc1ccc([N+](=O)[O-])cc1)C1CCC(c2ccccc2)CC1	443801920	MXOGQZLDABMMOZ-UHFFFAOYSA-N	324.380	4.507	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](c1cccs1)C1CC1	531944246	NDMXRIKZSRHPSR-SJCJKPOMSA-N	316.426	4.767	5	20	DJBD	
CC[C@H](N[C@@H]1CCc2c(C)cccc21)c1cccc([N+](=O)[O-])c1	539081398	YAHQPBAJNKNBRO-RBUKOAKNSA-N	310.397	4.631	5	20	DJBD	
CSCc1ccc(N[C@@H]2CCc3c2cccc3[N+](=O)[O-])cc1	573933440	GFIKMYLKUKTAIH-MRXNPFEDSA-N	314.410	4.557	5	20	DJBD	
O=[N+]([O-])c1ccc(N2CCC[C@@H]2c2cccs2)c(Cl)c1	912727790	GMSQWJKAZRQIEX-CYBMUJFWSA-N	308.790	4.651	5	20	DJBD	
C[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1cc2ccccc2o1	152772783	MCRDJNBKYCRYFC-OLZOCXBDSA-N	310.353	4.753	5	20	DJBD	
Cc1nc(N[C@@H](C)c2cccc3ccccc23)ccc1[N+](=O)[O-]	301625019	GUQRPJLXQIKGED-LBPRGKRZSA-N	307.353	4.625	5	20	DJBD	
O=[N+]([O-])c1ccc(CNc2cccc(Oc3ccccc3)c2)cc1	391976110	AHEUPSOJGWSIER-UHFFFAOYSA-N	320.348	4.999	5	20	DJBD	
CC[C@H](NCc1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1F	461083862	DBBQEJTZUSVPFD-HNNXBMFYSA-N	322.767	4.628	5	20	DJBD	
Cc1cc2cc(CNCc3cccc([N+](=O)[O-])c3C)oc2cc1C	480469810	DVZPQFGFAIFKNX-UHFFFAOYSA-N	324.380	4.556	5	20	DJBD	
CC(=O)c1ccc(N[C@H](C)c2cc(C)cc(C)c2)c([N+](=O)[O-])c1	501278459	BOAMAEIWJXUHGH-CYBMUJFWSA-N	312.369	4.587	5	20	DJBD	
CC(C)[C@@H](C)N(C)C(=O)c1cc2ccccc2c2cccnc12	524421521	YVBBXMSSYREWLM-CQSZACIVSA-N	306.409	4.505	5	20	DJBD	
C[C@@H](NC1(c2ccc(Cl)cc2)CC1)c1cccc([N+](=O)[O-])c1	553858638	FEMUHGPZCBECHE-GFCCVEGCSA-N	316.788	4.588	5	20	DJBD	
CSc1cccc(N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)c1	569672358	QJPFDPKLDJFASG-QGZVFWFLSA-N	314.410	4.806	5	20	DJBD	
Cc1ccsc1/C=C(/Cl)c1nc2cc([N+](=O)[O-])ccc2o1	255270023	MIENNCDPYFANAY-JXMROGBWSA-N	320.757	4.843	5	20	DJBD	
CC(C)[C@@H](Nc1ncc([N+](=O)[O-])s1)c1ccc(Cl)cc1	443442550	ZAISVBWAEZDBNS-GFCCVEGCSA-N	311.794	4.514	5	20	DJBD	
CC(C)C[C@@H](NCc1cc(F)ccc1[N+](=O)[O-])c1ccccc1	774816550	ZYEOYFXQNWXRSX-QGZVFWFLSA-N	316.376	4.611	5	20	DJBD	
O=[N+]([O-])c1ccc(NCc2cccc3ccsc23)c(F)c1	864019830	ANNGMZMODIPHPK-UHFFFAOYSA-N	302.330	4.561	5	20	DJBD	
Cc1cc(N[C@H](C)c2cc3ccccc3s2)ncc1[N+](=O)[O-]	301437168	MXRWNOXOBIZSEY-LLVKDONJSA-N	313.382	4.686	5	20	DJBD	
Cc1cc([C@H](C)Nc2ccnc3c([N+](=O)[O-])cccc23)c(C)o1	322164669	NBKDYQDQBXFAIG-NSHDSACASA-N	311.341	4.526	5	20	DJBD	
C/C=C\c1ccc(Oc2ccc(F)cc2[N+](=O)[O-])c(OC)c1	497721251	CGRQDKYDENIYMQ-ARJAWSKDSA-N	303.289	4.568	5	20	DJBD	
CCCCOc1cccc(NCc2ccc(C)c([N+](=O)[O-])c2)c1	920179801	BRFTXJJIUHIBNM-UHFFFAOYSA-N	314.385	4.694	5	20	DJBD	
C[C@H](Nc1ncc(Cl)cc1[N+](=O)[O-])c1cc2ccccc2o1	301735975	HGLMMJBSGXEQHJ-VIFPVBQESA-N	317.732	4.563	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C1CCCCCCC1	755025464	XTZJPEDVMLXIHL-UHFFFAOYSA-N	304.390	4.511	5	20	DJBD	
CSc1cc(NCc2cccc([N+](=O)[O-])c2C)ccc1Cl	864031110	UVNUQERCXHSZIZ-UHFFFAOYSA-N	322.817	4.891	5	20	DJBD	
Cc1ccc([C@@H](C)Nc2cccc3ccncc23)cc1[N+](=O)[O-]	321773106	PXOHRBACYYOEGO-CYBMUJFWSA-N	307.353	4.625	5	20	DJBD	
C[C@@H](Nc1ccccc1C(C)(F)F)c1cccc([N+](=O)[O-])c1	453302848	ZJHDJRDJTLRXRO-LLVKDONJSA-N	306.312	4.880	5	20	DJBD	
C[C@@H](c1ccccc1Cl)N(C)Cc1c(F)cccc1[N+](=O)[O-]	505818344	ASRVGYQSLRDJKY-NSHDSACASA-N	322.767	4.580	5	20	DJBD	
CCOCc1ccc(N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1	540753492	PQELIYDKVFZWQI-CQSZACIVSA-N	314.385	4.613	5	20	DJBD	
CSCc1ccc(N[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1	540836825	ZEJIJSICABDCTG-ZDUSSCGKSA-N	316.426	4.939	5	20	DJBD	
O=[N+]([O-])c1ccc(CN2CCC[C@H]2c2cccs2)cc1Cl	761505155	HHBVVOALGTZBJN-AWEZNQCLSA-N	322.817	4.647	5	20	DJBD	
CC[C@@H](C)Oc1ccc(NCc2cccc([N+](=O)[O-])c2C)cc1	864006386	HUVXWJLNOYDQHQ-CYBMUJFWSA-N	314.385	4.693	5	20	DJBD	
Cc1cc(NCc2cccc([N+](=O)[O-])c2C)c2ccccc2c1	864029658	SRTROVNEBPWFCB-UHFFFAOYSA-N	306.365	4.977	5	20	DJBD	
O=[N+]([O-])c1cccc(CNc2ccccc2Oc2ccccc2)c1	302835013	ZBVANWLLTVCZKI-UHFFFAOYSA-N	320.348	4.999	5	20	DJBD	
CSc1ccccc1[C@H](C)N[C@@H](C)c1cccc([N+](=O)[O-])c1	194866911	WNUVVEUWJKOVDB-STQMWFEESA-N	316.426	4.729	5	20	DJBD	
Cc1cc(F)cc(-c2nc(O)c3cc4ccccc4cc3n2)c1	431181877	UAPYEFRRXFNQIG-UHFFFAOYSA-N	304.324	4.603	5	20	DJBD	
O=[N+]([O-])c1ccc(SCc2c(Cl)cccc2Cl)nc1	60862553	ADSAIDUHIHVQHP-UHFFFAOYSA-N	315.181	4.589	5	20	DJBD	
Cc1c([C@@H](C)N[C@H]2C[C@H](c3ccccc3)C2)cccc1[N+](=O)[O-]	436286325	AUPHPYDISBMFNV-DJIMGWMZSA-N	310.397	4.500	5	20	DJBD	
Cc1c([C@@H](C)N[C@@H](CC(F)(F)F)C(C)C)cccc1[N+](=O)[O-]	437092445	MCMNNGTTXSAMRG-YPMHNXCESA-N	318.339	4.531	5	20	DJBD	
CC[C@H](Nc1ccccc1[N+](=O)[O-])c1ncc(-c2ccccc2)[nH]1	537090804	AHSLZALMIXAXNH-AWEZNQCLSA-N	322.368	4.548	5	20	DJBD	
C[C@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1	37177029	PFUZRNXFGFEABS-RYUDHWBXSA-N	304.777	4.660	5	20	DJBD	
Cc1cccc([C@@H](C)Nc2ccc([N+](=O)[O-])c3cccnc23)c1C	303633177	FWKBWYYNIVMKRU-CQSZACIVSA-N	321.380	4.933	5	20	DJBD	
CSc1ccc(N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1	447585908	KVWKQTLOYJKOBO-QGZVFWFLSA-N	314.410	4.806	5	20	DJBD	
C[C@H](N[C@H]1CCc2ccc(Cl)cc21)c1cccc([N+](=O)[O-])c1	479254710	WEMLWZZRLYOGRC-GTNSWQLSSA-N	316.788	4.586	5	20	DJBD	
Cc1cccc(C)c1[C@H](C)NCc1ccc(Cl)cc1[N+](=O)[O-]	546225947	TVFVLDUFSBSQHZ-ZDUSSCGKSA-N	318.804	4.716	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2C)s1	765303292	FMGHXPZMQFGPSE-STQMWFEESA-N	304.415	4.685	5	20	DJBD	
Cc1cc(OC(C)C)ccc1NCc1cccc([N+](=O)[O-])c1C	864006355	SOMQPXPMQWMEHK-UHFFFAOYSA-N	314.385	4.611	5	20	DJBD	
O=[N+]([O-])c1cnc(Oc2ccc(Cl)c3ccccc23)s1	443405678	BTGFLZCTWTZTHE-UHFFFAOYSA-N	306.730	4.650	5	20	DJBD	
CC[C@H](Nc1cc(C)c([N+](=O)[O-])cn1)c1ccc(Cl)cc1	470870449	XEKZUHNWFYGEBQ-ZDUSSCGKSA-N	305.765	4.515	5	20	DJBD	
C[C@@H](Nc1ccc(CC(F)(F)F)cc1)c1ccc([N+](=O)[O-])cc1	178658440	OHNTXQCNRIQRJD-LLVKDONJSA-N	324.302	4.873	5	20	DJBD	
CC[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1cc(F)ccc1F	173437920	RWTWVPLJWNBEQO-GTNSWQLSSA-N	320.339	4.675	5	20	DJBD	
CC(C)COc1ccccc1N[C@@H](C)c1ccccc1[N+](=O)[O-]	390969574	DSJPVQJYPHAPCL-AWEZNQCLSA-N	314.385	4.803	5	20	DJBD	
COc1ccccc1CS[C@H](C)c1ccccc1[N+](=O)[O-]	463188045	BGHHQJINWFOTTK-GFCCVEGCSA-N	303.383	4.598	5	20	DJBD	
COc1ccc(CS[C@H](C)c2ccccc2F)cc1[N+](=O)[O-]	517976093	FISXGLRSEYXAHB-LLVKDONJSA-N	321.373	4.737	5	20	DJBD	
CCCCN(C(=O)Nc1ccc([N+](=O)[O-])cc1)C1CCCCC1	582135333	RKQOBGINYIOKAM-UHFFFAOYSA-N	319.405	4.562	5	20	DJBD	
COc1ccccc1CSCc1cc(Cl)ccc1[N+](=O)[O-]	746389459	PSMZIOVISMIJDX-UHFFFAOYSA-N	323.801	4.690	5	20	DJBD	
COC(=O)c1c2ccccc2c(Br)c2ccccc12	401840	RZVMYSWMLGGHHL-UHFFFAOYSA-N	315.166	4.542	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)c(N[C@@H]2CCC(F)(F)C2)c(Cl)c1	311825362	FJEDOHLVCKLSKU-ZCFIWIBFSA-N	311.115	4.501	5	20	DJBD	
CCOc1cccc(N[C@@H](CC)c2cccc([N+](=O)[O-])c2)c1	315584022	NGLKOSGARPQVQB-KRWDZBQOSA-N	300.358	4.557	5	20	DJBD	
CC[C@@H](Nc1cccc2ccncc12)c1cccc([N+](=O)[O-])c1	322371589	ZQMXOASAKAPKGU-QGZVFWFLSA-N	307.353	4.706	5	20	DJBD	
O=[N+]([O-])c1ccccc1CN(Cc1ccoc1)C1CCCCC1	525122101	SYAAXBIMYQEQHS-UHFFFAOYSA-N	314.385	4.523	5	20	DJBD	
Cc1ccc2oc(CN[C@H](C)c3ccc(C)c([N+](=O)[O-])c3)cc2c1	561527245	NSSABESFYQIEIW-CQSZACIVSA-N	324.380	4.809	5	20	DJBD	
Cc1cc(OCc2csc(C3CCCC3)n2)ccc1[N+](=O)[O-]	64025290	XMIJLNKLALSUCV-UHFFFAOYSA-N	318.398	4.596	5	20	DJBD	
Cc1ccc(C)c([C@H](C)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1	319687766	BHXZNLPWWJRSEO-CVEARBPZSA-N	312.413	4.932	5	20	DJBD	
Cc1ccc2cc([C@H](C)NCc3cccc([N+](=O)[O-])c3C)oc2c1	426061720	VIEUPCKVMMCRSE-AWEZNQCLSA-N	324.380	4.809	5	20	DJBD	
O=[N+]([O-])c1ccc(SCc2ncc(Cl)cc2Cl)cc1	540726072	MVMXDQUUNVSULI-UHFFFAOYSA-N	315.181	4.589	5	20	DJBD	
CC[C@H](NCc1ccc([C@@H]2C[C@@H]2C)o1)c1cccc([N+](=O)[O-])c1	175050779	GFHXVOJHUWZQIO-VUCTXSBTSA-N	314.385	4.552	5	20	DJBD	
Cc1c(CNc2ccc([N+](=O)[O-])cc2F)oc2ccc(F)cc12	357237922	GGBXNIFUGDIAIA-UHFFFAOYSA-N	318.279	4.540	5	20	DJBD	
CCc1ccccc1NC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1	439213306	QZYQAVKKQKBLKJ-UHFFFAOYSA-N	312.369	4.533	5	20	DJBD	
CC[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1cccc(F)c1	453247672	OFJDNZJYZMAFEQ-YVEFUNNKSA-N	302.349	4.536	5	20	DJBD	
Cc1ccc([C@@H](C)NC2CC(c3ccccc3)C2)cc1[N+](=O)[O-]	467448695	MPLQOIFUPCNGOW-RWBZWWBESA-N	310.397	4.500	5	20	DJBD	
CC1(C)C[C@@H](Nc2ccc([N+](=O)[O-])s2)c2ccc(F)cc2O1	610808999	RVGUSXWIRZTQDY-LLVKDONJSA-N	322.361	4.510	5	20	DJBD	
O=C(c1c2ccccc2cc2ccccc12)N1CCC[C@@H](F)C1	846743876	KLKZFMDLFSFERL-MRXNPFEDSA-N	307.368	4.567	5	20	DJBD	
C[C@H](c1cccc([N+](=O)[O-])c1)c1nc(C2CCCCCC2)no1	904685332	JARSGCYODJPYPU-GFCCVEGCSA-N	315.373	4.567	5	20	DJBD	
O=C(Nc1cccc(-c2cccs2)c1)c1ccccc1[N+](=O)[O-]	195388850	CYSDSOCFIBRLPU-UHFFFAOYSA-N	324.361	4.576	5	20	DJBD	
Cc1ccc([C@H](C)NCc2cccc(C(F)F)c2)cc1[N+](=O)[O-]	275785067	WLTSXWPZBZPJIW-LBPRGKRZSA-N	320.339	4.692	5	20	DJBD	
CC(C)c1ccc(CNc2ccc([N+](=O)[O-])c3cnccc23)cc1	324315887	GFXIHYZIJRBEBC-UHFFFAOYSA-N	321.380	4.879	5	20	DJBD	
CC(C)c1ccc(CN(C)[C@H](C)c2ccco2)cc1[N+](=O)[O-]	507207141	BKKAEJCXPXQEBK-CYBMUJFWSA-N	302.374	4.504	5	20	DJBD	
O=[N+]([O-])c1ccc(CN2CCC[C@H]2c2ccc(Cl)cc2)cc1	603497572	BKZDOOZHQYNBOH-KRWDZBQOSA-N	316.788	4.585	5	20	DJBD	
COc1ccc([N+](=O)[O-])c(N[C@@H](C)c2cc3ccccc3o2)c1	609494843	MQJBUVLAURNSJM-NSHDSACASA-N	312.325	4.523	5	20	DJBD	
CC(C)CCOc1ccc(NCc2ccccc2[N+](=O)[O-])cc1	744449991	SJMCMNGBYHOBOH-UHFFFAOYSA-N	314.385	4.632	5	20	DJBD	
CSc1ccc(NCc2ccc([N+](=O)[O-])cc2Cl)cc1	49963120	QJQGVSRNKAYHGL-UHFFFAOYSA-N	308.790	4.582	5	20	DJBD	
CC(C)Oc1cccc([C@@H](C)Nc2ccc([N+](=O)[O-])s2)c1	64029574	AKJVZPHEAXFGCU-LLVKDONJSA-N	306.387	4.617	5	20	DJBD	
O=[N+]([O-])c1ccc(N[C@@H]2CCSc3c(F)cccc32)c(F)c1	301102961	UMZWFTVQAJCBMG-CYBMUJFWSA-N	322.336	4.522	5	20	DJBD	
Cc1ccc2c(c1)CC[C@@H]2NCc1ccc(C(C)C)c([N+](=O)[O-])c1	521830372	XLDCCSTUGGLSPC-IBGZPJMESA-N	324.424	4.804	5	20	DJBD	
CC[C@H](N[C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(F)cc1	538138471	RCMNQEGDTOCEQV-WBMJQRKESA-N	302.349	4.536	5	20	DJBD	
C[C@@H](Nc1ccsc1[N+](=O)[O-])c1ccccc1C(F)(F)F	742414297	ZTTIMKYONDWEMP-MRVPVSSYSA-N	316.304	4.848	5	20	DJBD	
COc1ccc([N+](=O)[O-])cc1CNc1cc(C)cc2ccccc12	864029286	IELNCVYEVHKOOV-UHFFFAOYSA-N	322.364	4.677	5	20	DJBD	
CC(C)c1nc([C@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)cs1	173429864	PCUDARXLGBYDLI-NEPJUHHUSA-N	319.430	4.587	5	20	DJBD	
C[C@H](Sc1c(F)cc(F)cc1F)c1ccccc1[N+](=O)[O-]	571135368	UGNIFJLEMRHLIF-QMMMGPOBSA-N	313.300	4.865	5	20	DJBD	
COc1cc(Cl)c(C)cc1N[C@@H](C)c1ccccc1[N+](=O)[O-]	314414009	WMEZKCHWSCKCRY-NSHDSACASA-N	320.776	4.738	5	20	DJBD	
C[C@@H](SCCCC1CCOCC1)c1ccccc1[N+](=O)[O-]	578721487	MVQNNAZDVRPVHT-CYBMUJFWSA-N	309.431	4.596	5	20	DJBD	
CCC[C@H](NCc1c(C)cccc1F)c1cccc([N+](=O)[O-])c1	766214650	YOVBTMIPTMKEEG-SFHVURJKSA-N	316.376	4.673	5	20	DJBD	
Cc1ccc(-c2csc(-c3cccc([N+](=O)[O-])c3)n2)s1	71971783	QVYBAUHZHSQSON-UHFFFAOYSA-N	302.380	4.755	5	20	DJBD	
CC(C)c1nc([C@@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cs1	173429822	PCUDARXLGBYDLI-NWDGAFQWSA-N	319.430	4.587	5	20	DJBD	
Cc1cc(N[C@@H]2CCSc3c(F)cccc32)ccc1[N+](=O)[O-]	315124028	IYYXKAOGVDVQLZ-CQSZACIVSA-N	318.373	4.691	5	20	DJBD	
CCC(CC)[C@H](NCc1cccc([N+](=O)[O-])c1)c1ccccc1	319811207	PGAIMGFFCLTSPH-IBGZPJMESA-N	312.413	4.862	5	20	DJBD	
Cc1cnc(N[C@@H](C)c2cccc3ccccc23)c([N+](=O)[O-])c1	463051171	AGUFOKSELDJFJF-ZDUSSCGKSA-N	307.353	4.625	5	20	DJBD	
Cc1cc(N[C@H](C)c2ccccc2OC(C)C)ccc1[N+](=O)[O-]	603861973	JZPMLSZJJDDWJM-CQSZACIVSA-N	314.385	4.864	5	20	DJBD	
O=[N+]([O-])c1ccc(N2CCC[C@@H]2c2cccc(Cl)c2)cc1	1317895063	DVRHNPYUIZCYLP-MRXNPFEDSA-N	302.761	4.590	5	20	DJBD	
O=[N+]([O-])c1ccc(-c2csc(-c3cccc(F)c3)n2)cc1	7846009	DWEFEVRUPIGVRD-UHFFFAOYSA-N	300.314	4.524	5	20	DJBD	
CC[C@@H](Nc1cccc(SC)c1)c1cccc([N+](=O)[O-])c1	36721073	XMHQTWMEKVRRGA-MRXNPFEDSA-N	302.399	4.880	5	20	DJBD	
C[C@@H](N[C@@H]1CCCCc2ccccc21)c1cccc([N+](=O)[O-])c1	321648332	QIMRGDXMAVYFSG-AUUYWEPGSA-N	310.397	4.713	5	20	DJBD	
CC[C@H](N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccc(F)cc1	531205108	WRUIZTWMXOJKTK-DYVFJYSZSA-N	316.376	4.844	5	20	DJBD	
Cc1ccccc1[C@H](NCc1c(F)cccc1[N+](=O)[O-])C(C)C	611394094	GNFZCKJXGJMMHU-GOSISDBHSA-N	316.376	4.529	5	20	DJBD	
Cc1nc(CS[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c(C)s1	1116495197	RQODHMMZXVGPPC-JTQLQIEISA-N	322.455	4.971	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H](c2ccccc2)C(C)C)cc1[N+](=O)[O-]	319840298	OFXJWIGUJWZIAN-KXBFYZLASA-N	312.413	4.951	5	20	DJBD	
Cc1cc(C)c([C@@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)c(C)c1	321939931	DXEMBHAUHCRPSC-HZPDHXFCSA-N	312.413	4.932	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC1(c2ccccc2)CCC1	538569362	RKNUEVFEMXVJBA-OAHLLOKOSA-N	310.397	4.633	5	20	DJBD	
Cc1cc(NCc2c3ccccc3cc3ccccc23)nn1C	747922786	CACYOEUJAOFSMT-UHFFFAOYSA-N	301.393	4.647	5	20	DJBD	
CC[C@@H](NCc1ccccc1[N+](=O)[O-])c1ccc(Cl)s1	89512096	FWODSHIVAYPWMB-LLVKDONJSA-N	310.806	4.551	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H](C)c2cc(F)cc(F)c2)cc1[N+](=O)[O-]	90217578	SQTBYOOERCBAKK-NEPJUHHUSA-N	320.339	4.593	5	20	DJBD	
CCc1c([C@@H](C)NCc2ccccc2[N+](=O)[O-])oc2ccccc12	324288472	RFPUWOZLJBVRTI-CYBMUJFWSA-N	324.380	4.754	5	20	DJBD	
Cc1cc(N[C@@H](c2ccccc2)C2CCCC2)ncc1[N+](=O)[O-]	470874079	SFVIZCZLKJXBJY-SFHVURJKSA-N	311.385	4.642	5	20	DJBD	
C[C@H](c1ccccc1Cl)N(C)Cc1c(F)cccc1[N+](=O)[O-]	505818343	ASRVGYQSLRDJKY-LLVKDONJSA-N	322.767	4.580	5	20	DJBD	
Cc1cc(C)cc([C@@H](C)NCc2cc(Cl)ccc2[N+](=O)[O-])c1	775387182	KALCHYMERHWCDO-CYBMUJFWSA-N	318.804	4.716	5	20	DJBD	
COc1ccccc1[C@H](C)SCc1ccc([N+](=O)[O-])cc1	463208423	XPOZWKDWYDAFPN-LBPRGKRZSA-N	303.383	4.598	5	20	DJBD	
CCC[C@@H](C)NCc1ccc(-c2ccccc2[N+](=O)[O-])s1	608834982	YZDUBEWEPBIECT-GFCCVEGCSA-N	304.415	4.602	5	20	DJBD	
O=[N+]([O-])c1cccc2ccc(/C=C\c3ccc(F)c(F)c3)nc12	207813296	LNCUSEJHTJODGF-DAXSKMNVSA-N	312.275	4.592	5	20	DJBD	
CSc1ccc(Oc2ccc([N+](=O)[O-])c3cnccc23)cc1	301055660	CXDWROYULGUOSS-UHFFFAOYSA-N	312.350	4.657	5	20	DJBD	
Cc1cc(NCc2ccc([N+](=O)[O-])cc2)ccc1-c1ccncc1	427416845	XVZNIZXGFJIJJR-UHFFFAOYSA-N	319.364	4.577	5	20	DJBD	
C/C(=C/c1cccc([N+](=O)[O-])c1)CNc1ccc2nc(C)oc2c1	469098266	UOFMZNIZCVQGDH-WQLSENKSSA-N	323.352	4.560	5	20	DJBD	
Cc1ccc2oc(N[C@H](C)c3ccc(C)c([N+](=O)[O-])c3)nc2c1	487639387	HDKIGTQITKCOLD-GFCCVEGCSA-N	311.341	4.526	5	20	DJBD	
Cc1ccc2nc(S[C@@H](C)c3ccccc3[N+](=O)[O-])[nH]c2c1	463039103	XOJJUKMDUANBER-NSHDSACASA-N	313.382	4.633	5	20	DJBD	
CC(C)[C@H](NCc1c(Cl)cccc1[N+](=O)[O-])c1ccccc1	494196362	WCXVXBKSLFNGEZ-KRWDZBQOSA-N	318.804	4.735	5	20	DJBD	
C[C@H](NC1(c2ccccc2Cl)CC1)c1ccc([N+](=O)[O-])cc1	592391895	SNFFYUCUCBWWIC-LBPRGKRZSA-N	316.788	4.588	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1N[C@H]1CSc2ccccc21	83748552	FIZIOCONDJFAKU-LBPRGKRZSA-N	306.774	4.507	5	20	DJBD	
O=[N+]([O-])c1cc(F)ccc1CSCc1csc(C2CC2)n1	596350548	XBPXXOCEFIACIP-UHFFFAOYSA-N	324.402	4.501	5	20	DJBD	
C[C@@H](c1ccccc1)c1ccc(Oc2cccnc2[N+](=O)[O-])cc1	609143811	WJKMROPEKARNCH-AWEZNQCLSA-N	320.348	4.934	5	20	DJBD	
O=[N+]([O-])c1cc(Br)ccc1Sc1cccs1	42389113	JCLCOKHFYPQIIO-UHFFFAOYSA-N	316.201	4.570	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H](C)c2ccc(F)cc2F)cc1[N+](=O)[O-]	78970814	VHPPAMYMPXZVLE-NEPJUHHUSA-N	320.339	4.593	5	20	DJBD	
C[C@H](N[C@H](C)c1cc2ccccc2o1)c1ccc([N+](=O)[O-])cc1	190610153	XQRTYVLQXUJGNF-QWHCGFSZSA-N	310.353	4.753	5	20	DJBD	
CCC[C@H](Nc1ccc(Cl)cc1[N+](=O)[O-])c1ccccn1	615942254	QHUVNLGFRGZTFW-ZDUSSCGKSA-N	305.765	4.597	5	20	DJBD	
C[C@H](c1cccs1)N(C)Cc1cc([N+](=O)[O-])ccc1Cl	49726667	YOJWWFRGBPSJGG-SNVBAGLBSA-N	310.806	4.503	5	20	DJBD	
CCCOc1ccccc1N[C@H](C)c1cccc([N+](=O)[O-])c1	387719258	MONBEYZCRLGZLB-CYBMUJFWSA-N	300.358	4.557	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1c(C)oc2ccccc12	546649342	MQLCDPLOLMFNKQ-CYBMUJFWSA-N	324.380	4.809	5	20	DJBD	
Cc1ccc(-c2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)o1	609675802	KGIIPCRCSMHLPU-UHFFFAOYSA-N	300.339	4.595	5	20	DJBD	
CCC[C@H](Nc1ccc(C(C)=O)cc1[N+](=O)[O-])c1ccccc1	8204883	FIDWSBIIGDFRLV-INIZCTEOSA-N	312.369	4.751	5	20	DJBD	
C[C@@H](N[C@@H]1CCc2cc(Cl)ccc21)c1cccc([N+](=O)[O-])c1	173361367	LNDVCBZJMVVSFO-PIGZYNQJSA-N	316.788	4.586	5	20	DJBD	
CC[C@H](Nc1cc(C)c([N+](=O)[O-])cc1Cl)c1c(C)noc1C	301830052	PLFHPQBICPTTCN-LBPRGKRZSA-N	323.780	4.725	5	20	DJBD	
O=[N+]([O-])c1cccc(SCc2csc(-c3ccco3)n2)c1	509085529	USXWKDMOOVAKMQ-UHFFFAOYSA-N	318.379	4.604	5	20	DJBD	
C[C@H](NCc1cccc([N+](=O)[O-])c1)c1ccc(F)c2ccccc12	556064967	TWQBNLPWKWAHQH-ZDUSSCGKSA-N	324.355	4.738	5	20	DJBD	
C[C@@H](N[C@H](C)c1ccc2ccccc2n1)c1cccc([N+](=O)[O-])c1	178687178	HPICIUROOBKSTB-ZIAGYGMSSA-N	321.380	4.555	5	20	DJBD	
Cc1cnc([C@@H](Nc2ccc(Cl)cc2[N+](=O)[O-])C2CC2)s1	301581458	NSYFHRRRKNWOIV-ZDUSSCGKSA-N	323.805	4.576	5	20	DJBD	
Cc1cnc(Oc2ccc(-c3ccccc3)cc2)c([N+](=O)[O-])c1	463051109	CLOMGPLSYDHQOA-UHFFFAOYSA-N	306.321	4.758	5	20	DJBD	
CCC(=O)c1ccc(NCc2coc3ccccc23)c([N+](=O)[O-])c1	480018919	PTRNKVDBISQUNI-UHFFFAOYSA-N	324.336	4.546	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1CCCc2ccccc21	532442733	URIJFDGNIZUSGY-IFXJQAMLSA-N	310.397	4.631	5	20	DJBD	
CCC[C@H](Nc1ccc([N+](=O)[O-])c(C(C)=O)c1)c1ccccc1	561104831	CEPWFEUJGYNIKF-KRWDZBQOSA-N	312.369	4.751	5	20	DJBD	
CC[C@H](OC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccccc1	733491637	NHSVJYZKPLXPEJ-AWEZNQCLSA-N	319.744	4.556	5	20	DJBD	
O=[N+]([O-])c1ccc(N[C@@H]2CCSc3ccc(F)cc32)c(F)c1	301094914	QPSAWCGYXIPIJR-CYBMUJFWSA-N	322.336	4.522	5	20	DJBD	
Cc1ccccc1[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)C(C)C	467863678	MAIQEBKHUUHRIY-HNAYVOBHSA-N	312.413	4.951	5	20	DJBD	
Cc1nc(CS[C@@H](C)c2ccccc2[N+](=O)[O-])c(C)s1	1341052939	XKACUKFTVMOLDW-VIFPVBQESA-N	308.428	4.663	5	20	DJBD	
COCc1cccc(CS[C@H](C)c2ccccc2[N+](=O)[O-])c1	446960650	ZZILEIOSCYDIAB-CYBMUJFWSA-N	317.410	4.736	5	20	DJBD	
CC(C)CCCNC(=O)c1cc2ccccc2c2cccnc12	514559512	PEFBJKITACMHPK-UHFFFAOYSA-N	306.409	4.554	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H]2CCc3c(C)cccc32)cc1[N+](=O)[O-]	540179315	QTVNWMVRIBHHTJ-KBXCAEBGSA-N	310.397	4.550	5	20	DJBD	
Cc1ccc(N[C@H]2CCc3c2cccc3[N+](=O)[O-])cc1Cl	863988130	ATSFBLRYPIMJGU-HNNXBMFYSA-N	302.761	4.656	5	20	DJBD	
Cc1ccc([C@@H](N[C@@H](C)c2cccc([N+](=O)[O-])c2)C2CC2)cc1	390962626	LIAOCCMNOGMDQS-IFXJQAMLSA-N	310.397	4.705	5	20	DJBD	
O=[N+]([O-])c1cccc(-c2nnc(-c3csc4ccccc34)o2)c1	1322247880	KITZXGBAIRVEBI-UHFFFAOYSA-N	323.333	4.527	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2nc(C(F)(F)F)cs2)cc1Cl	301747634	ZHZTYCZBTXDWMF-UHFFFAOYSA-N	324.667	4.516	5	20	DJBD	
CCC(=O)c1ccc(N[C@@H](C)c2cc(C)oc2C)c([N+](=O)[O-])c1	359460727	SLVYEWQIHUMSPM-NSHDSACASA-N	316.357	4.570	5	20	DJBD	
Cc1cc2cc(C(=O)Nc3ccc(C)c([N+](=O)[O-])c3)oc2cc1C	463241776	DOPDHILNWGTDQG-UHFFFAOYSA-N	324.336	4.519	5	20	DJBD	
COc1cc([N+](=O)[O-])ccc1[C@H](C)Nc1ccc(C)c(Cl)c1	863988197	FFMKZWRZHMAFKQ-NSHDSACASA-N	320.776	4.738	5	20	DJBD	
O=C(c1cc2ccccc2c2cccnc12)N1CCCCCCC1	915806205	JBOXQBUSCCQANM-UHFFFAOYSA-N	318.420	4.794	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H]2CCCc3ccccc32)cc1[N+](=O)[O-]	219866884	QXKCNWDTWKAPSO-KDOFPFPSSA-N	310.397	4.631	5	20	DJBD	
Cc1ccc(C)c([C@H](C)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1	319687770	BHXZNLPWWJRSEO-HOTGVXAUSA-N	312.413	4.932	5	20	DJBD	
O=[N+]([O-])c1cccc(CSCc2nc3ccccc3s2)c1	517962966	VAAQCVKZICIYQK-UHFFFAOYSA-N	316.407	4.638	5	20	DJBD	
Cc1cccc([C@H](NCc2ccccc2[N+](=O)[O-])C(C)(C)C)c1	521479842	IPYAFMVSOWZUKE-SFHVURJKSA-N	312.413	4.780	5	20	DJBD	
CC(C)c1ccc2c(c1)[C@@H](NCc1csc([N+](=O)[O-])c1)CC2	189617614	JTNWYBONZPJGRJ-INIZCTEOSA-N	316.426	4.557	5	20	DJBD	
Cc1cccc(C)c1NC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1	190391692	DYPITZAHPCRPGD-UHFFFAOYSA-N	312.369	4.587	5	20	DJBD	
Cc1cc(N[C@H](c2ccccc2Cl)C(C)C)ncc1[N+](=O)[O-]	470866767	YGZJQKDIJXIGNK-INIZCTEOSA-N	319.792	4.761	5	20	DJBD	
Cc1cccc2c1[C@H](C)C[C@H]2N[C@@H](C)c1cccc([N+](=O)[O-])c1	504900160	SAQYCBRCIPNFSF-QWQRMKEZSA-N	310.397	4.802	5	20	DJBD	
Cc1ccc([C@@H](C)N(C)Cc2ccc(Cl)cc2[N+](=O)[O-])cc1	523840193	YXPKYVCEOBWXNE-CYBMUJFWSA-N	318.804	4.750	5	20	DJBD	
C[C@@H](NC1(c2ccc(Cl)cc2)CC1)c1ccc([N+](=O)[O-])cc1	578659940	LCVXWJYGIFMWNW-GFCCVEGCSA-N	316.788	4.588	5	20	DJBD	
Cc1cc([C@@H](C)NCc2c(Cl)cccc2[N+](=O)[O-])ccc1F	451162219	MKWXIVBWBPBHJW-LLVKDONJSA-N	322.767	4.547	5	20	DJBD	
CC[C@@H](Nc1cnn([C@H](C)CC)c1C)c1cccc([N+](=O)[O-])c1	477923077	NHZSZMGUIHZOLK-MLGOLLRUSA-N	316.405	4.634	5	20	DJBD	
Cc1c([C@@H](C)Nc2ccc3scnc3c2)cccc1[N+](=O)[O-]	488484601	UZSMCUTUKSCNBP-LLVKDONJSA-N	313.382	4.686	5	20	DJBD	
CSc1ccc(C)c(NCc2ccc(C)c([N+](=O)[O-])c2)c1	540499964	RIIQAVGQXHYRRF-UHFFFAOYSA-N	302.399	4.546	5	20	DJBD	
Cc1nc(SCc2ccc(Cl)cc2[N+](=O)[O-])sc1C	741856205	HPVVKIKSMNEPRB-UHFFFAOYSA-N	314.819	4.614	5	20	DJBD	
COc1ccc(/C=C(\C)c2ccc3ccccc3n2)cc1[N+](=O)[O-]	1325205367	QQYHACSQQXMKPG-ACCUITESSA-N	320.348	4.712	5	20	DJBD	
C[C@H](Nc1ccc2oc(C3CC3)nc2c1)c1ccccc1[N+](=O)[O-]	78972632	UQZOPVBNGJVZEP-NSHDSACASA-N	323.352	4.787	5	20	DJBD	
Cc1ccc(C)c(NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1	137321052	XJRCLUXMWQGBRY-UHFFFAOYSA-N	319.748	4.509	5	20	DJBD	
CCC(=O)c1ccc(N[C@H](C)c2cc(C)oc2C)c([N+](=O)[O-])c1	359460726	SLVYEWQIHUMSPM-LLVKDONJSA-N	316.357	4.570	5	20	DJBD	
CC[C@H](Sc1ccc([N+](=O)[O-])cn1)c1ccc(F)cc1F	532587773	WYMFAVMBVAOAAV-ZDUSSCGKSA-N	310.325	4.511	5	20	DJBD	
C[C@H](SCc1cnn(C(C)(C)C)c1)c1ccccc1[N+](=O)[O-]	1330684444	FMLRHQBOPYQXGT-LBPRGKRZSA-N	319.430	4.541	5	20	DJBD	
O=[N+]([O-])c1ccc(N[C@@H]2CC[C@@H]3CCC[C@@H]3C2)c2ccncc12	462904418	UQOOPYLPDBIUIQ-BFHYXJOUSA-N	311.385	4.524	5	20	DJBD	
O=[N+]([O-])c1cccc2nc(/C=C\c3cc(F)ccc3F)ccc12	514572085	QVHSEACWZXOEDM-XQRVVYSFSA-N	312.275	4.592	5	20	DJBD	
O=[N+]([O-])c1cnc(Oc2cc(Cl)cc(Cl)c2)c(Cl)c1	522936635	VHZDZTNLURGHJL-UHFFFAOYSA-N	319.531	4.742	5	20	DJBD	
O=[N+]([O-])c1ccc(CSCc2cc(C3CC3)no2)c(Cl)c1	596410734	WJELCOAEYGRZOT-UHFFFAOYSA-N	324.789	4.547	5	20	DJBD	
COCCCC[C@H](Nc1ccc([N+](=O)[O-])s1)c1ccccc1	619501133	VHDMSCGLBALJEY-AWEZNQCLSA-N	320.414	4.626	5	20	DJBD	
C[C@@H](Nc1ccc(F)cc1[N+](=O)[O-])c1cc2ccccc2o1	26759514	MPOONXFKHDYPOM-SNVBAGLBSA-N	300.289	4.653	5	20	DJBD	
Cc1c([C@H](C)N[C@@H](C)c2ccccc2Cl)cccc1[N+](=O)[O-]	479766604	QEDHCRBSICNNRK-STQMWFEESA-N	318.804	4.968	5	20	DJBD	
O=[N+]([O-])c1ccc(SCCC(F)(F)F)cc1C(F)(F)F	480787118	QETVCQNEYRJEBH-UHFFFAOYSA-N	319.226	4.658	5	20	DJBD	
CCC[C@H](C)CC(=O)N(c1cccc([N+](=O)[O-])c1)C1CCCC1	522873271	SKHQOUOBSUNHSN-AWEZNQCLSA-N	318.417	4.697	5	20	DJBD	
Cc1c([C@H](C)Nc2cccc(OC(F)F)c2)cccc1[N+](=O)[O-]	538497819	QSGCPNKBFILCLC-NSHDSACASA-N	322.311	4.678	5	20	DJBD	
COc1ccc(CSC/C=C/c2ccccc2)cc1[N+](=O)[O-]	552480728	CQXCAPBIYXFJLZ-VMPITWQZSA-N	315.394	4.550	5	20	DJBD	
Cc1ccc(NCc2ccc(Cl)cc2[N+](=O)[O-])cc1Cl	50443037	DITRLYQPIIGTBM-UHFFFAOYSA-N	311.168	4.822	5	20	DJBD	
C[C@H](Nc1cccc(CC(F)(F)F)c1)c1ccc([N+](=O)[O-])cc1	179975899	MSBORCVHRKANNR-NSHDSACASA-N	324.302	4.873	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H](c2ccccc2)C2CC2)cc1[N+](=O)[O-]	192796419	ZJRDIPLTXMBNQA-IFXJQAMLSA-N	310.397	4.705	5	20	DJBD	
Cc1ccc(CN[C@H](c2ccccc2)C2CCCC2)cc1[N+](=O)[O-]	520216989	BDBIPIJDXHOGOV-HXUWFJFHSA-N	324.424	4.924	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2ncc(Cl)s2)c2ccccc12	613184146	PFECNORGQHTWPA-UHFFFAOYSA-N	306.730	4.650	5	20	DJBD	
Cc1noc(C)c1CNCc1c2ccccc2cc2ccccc12	63550389	GXGVSSCKBOYFKU-UHFFFAOYSA-N	316.404	4.888	5	20	DJBD	
C[C@H](Sc1ncccc1[N+](=O)[O-])c1ccc2ccccc2c1	65692327	OYDDNJUTWUBGFT-LBPRGKRZSA-N	310.378	4.996	5	20	DJBD	
CSc1ccc([C@H](C)N[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1	315640778	ZCITXCLBZQUDJC-OLZOCXBDSA-N	316.426	4.729	5	20	DJBD	
O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@@H]1CCCc3ccccc31)CCC2	447517810	UMFONYNIDNPXON-WOJBJXKFSA-N	322.408	4.639	5	20	DJBD	
CCN(Cc1cccs1)[C@@H](C)c1cc([N+](=O)[O-])ccc1C	485743067	JMHXHRAPCNFROT-ZDUSSCGKSA-N	304.415	4.548	5	20	DJBD	
CC(=O)c1ccc(N[C@H](c2ccccc2C)C2CC2)c([N+](=O)[O-])c1	488275329	YNNFQXBPMAHALH-IBGZPJMESA-N	324.380	4.669	5	20	DJBD	
Cc1ccc2c(c1)CC[C@H]2N[C@@H](C)c1cc([N+](=O)[O-])ccc1C	539042160	VWDQSIKVVRPIQH-IFXJQAMLSA-N	310.397	4.550	5	20	DJBD	
O=C(Nc1cccc(-c2ccccc2)c1)c1ccc([N+](=O)[O-])s1	557930089	UUSUVAPNXDVURY-UHFFFAOYSA-N	324.361	4.576	5	20	DJBD	
CC[C@H](N[C@@H](CC)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1	342294969	OPRNCZXKZPESFJ-ROUUACIJSA-N	316.376	4.926	5	20	DJBD	
Cc1ccc([C@@H](NCc2ccc([N+](=O)[O-])cc2)C2CCC2)cc1	427718346	LZDGURMHZVMQOO-IBGZPJMESA-N	310.397	4.534	5	20	DJBD	
CCC(=O)c1ccc(Oc2ccc(F)cc2Cl)c([N+](=O)[O-])c1	479848453	FPDZQEDQTWAXPC-UHFFFAOYSA-N	323.707	4.772	5	20	DJBD	
Cc1cccc2c1[C@H](C)C[C@@H]2N[C@@H](C)c1cccc([N+](=O)[O-])c1	504900157	SAQYCBRCIPNFSF-GLJUWKHASA-N	310.397	4.802	5	20	DJBD	
O=[N+]([O-])c1ccc2c(c1)[C@@H](Nc1cccc3ccncc13)CCC2	577932653	MAILUMNPAPANPR-SFHVURJKSA-N	319.364	4.633	5	20	DJBD	
CCSc1ccc([C@H](C)Nc2ccc([N+](=O)[O-])c(C)n2)cc1	301650410	PQKBUEZYESVDDP-NSHDSACASA-N	317.414	4.583	5	20	DJBD	
C[C@@H](SCc1cccc([N+](=O)[O-])c1)c1c(F)cccc1F	604046782	DFLZECFTKRYMRY-SNVBAGLBSA-N	309.337	4.867	5	20	DJBD	
Cc1ccc([C@@H](C)Nc2ccc([N+](=O)[O-])c3cccnc23)s1	53582194	IHDSBMJLWQEIEP-LLVKDONJSA-N	313.382	4.686	5	20	DJBD	
COc1ccccc1[C@H](C)SCc1ccccc1[N+](=O)[O-]	140635982	NKVHXEXRSMQWQS-LBPRGKRZSA-N	303.383	4.598	5	20	DJBD	
CC(C)[C@H](Nc1ccc([N+](=O)[O-])c2cnccc12)c1ccccc1	248216775	GPSZFUYEHDGGKZ-IBGZPJMESA-N	321.380	4.952	5	20	DJBD	
C[C@@H](Nc1ccc(F)cc1[N+](=O)[O-])c1nc(C(C)(C)C)cs1	301181268	HZHBFYHWNVMNNC-SECBINFHSA-N	323.393	4.661	5	20	DJBD	
C[C@@H](CSCc1ccc(Cl)cc1[N+](=O)[O-])C(F)(F)F	439061816	KZEPFNOPXPJCAG-ZETCQYMHSA-N	313.728	4.680	5	20	DJBD	
CCc1ccc(Oc2nc3ccccc3cc2[N+](=O)[O-])c(OC)c1	473524607	OZVAKCLCBRDRMJ-UHFFFAOYSA-N	324.336	4.506	5	20	DJBD	
CC(C)Oc1ccccc1[C@H](C)Nc1ccc([N+](=O)[O-])s1	604409317	XDRHPCCNNOTLFF-NSHDSACASA-N	306.387	4.617	5	20	DJBD	
CC(C)[C@H]1CC[C@H](c2nnc(-c3cccc([N+](=O)[O-])c3)o2)CC1	1348882101	MBVNPJAKFBUHOD-JOCQHMNTSA-N	315.373	4.575	5	20	DJBD	
C[C@@H](Nc1ccc2oc(C3CC3)nc2c1)c1ccccc1[N+](=O)[O-]	78972634	UQZOPVBNGJVZEP-LLVKDONJSA-N	323.352	4.787	5	20	DJBD	
Cc1ccc(N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1-c1ncco1	180007685	JRTIBJFLEBVSQS-ZDUSSCGKSA-N	323.352	4.731	5	20	DJBD	
COc1cccc(N[C@H](C)c2cc3ccccc3o2)c1[N+](=O)[O-]	302625290	FHOSOLLHARHOIV-LLVKDONJSA-N	312.325	4.523	5	20	DJBD	
COc1ccc([N+](=O)[O-])cc1CS[C@@H](C)c1cccs1	737404739	VSCKLYMVGXRIHE-JTQLQIEISA-N	309.412	4.659	5	20	DJBD	
C[C@H](Sc1ncnc2sc([N+](=O)[O-])cc12)c1cccs1	804476985	QTZDLHSMCGIAJQ-ZETCQYMHSA-N	323.424	4.514	5	20	DJBD	
O=[N+]([O-])c1ccc2nc3c(c(-c4ccccc4)c2c1)CSCC3	24513164	QPOKEWAEGNOWLD-UHFFFAOYSA-N	322.389	4.599	5	20	DJBD	
CC(=O)c1ccc(S[C@@H](C)c2ccc(F)cc2)c([N+](=O)[O-])c1	301117973	VAPGAHMADYPUFQ-NSHDSACASA-N	319.357	4.790	5	20	DJBD	
CSCc1cccc(N[C@H]2CCc3c2cccc3[N+](=O)[O-])c1	594504308	HYOMNVCHDBKXNW-INIZCTEOSA-N	314.410	4.557	5	20	DJBD	
CCCCc1nc(CSCc2ccccc2[N+](=O)[O-])cs1	609237158	HRFIOXGFXKQBKB-UHFFFAOYSA-N	322.455	4.827	5	20	DJBD	
C[C@@H]1C[C@H](NCc2c3ccccc3cc3ccccc23)CCO1	769710743	PFFZYFYUZQEAMG-CRAIPNDOSA-N	305.421	4.650	5	20	DJBD	
O=[N+]([O-])c1cc(C(F)F)ccc1N1CCC[C@H]1c1cccs1	809343353	JCECDGKKIWLWBK-LBPRGKRZSA-N	324.352	4.935	5	20	DJBD	
O=[N+]([O-])c1ccccc1CSCc1ccc2ncccc2c1	1320626002	QHQFWEHHKRENCV-UHFFFAOYSA-N	310.378	4.576	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H]2CCCc3ccccc32)cc1[N+](=O)[O-]	219866809	QXKCNWDTWKAPSO-RDTXWAMCSA-N	310.397	4.631	5	20	DJBD	
Cc1ccc([C@H](C)Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)cc1	462778968	RAUSAQLYKMCAAD-NSHDSACASA-N	322.311	4.678	5	20	DJBD	
CSCc1ccc(N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1	540835835	SCRMDMZMYVQDKN-CYBMUJFWSA-N	316.426	4.939	5	20	DJBD	
C[C@@H](Nc1ccc(OCC2CC2)cc1)c1ccc([N+](=O)[O-])cc1	749840669	ODALHHWHXLPSNB-CYBMUJFWSA-N	312.369	4.557	5	20	DJBD	
CSc1cc(C)ccc1NCc1ccc(C)c([N+](=O)[O-])c1	864039786	BUJLPILICUKMCT-UHFFFAOYSA-N	302.399	4.546	5	20	DJBD	
C[C@H](Nc1ncc([N+](=O)[O-])s1)c1cc(Cl)ccc1Cl	409655323	ZYIQPQLTCCVLAY-LURJTMIESA-N	318.185	4.531	5	20	DJBD	
O=[N+]([O-])c1ccccc1CSc1nc(-c2ccccc2)co1	436259080	JUHNAVLSCZRBIM-UHFFFAOYSA-N	312.350	4.542	5	20	DJBD	
CC[C@H](NCc1cccc([N+](=O)[O-])c1C)c1ccc(Cl)s1	544452735	XXODCULJJADSOJ-LBPRGKRZSA-N	324.833	4.859	5	20	DJBD	
O=[N+]([O-])c1ccc(/C=C/c2nc(C3CCCCCC3)no2)cc1	904677657	CLIXQOXHAFFXJO-FMIVXFBMSA-N	313.357	4.586	5	20	DJBD	
O=[N+]([O-])c1ccc(NCc2cc3ccccc3o2)c2ccncc12	97476240	BNNGUWZLQJSCDM-UHFFFAOYSA-N	319.320	4.501	5	20	DJBD	
Cc1cc([C@H](C)Nc2ccc3cc([N+](=O)[O-])ccc3n2)c(C)o1	301128481	RXZCGAIEXGRVJO-NSHDSACASA-N	311.341	4.526	5	20	DJBD	
Cc1ccc2cc([C@H](C)NCc3ccccc3[N+](=O)[O-])oc2c1	426039643	OFOUZIJNVOFPSL-ZDUSSCGKSA-N	310.353	4.500	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@@H](C)CCC(C)(C)C	544401794	PSPXCKDYJWTPFM-LBPRGKRZSA-N	306.406	4.613	5	20	DJBD	
COCc1ccc(SCc2ccc(Cl)c([N+](=O)[O-])c2)cc1	768400645	UMFLMFREEOYQPO-UHFFFAOYSA-N	323.801	4.687	5	20	DJBD	
O=[N+]([O-])c1cc(F)ccc1NCc1csc2ccccc12	48337136	DOEODCBNXZSTKU-UHFFFAOYSA-N	302.330	4.561	5	20	DJBD	
CCc1ccc([C@@H](NCc2ccccc2[N+](=O)[O-])C(C)C)cc1	61030898	RTNYJBSRAOVGFM-IBGZPJMESA-N	312.413	4.644	5	20	DJBD	
C[C@H](N[C@@H]1CCc2cc(Cl)ccc21)c1ccc([N+](=O)[O-])cc1	178649565	NSGGEJBZIHCZFR-APPDUMDISA-N	316.788	4.586	5	20	DJBD	
C[C@H](SCCCCOC(C)(C)C)c1ccccc1[N+](=O)[O-]	473796850	FKCVFPMZVFOPKL-ZDUSSCGKSA-N	311.447	4.984	5	20	DJBD	
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@H]1c1ccccc1	498837511	LOYIBMXZUOODTK-ZDUSSCGKSA-N	322.286	4.565	5	20	DJBD	
CC[C@@H](NCc1c(F)cccc1[N+](=O)[O-])c1ccc(Cl)cc1	505614446	UKRCXBSOJGJGKL-OAHLLOKOSA-N	322.767	4.628	5	20	DJBD	
CCC(C)(C)NCc1ccc(-c2ccccc2[N+](=O)[O-])s1	518273861	LHHYUGQGVDCDJJ-UHFFFAOYSA-N	304.415	4.602	5	20	DJBD	
Cc1ccccc1[C@@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)C1CC1	532510982	BFVFHSIOPRKZKE-KUHUBIRLSA-N	310.397	4.705	5	20	DJBD	
O=C(O)c1c2ccccc2c(C(=O)O)c2cc3ccccc3cc12	2113919171	WETXVVRAXPAVOC-UHFFFAOYSA-N	316.312	4.543	5	20	DJBD	
C[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1c(F)cccc1Cl	90180321	IQNVDGSVTOIGBY-MNOVXSKESA-N	322.767	4.799	5	20	DJBD	
C[C@H](N[C@H](C)c1ccc(F)cc1Cl)c1ccc([N+](=O)[O-])cc1	178657469	RIGPGWDXFXCIIS-WDEREUQCSA-N	322.767	4.799	5	20	DJBD	
Cc1ccc([C@@H](C)Nc2ccc3ccn(C)c3c2)cc1[N+](=O)[O-]	443091712	IEULPMQMFLDWIS-CYBMUJFWSA-N	309.369	4.568	5	20	DJBD	
C[C@H](c1ccc(F)cc1)N(C)Cc1cc([N+](=O)[O-])ccc1Cl	788464017	LYJJFBFGTIVBJO-LLVKDONJSA-N	322.767	4.580	5	20	DJBD	
CN(Cc1csc2ccccc12)c1ccsc1[N+](=O)[O-]	63262335	CVDXSRVPLDLZNE-UHFFFAOYSA-N	304.396	4.507	5	20	DJBD	
Cc1ccccc1C(C)(C)NCc1ccc([N+](=O)[O-])cc1Cl	549867690	AJTVAHZMOZZYAU-UHFFFAOYSA-N	318.804	4.582	5	20	DJBD	
C[C@@H](c1ccccc1[N+](=O)[O-])N1C[C@H](c2ccccc2)C[C@H]1C	441399099	UOKCDYHUYZVBAH-HLLBOEOZSA-N	310.397	4.534	5	20	DJBD	
Cc1cc(OCc2cccc(C(F)F)c2)c(F)cc1[N+](=O)[O-]	475896070	JNQOQMIMGCHHKU-UHFFFAOYSA-N	311.259	4.559	5	20	DJBD	
O=[N+]([O-])c1cnc(Oc2ccc3oc4ccccc4c3c2)s1	619693829	WOAPWVQTQMZNSO-UHFFFAOYSA-N	312.306	4.743	5	20	DJBD	
C[C@@H](N[C@H](C)c1ccccc1Cl)c1ccc([N+](=O)[O-])cc1	37177050	WSBPRKZWXZAGQP-VXGBXAGGSA-N	304.777	4.660	5	20	DJBD	
CC(C)Oc1cccc([C@H](C)Nc2cccc(F)c2[N+](=O)[O-])c1	919963976	ZHQNKQXUGKEGEJ-LBPRGKRZSA-N	318.348	4.694	5	20	DJBD	
O=[N+]([O-])c1ccc(SCc2ccc3ncccc3c2)c(F)c1	618964517	USPVCTLSEXRKPJ-UHFFFAOYSA-N	314.341	4.574	5	20	DJBD	
Cc1c([C@@H](C)Nc2cccc(F)c2[N+](=O)[O-])oc2ccccc12	919963434	PAHBTRPWCGNETN-LLVKDONJSA-N	314.316	4.962	5	20	DJBD	
O=[N+]([O-])c1ccc2sc(-c3nnc(C4CCCC4)o3)cc2c1	1117246069	YPHYGHVPIFWQSO-UHFFFAOYSA-N	315.354	4.517	5	20	DJBD	
C[C@@H](Nc1cccc(CC(F)(F)F)c1)c1cccc([N+](=O)[O-])c1	179975945	ITMOHPFNPCXWGD-LLVKDONJSA-N	324.302	4.873	5	20	DJBD	
C[C@@H](NC(=O)CCCC1CCCCC1)c1cccc([N+](=O)[O-])c1	515681866	LDAFBKOHPJVVBD-CQSZACIVSA-N	318.417	4.523	5	20	DJBD	
CSc1ccc([C@@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1	192756299	DJIBSZJAHXBMOK-OLZOCXBDSA-N	316.426	4.729	5	20	DJBD	
Cc1ccc2c(c1)CC[C@H]2N[C@H]1CCCc2ccc([N+](=O)[O-])cc21	447530384	MNMJXHOHBIASAQ-VQTJNVASSA-N	322.408	4.558	5	20	DJBD	
CC1(NCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CCC1	537490503	ABZAREUDJNGTTB-UHFFFAOYSA-N	320.776	4.540	5	20	DJBD	
C[C@H](Sc1ccc([N+](=O)[O-])cc1F)c1c(F)cccc1F	604433705	SNAFJHAWBKBCNZ-QMMMGPOBSA-N	313.300	4.865	5	20	DJBD	
C[C@@H](N[C@@H]1CCc2ccc(Cl)cc21)c1ccc([N+](=O)[O-])cc1	858582077	MLFWIPWOZNGORA-PIGZYNQJSA-N	316.788	4.586	5	20	DJBD	
Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1oc2ccccc2c1C	193678933	XGJFIMNERBRBKR-UHFFFAOYSA-N	324.336	4.519	5	20	DJBD	
CSc1ccccc1[C@@H](C)N[C@H](C)c1cccc([N+](=O)[O-])c1	194866958	WNUVVEUWJKOVDB-CHWSQXEVSA-N	316.426	4.729	5	20	DJBD	
C[C@@H]1CC[C@@H](N[C@H](C)c2cccc([N+](=O)[O-])c2)c2ccccc21	322132114	YVOZDBSXTWHVQA-PJIJBLCYSA-N	310.397	4.884	5	20	DJBD	
CC[C@@H](N[C@H](CC(F)(F)F)C(C)C)c1cccc([N+](=O)[O-])c1	437071806	AOUNGXRXMKPFCJ-ZIAGYGMSSA-N	318.339	4.613	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)c(CSc2ncccc2Cl)c1	79422301	SGUCTSHEUWQBOM-UHFFFAOYSA-N	315.181	4.589	5	20	DJBD	
CC[C@@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F	178657711	UILBMRCLWQUUCA-PIGZYNQJSA-N	320.339	4.675	5	20	DJBD	
Cc1ccc([C@H]2CCCCCN2Cc2ccccc2[N+](=O)[O-])o1	303784275	TUSUZLDALUHAJJ-QGZVFWFLSA-N	314.385	4.614	5	20	DJBD	
CC[C@@H](Nc1ncc(C)cc1[N+](=O)[O-])c1ccc(Cl)cc1	463052457	IDPNAHYQDIUONU-CYBMUJFWSA-N	305.765	4.515	5	20	DJBD	
COc1ccccc1CS[C@@H](C)c1ccccc1[N+](=O)[O-]	463188046	BGHHQJINWFOTTK-LBPRGKRZSA-N	303.383	4.598	5	20	DJBD	
Cc1cc(Oc2ccc(-c3ccccc3)cc2)ncc1[N+](=O)[O-]	470865775	IKGWCLMSDZMWPH-UHFFFAOYSA-N	306.321	4.758	5	20	DJBD	
CC[C@H](Nc1ccc(N(C)C)c(C)c1)c1cccc([N+](=O)[O-])c1	777643675	VEPGKPIYQNSKOJ-KRWDZBQOSA-N	313.401	4.532	5	20	DJBD	
Cc1ccc(NC(=O)c2oc3c(C)cccc3c2C)cc1[N+](=O)[O-]	64696572	XLEGZVDSUSNSKS-UHFFFAOYSA-N	324.336	4.519	5	20	DJBD	
C[C@@H](NCc1cccc2ccccc12)c1ccc([N+](=O)[O-])cc1	195260176	RZRMVPSQBNMOTO-CQSZACIVSA-N	306.365	4.599	5	20	DJBD	
O=[N+]([O-])c1ccc(/C(=C/c2cccc(F)c2)c2ccncc2)cc1	215737016	AXSQKHCNNGRRQH-UYRXBGFRSA-N	320.323	4.718	5	20	DJBD	
CCC[C@@H](Nc1ccccc1OC)c1cccc([N+](=O)[O-])c1	314279836	BGDUDWCIBKOOHY-OAHLLOKOSA-N	300.358	4.557	5	20	DJBD	
O=[N+]([O-])c1cccc(-c2noc(-c3ccc4sccc4c3)n2)c1	546937555	OTMVQYYSNVKWSP-UHFFFAOYSA-N	323.333	4.527	5	20	DJBD	
CSc1cccc(NCc2ccc(Cl)c([N+](=O)[O-])c2)c1C	774585829	LSSTUUABBOUVRD-UHFFFAOYSA-N	322.817	4.891	5	20	DJBD	
COC(=O)[C@@](C)(F)c1cccc2c1ccc1c(F)cc(F)cc12	98178042	LZLMUPDHMXYBTB-SFHVURJKSA-N	318.294	4.629	5	20	DJBD	
CC[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1cc(F)ccc1F	173437932	RWTWVPLJWNBEQO-APPDUMDISA-N	320.339	4.675	5	20	DJBD	
CCN(Cc1ccc([N+](=O)[O-])cc1)[C@H](C)c1cc2ccccc2o1	479595176	RDRSQASEWVUBLE-CQSZACIVSA-N	324.380	4.924	5	20	DJBD	
C[C@H](N[C@H](C)c1nccc2ccccc12)c1cccc([N+](=O)[O-])c1	562082644	SNJDSUWZWXJHPC-UONOGXRCSA-N	321.380	4.555	5	20	DJBD	
c1ccc2c(CN3CC[C@]4(CCOC4)C3)c3ccccc3cc2c1	769534754	XFZBTKBVTHKHIO-QFIPXVFZSA-N	317.432	4.605	5	20	DJBD	
CC[C@@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1	79723745	XMDOEPDYJWKGCB-SJKOYZFVSA-N	302.349	4.536	5	20	DJBD	
Cc1ccc2c(c1)[C@H](NCc1ccc(C(C)C)c([N+](=O)[O-])c1)CC2	609288396	QYLFBSKNSSCCSB-LJQANCHMSA-N	324.424	4.804	5	20	DJBD	
CC(=O)c1ccc(N2CCCC[C@H]2c2ccccc2)c([N+](=O)[O-])c1	762816242	NXNOEVJIHTWJBP-KRWDZBQOSA-N	324.380	4.529	5	20	DJBD	
Cc1ccc(CN[C@H](C)c2ccc(F)cc2Cl)cc1[N+](=O)[O-]	76761522	NGRGWKPCTMUJBD-LLVKDONJSA-N	322.767	4.547	5	20	DJBD	
CSc1ccc([C@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1	192756309	DJIBSZJAHXBMOK-QWHCGFSZSA-N	316.426	4.729	5	20	DJBD	
CC(C)[C@@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])c2ccccc21	447572257	AWSZJRFDELBLHN-ZWKOTPCHSA-N	310.397	4.569	5	20	DJBD	
Cc1ccccc1[C@@H](NCc1ccccc1[N+](=O)[O-])C(C)(C)C	540458913	SKFWGQVSKWQTME-GOSISDBHSA-N	312.413	4.780	5	20	DJBD	
Cc1c(NCc2ccccc2[N+](=O)[O-])cccc1C(F)(F)F	864019041	KTOBOUNXPZSHIC-UHFFFAOYSA-N	310.275	4.534	5	20	DJBD	
Cc1ccc([C@@H]2CCCCCN2Cc2ccc([N+](=O)[O-])cc2)o1	303734873	GCRCRYJLQRXOBW-KRWDZBQOSA-N	314.385	4.614	5	20	DJBD	
CCCOc1cccc(N[C@H](C)c2ccccc2[N+](=O)[O-])c1	315866712	MYKABEOHTALVMD-CYBMUJFWSA-N	300.358	4.557	5	20	DJBD	
CC(C)c1ccc(CNC(C)(C)c2cccs2)cc1[N+](=O)[O-]	523975588	FHGUEKUFCGAPOE-UHFFFAOYSA-N	318.442	4.805	5	20	DJBD	
O=[N+]([O-])c1cc(CNc2ccc(C3CC3)cc2)ccc1Cl	771683686	JAOJOZILHXRNJN-UHFFFAOYSA-N	302.761	4.738	5	20	DJBD	
Cc1ccc(Oc2nc3ccc([N+](=O)[O-])cc3s2)cc1C	111103497	NPKAYRZXQQBJRB-UHFFFAOYSA-N	300.339	4.614	5	20	DJBD	
C[C@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)c1cccc(C2CC2)c1	451118662	YBPKHZBNQVEDTH-KGLIPLIRSA-N	310.397	4.884	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)Nc1ccc2ccn(C)c2c1	526948912	DMBTZSQITUYZFY-ZDUSSCGKSA-N	309.369	4.568	5	20	DJBD	
Cc1cccc(C(C)(C)NCc2ccc([N+](=O)[O-])cc2Cl)c1	542053839	VEUCOMBPDNZZLL-UHFFFAOYSA-N	318.804	4.582	5	20	DJBD	
O=[N+]([O-])c1ccc2sc(/C=C/c3ccccc3F)nc2c1	7746204	RIRBXCVJVACKBC-VMPITWQZSA-N	300.314	4.514	5	20	DJBD	
Cc1cccc2c1CC[C@@H]2NCc1ccc(C(C)C)c([N+](=O)[O-])c1	609223760	VXGBRUNIZUTAMN-IBGZPJMESA-N	324.424	4.804	5	20	DJBD	
Cc1ccnc(Oc2ccc(Cc3ccccc3)cc2)c1[N+](=O)[O-]	609669968	AFWNESHQQDHJFJ-UHFFFAOYSA-N	320.348	4.681	5	20	DJBD	
CCC[C@@H](Nc1cccc(OC)c1F)c1cccc([N+](=O)[O-])c1	769982879	XQAOMUUWIOPARU-CQSZACIVSA-N	318.348	4.696	5	20	DJBD	
COc1ccc([C@@H](C)Nc2ccc(Cl)cc2[N+](=O)[O-])cc1F	61174400	WVBFQNVRGMNDFZ-SECBINFHSA-N	324.739	4.569	5	20	DJBD	
CC[C@H](NCc1coc2ccccc12)c1cccc([N+](=O)[O-])c1	90224790	BJHXZSVOTDBBDI-KRWDZBQOSA-N	310.353	4.582	5	20	DJBD	
Cc1ccc(CN[C@H](c2ccc(F)cc2)C(C)C)cc1[N+](=O)[O-]	378893006	MHDONTIEBDGQCN-SFHVURJKSA-N	316.376	4.529	5	20	DJBD	
C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H]1c1cccs1	432978043	QGAYVQXWCDQSCT-WFASDCNBSA-N	302.399	4.554	5	20	DJBD	
COc1ccccc1[C@@H](C)SCc1cccc([N+](=O)[O-])c1C	463209665	KYPSFHYBOLDOGI-CYBMUJFWSA-N	317.410	4.906	5	20	DJBD	
CCC[C@@H](CC)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1	517547284	KTMWUIJNTLYLDC-CQSZACIVSA-N	302.374	4.523	5	20	DJBD	
O=[N+]([O-])c1cc(CNC2(c3ccccc3)CCCCC2)cs1	533068715	QNQNLJGJWZBXRQ-UHFFFAOYSA-N	316.426	4.606	5	20	DJBD	
O=[N+]([O-])c1sccc1NCc1ccc(OC2CCCC2)cc1	604548859	YOSDCLFQICOICT-UHFFFAOYSA-N	318.398	4.590	5	20	DJBD	
CCCCCc1ccc(NC(=O)c2ccccc2[N+](=O)[O-])cc1	14598445	NJFJUAOBLHDLNP-UHFFFAOYSA-N	312.369	4.580	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](c1ccccc1)C1CC1	120383986	XIXSJSBINOLDHH-IFXJQAMLSA-N	310.397	4.705	5	20	DJBD	
C[C@@H](Nc1cccc(F)c1[N+](=O)[O-])c1nc(C(C)(C)C)cs1	301165052	BWYJZNZBYRKRPJ-SECBINFHSA-N	323.393	4.661	5	20	DJBD	
Cc1cc(NCc2ccccc2[N+](=O)[O-])ccc1-c1ccncc1	427425084	SWPMWIWEQDBVGM-UHFFFAOYSA-N	319.364	4.577	5	20	DJBD	
CC[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1F	449347145	FVABTQOVDHWLDB-YVEFUNNKSA-N	302.349	4.536	5	20	DJBD	
Cc1cccnc1NC(=O)c1c2ccccc2cc2ccccc12	1318927301	ALGVEFGKGWRQPJ-UHFFFAOYSA-N	312.372	4.949	5	20	DJBD	
O=[N+]([O-])c1ccc(Sc2ccccc2Cl)c2ccncc12	15208167	BZABSYVOBXNCMM-UHFFFAOYSA-N	316.769	4.948	5	20	DJBD	
CC[C@H](N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1cccs1	49529262	UJFHJSOWYVDRCK-OCCSQVGLSA-N	304.415	4.767	5	20	DJBD	
C[C@H](NCc1ccccc1[N+](=O)[O-])c1cc2ccccc2s1	184365700	PAWIRIJDFLDCQS-LBPRGKRZSA-N	312.394	4.660	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)SCc1nc(C)c(C)s1	486075032	LFWYFCDGCSNFRQ-GFCCVEGCSA-N	322.455	4.971	5	20	DJBD	
CC[C@@H](N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccccc1F	494020881	PQXJEUVHHJTOJV-CXAGYDPISA-N	316.376	4.844	5	20	DJBD	
CSc1ccc(Nc2ccc([N+](=O)[O-])c3cnccc23)cc1	515337708	MVHOJYQLDMQGKU-UHFFFAOYSA-N	311.366	4.609	5	20	DJBD	
CCCCC[C@H](CC)c1nnc(-c2cccc([N+](=O)[O-])c2)o1	1329246934	OIBULLUUNHRTKU-LBPRGKRZSA-N	303.362	4.719	5	20	DJBD	
CC[C@@H](Sc1ncccc1[N+](=O)[O-])c1ccc(Cl)cc1	64368466	ORMGLWGFBDFOPY-CYBMUJFWSA-N	308.790	4.887	5	20	DJBD	
Cc1c([C@H](C)N[C@H]2CCCc3sccc32)cccc1[N+](=O)[O-]	134966818	VNGPUUBHLOPDJQ-WFASDCNBSA-N	316.426	4.693	5	20	DJBD	
O=[N+]([O-])c1ccc(CNCc2ccc(-c3ccccc3)s2)cc1	237983680	MNQRGMAEYAWSPJ-UHFFFAOYSA-N	324.405	4.613	5	20	DJBD	
Cc1nc(SCc2cc([N+](=O)[O-])ccc2Cl)sc1C	741859572	RXDKNCQJHOPDOL-UHFFFAOYSA-N	314.819	4.614	5	20	DJBD	
Cc1cc(Cl)ccc1NCc1ccc(Cl)cc1[N+](=O)[O-]	312608282	PXFZTEBNOOZILJ-UHFFFAOYSA-N	311.168	4.822	5	20	DJBD	
O=[N+]([O-])c1ccccc1CN[C@@H](CC1CCC1)c1ccccc1	344163438	HRXRPFAYTRKYAH-SFHVURJKSA-N	310.397	4.616	5	20	DJBD	
Cc1cccc(C(C)(C)NCc2c(Cl)cccc2[N+](=O)[O-])c1	494795881	SFOXFEJGFIPKQH-UHFFFAOYSA-N	318.804	4.582	5	20	DJBD	
COc1ccc(CS[C@@H](C)c2cccc(F)c2)cc1[N+](=O)[O-]	517939690	KIDPBNHXCHQASQ-NSHDSACASA-N	321.373	4.737	5	20	DJBD	
O=[N+]([O-])c1cc(F)c(CNc2ccc3ccccc3c2)c(F)c1	795250161	HXFFOVVRAGABJQ-UHFFFAOYSA-N	314.291	4.638	5	20	DJBD	
C[C@@H](NCc1ccc(C2CCC2)cc1)c1ccc([N+](=O)[O-])cc1	492433111	AHHCPOZURIFPJX-CQSZACIVSA-N	310.397	4.713	5	20	DJBD	
Cc1cccc([C@@H](C)NCc2ccc(Cl)cc2[N+](=O)[O-])c1C	539289784	QIGWVTYXMLMQGS-CYBMUJFWSA-N	318.804	4.716	5	20	DJBD	
C[C@H](N[C@@H]1CC(C)(C)Cc2occc21)c1cccc([N+](=O)[O-])c1	155792582	FSDKQQBHXHJECM-BLLLJJGKSA-N	314.385	4.552	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC1(c2ccccc2)CCC1	538569358	RKNUEVFEMXVJBA-HNNXBMFYSA-N	310.397	4.633	5	20	DJBD	
CC[C@H](N[C@@H]1CCCc2sccc21)c1cccc([N+](=O)[O-])c1	90918489	HSTAMSJLYNSWDV-JKSUJKDBSA-N	316.426	4.775	5	20	DJBD	
Cc1ccsc1/C=C(\Cl)c1nc2cc([N+](=O)[O-])ccc2o1	177618499	MIENNCDPYFANAY-YFHOEESVSA-N	320.757	4.843	5	20	DJBD	
COc1cccc(SCc2ccc(Cl)cc2[N+](=O)[O-])c1	501146502	XZPLSHNSQJXQMS-UHFFFAOYSA-N	309.774	4.549	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)SCCc1scnc1C	507103219	LJHQXACYXMWYEB-GFCCVEGCSA-N	322.455	4.705	5	20	DJBD	
CC[C@@H](Nc1ccc2cnn(CC)c2c1)c1cccc([N+](=O)[O-])c1	539734453	RGZYMCBHUSKMAU-QGZVFWFLSA-N	324.384	4.528	5	20	DJBD	
CC(C)Sc1ccccc1NCc1ccccc1[N+](=O)[O-]	552213709	BUULDFIJSIPMJN-UHFFFAOYSA-N	302.399	4.707	5	20	DJBD	
CCOc1cc(N[C@@H](CC)c2cccs2)ccc1[N+](=O)[O-]	111048586	BFMGAMXROORBEA-LBPRGKRZSA-N	306.387	4.618	5	20	DJBD	
CC[C@H](N[C@H](CC)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1	342294970	OPRNCZXKZPESFJ-ZWKOTPCHSA-N	316.376	4.926	5	20	DJBD	
CSc1cccc(NCc2c(F)cc([N+](=O)[O-])cc2F)c1C	506310815	QBQZDXTYRQYSIJ-UHFFFAOYSA-N	324.352	4.515	5	20	DJBD	
O=C(c1cc2cc([N+](=O)[O-])ccc2o1)c1cccc2ccccc12	545994363	FFAJRYJKAGGFAP-UHFFFAOYSA-N	317.300	4.725	5	20	DJBD	
O=[N+]([O-])c1ccc2nc(/C=C/c3scnc3C3CC3)ccc2c1	556056884	KGXIBZFKFQLOJZ-VMPITWQZSA-N	323.377	4.647	5	20	DJBD	
O=[N+]([O-])c1ccccc1/C=C/C=C/c1nc2ccccc2s1	508596736	FHEUCFMINCWXQO-CAOUKYIASA-N	308.362	4.931	5	20	DJBD	
C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[C@H]1c1ccc(Cl)cc1	511590590	CTZXSKVIWZUDAR-LRDDRELGSA-N	316.788	4.756	5	20	DJBD	
CCCCCS[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1	180731097	SKBATVFPAHRDAV-LLVKDONJSA-N	321.402	4.629	5	20	DJBD	
Cc1c([C@@H](C)NCc2ccc(Cl)cc2F)cccc1[N+](=O)[O-]	187577959	MBWJSQGHGSEZQZ-LLVKDONJSA-N	322.767	4.547	5	20	DJBD	
C[C@@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1	20545599	KRNGZNCKUMEFER-VXGBXAGGSA-N	304.777	4.660	5	20	DJBD	
C/C(=C\c1cccc([N+](=O)[O-])c1)CNCc1ccc(Cl)s1	468641661	LZDPTHSEZVXUAQ-YRNVUSSQSA-N	322.817	4.503	5	20	DJBD	
O=[N+]([O-])c1cc(F)ccc1Oc1ccc(-c2cscn2)cc1	610515981	QAYWEEMQKASOQZ-UHFFFAOYSA-N	316.313	4.650	5	20	DJBD	
O=[N+]([O-])c1ccc2sc(/C=C\c3cccc(F)c3)nc2c1	96767233	KQNFFOMWWVGLDC-DAXSKMNVSA-N	300.314	4.514	5	20	DJBD	
CC(C)OCc1ccc(N[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1	178649916	KZCMYRLLXNCWRD-CQSZACIVSA-N	314.385	4.693	5	20	DJBD	
CCOc1cc(N[C@H]2CCCc3sccc32)ccc1[N+](=O)[O-]	301201389	QJLSINJFXSJGBE-ZDUSSCGKSA-N	318.398	4.545	5	20	DJBD	
CCc1ccc([C@H](NCc2ccccc2[N+](=O)[O-])C(C)C)cc1	320202919	RTNYJBSRAOVGFM-LJQANCHMSA-N	312.413	4.644	5	20	DJBD	
Cc1cc(C)c([C@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c(C)c1	321939926	DXEMBHAUHCRPSC-HOTGVXAUSA-N	312.413	4.932	5	20	DJBD	
O=[N+]([O-])c1cnc(N[C@@H](c2ccc(Cl)cc2)C2CCC2)s1	443524477	URJWIJQBLUZANE-CYBMUJFWSA-N	323.805	4.658	5	20	DJBD	
Cc1c([C@H](C)N[C@H](c2cccs2)C2CC2)cccc1[N+](=O)[O-]	480241486	PBMWJKICRMFFNW-SJCJKPOMSA-N	316.426	4.767	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)cc(Cl)c1Oc1ccc2c[nH]nc2c1	516327260	WYGBWVLIZBRKKI-UHFFFAOYSA-N	324.123	4.570	5	20	DJBD	
C[C@@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc(F)c2ccccc12	551063137	KWVDTICFMWOFOF-CYBMUJFWSA-N	324.355	4.738	5	20	DJBD	
O=C(CSc1ccc2ccccc2c1)c1cccc([N+](=O)[O-])c1	216810478	GPKJTMYUVBGQKJ-UHFFFAOYSA-N	323.373	4.723	5	20	DJBD	
Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)CCCC(C)(C)C	736161495	ZRMRIUXPBXNCOJ-UHFFFAOYSA-N	312.797	4.712	5	20	DJBD	
CC1(C(=O)Nc2cccc([N+](=O)[O-])c2Cl)CCCCCC1	813242673	UVGZNNPXGZNFDL-UHFFFAOYSA-N	310.781	4.547	5	20	DJBD	
C[C@@H](Nc1ccc([N+](=O)[O-])s1)c1ccc(Cl)c(F)c1	1116428772	JBQYCFTXNKAFAB-SSDOTTSWSA-N	300.742	4.622	5	20	DJBD	
O=[N+]([O-])c1ccc(/C=C(/Cl)c2nc3ccccc3s2)cc1	213508641	KLUSPCHPPJFGPO-FMIVXFBMSA-N	316.769	4.941	5	20	DJBD	
CN(Cc1c(F)cccc1[N+](=O)[O-])Cc1cccc2ccccc12	505785313	TWXPLMIBHUUHAA-UHFFFAOYSA-N	324.355	4.519	5	20	DJBD	
Cc1cccc2c1CC[C@H]2N[C@H](C)c1cccc([N+](=O)[O-])c1C	540178958	JXBLUGCIXLKXEX-RDTXWAMCSA-N	310.397	4.550	5	20	DJBD	
C[C@@H](SCc1cnn(C(C)(C)C)c1)c1ccccc1[N+](=O)[O-]	1330684436	FMLRHQBOPYQXGT-GFCCVEGCSA-N	319.430	4.541	5	20	DJBD	
Cc1ccc(CN[C@@H](C)c2ccc(F)cc2Cl)cc1[N+](=O)[O-]	76761519	NGRGWKPCTMUJBD-NSHDSACASA-N	322.767	4.547	5	20	DJBD	
CC[C@H](N[C@H](C)c1ccc(F)cc1F)c1cccc([N+](=O)[O-])c1	90068697	JCMHALXWYPBMSG-DIFFPNOSSA-N	320.339	4.675	5	20	DJBD	
C[C@@H](N[C@H](C)c1cc2ccccc2o1)c1ccc([N+](=O)[O-])cc1	190610174	XQRTYVLQXUJGNF-CHWSQXEVSA-N	310.353	4.753	5	20	DJBD	
C[C@@H](Nc1ccccc1[N+](=O)[O-])c1nc(C(C)(C)C)cs1	301204791	RVFINGFAPVEOPB-SNVBAGLBSA-N	305.403	4.522	5	20	DJBD	
CC(C)[C@@H](c1ccccc1)N(C)Cc1c(F)cccc1[N+](=O)[O-]	497448130	XWYZXZWGSHHLKR-SFHVURJKSA-N	316.376	4.563	5	20	DJBD	
Cc1cccc(COc2ccc(-c3ccccc3)cc2[N+](=O)[O-])n1	559453569	HPSYCWLVUYJMNL-UHFFFAOYSA-N	320.348	4.544	5	20	DJBD	
CSc1ccc(C)c(NCc2ccc(Cl)cc2[N+](=O)[O-])c1	864022752	TVBIDGRQSFKHAE-UHFFFAOYSA-N	322.817	4.891	5	20	DJBD	
CC[C@H](N[C@H](C)c1c(F)cccc1F)c1cccc([N+](=O)[O-])c1	90068564	RWCMGXXTFGTIQO-BZNIZROVSA-N	320.339	4.675	5	20	DJBD	
CC[C@H](Nc1ccccc1OC(F)F)c1cccc([N+](=O)[O-])c1	320121403	DSAGXBYCFNDBQQ-ZDUSSCGKSA-N	322.311	4.759	5	20	DJBD	
Cc1cnc(S[C@@H](C)c2ccc(Cl)cc2)c([N+](=O)[O-])c1	463054161	KWUBPPOEUDEPFQ-JTQLQIEISA-N	308.790	4.805	5	20	DJBD	
CC[C@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])c1cc(F)ccc1F	537094408	CRYHSDFGVIXOCS-ZBEGNZNMSA-N	320.339	4.675	5	20	DJBD	
C[C@@H](NC1CCC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1	540168359	HDDAMSKIGKHJHM-LLVKDONJSA-N	302.399	4.526	5	20	DJBD	
O=[N+]([O-])c1cccc(CN2CCC[C@@H]2c2cccc(Cl)c2)c1	603855530	YWYPXJBWMMFHPY-QGZVFWFLSA-N	316.788	4.585	5	20	DJBD	
COCc1ccc(SCc2cc(Cl)ccc2[N+](=O)[O-])cc1	747813840	LYJBXPABUJTNIT-UHFFFAOYSA-N	323.801	4.687	5	20	DJBD	
CCOc1ccc(N[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1F	776858748	ZHHCICBHQLYPPX-LBPRGKRZSA-N	318.348	4.614	5	20	DJBD	
O=[N+]([O-])c1ccccc1CN1CCC[C@H]1c1ccc(Cl)cc1	23075524	KJNMFCAQFJZMMA-INIZCTEOSA-N	316.788	4.585	5	20	DJBD	
Fc1cccnc1CNCc1c2ccccc2cc2ccccc12	126166638	RXNHINVXHLKVNR-UHFFFAOYSA-N	316.379	4.817	5	20	DJBD	
CCc1ccc([C@@H](C)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1	536911381	VDOXPSDTLXNVSO-QWHCGFSZSA-N	318.442	4.939	5	20	DJBD	
CC(C)(C)Oc1ccccc1NCc1cc(F)ccc1[N+](=O)[O-]	742259905	WCRIJIJECJKNHN-UHFFFAOYSA-N	318.348	4.523	5	20	DJBD	
Cc1ccc2sc(/C=C/c3csc([N+](=O)[O-])c3)nc2c1	48579065	JWXMSKZAAGUTRR-HWKANZROSA-N	302.380	4.745	5	20	DJBD	
Cc1ccc2c(c1)CC[C@@H]2N[C@H]1CCCc2ccc([N+](=O)[O-])cc21	447530380	MNMJXHOHBIASAQ-PMACEKPBSA-N	322.408	4.558	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H]2C[C@H](C)c3ccccc32)cc1[N+](=O)[O-]	552905516	HFTAUVAMFXROLV-DEYYWGMASA-N	310.397	4.802	5	20	DJBD	
CCCCCCC(=O)N(c1cccc([N+](=O)[O-])c1)C1CCCC1	736015879	KHGYQSNTNIOKKQ-UHFFFAOYSA-N	318.417	4.841	5	20	DJBD	
Cc1cc(/C=C/c2ccc3c([N+](=O)[O-])cccc3n2)cc(C)c1O	8321816	JSKNFSLFGMTDGO-VOTSOKGWSA-N	320.348	4.636	5	20	DJBD	
Cc1c(NC(=O)c2oc3c(C)cccc3c2C)cccc1[N+](=O)[O-]	52981680	WYQGXASWFPYPCL-UHFFFAOYSA-N	324.336	4.519	5	20	DJBD	
CC[C@H](N[C@@H](C)c1c(F)cccc1F)c1cccc([N+](=O)[O-])c1	90068563	RWCMGXXTFGTIQO-ZBEGNZNMSA-N	320.339	4.675	5	20	DJBD	
CC[C@H](N[C@@H](CC(F)(F)F)C(C)C)c1cccc([N+](=O)[O-])c1	437071803	AOUNGXRXMKPFCJ-KBPBESRZSA-N	318.339	4.613	5	20	DJBD	
Cc1ccc([C@@H](C)NCc2ccc3occc3c2)cc1[N+](=O)[O-]	512044713	HIECLJQIELFWPN-CYBMUJFWSA-N	310.353	4.500	5	20	DJBD	
CC(C)(CCNCc1c2ccccc2cc2ccccc12)C(=O)O	818628874	DBCAITORZVJXAP-UHFFFAOYSA-N	321.420	4.584	5	20	DJBD	
O=[N+]([O-])c1ccccc1/C=C\CN1CCC[C@@H]1c1ccsc1	507167399	LCXVLIHBVUTLQH-QQNRWZHASA-N	314.410	4.507	5	20	DJBD	
C[C@@H](C(=O)Nc1cccc(C2CCC2)c1)c1cccc([N+](=O)[O-])c1	515335382	QIPUKFWLLYZKFX-CYBMUJFWSA-N	324.380	4.605	5	20	DJBD	
Cc1ccc(C[C@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2C)s1	531713030	YHVBFPYCLCOKTP-FZMZJTMJSA-N	318.442	4.555	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1cccc(C2CCC2)c1	538511211	RULDIDAVFGPMLV-UHFFFAOYSA-N	324.380	4.731	5	20	DJBD	
O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CC=CCC3)s2)cc1	609902192	CLZTULORLIHIJT-CQSZACIVSA-N	314.410	4.522	5	20	DJBD	
C[C@H](N[C@H](C)c1cccc(Cl)c1)c1ccc([N+](=O)[O-])cc1	37177053	MQCQQVGDODLKPI-NWDGAFQWSA-N	304.777	4.660	5	20	DJBD	
CC[C@H](N[C@@H](C)c1ccc(C)s1)c1cccc([N+](=O)[O-])c1	49159396	XUSDCNJCJHBXAD-WFASDCNBSA-N	304.415	4.767	5	20	DJBD	
COc1ccccc1[C@@H](C)Sc1ccc([N+](=O)[O-])cc1F	463066959	BYYKIEIFUBRGGD-SNVBAGLBSA-N	307.346	4.596	5	20	DJBD	
CC(C)c1ccccc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1	514561073	XIXYLIHXCOZRFM-UHFFFAOYSA-N	324.336	4.717	5	20	DJBD	
CCc1ccccc1CNCc1ccc(C(C)C)c([N+](=O)[O-])c1	524883572	VJZCWEKHMJZLDW-UHFFFAOYSA-N	312.413	4.570	5	20	DJBD	
CSc1ccc(CN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1	563786326	MIVSHYQVWZVNNP-NSHDSACASA-N	322.455	4.537	5	20	DJBD	
C[C@@H](SCc1ccc([N+](=O)[O-])cc1)c1c(F)cccc1F	604434594	LUKBWAMHVHUROF-SNVBAGLBSA-N	309.337	4.867	5	20	DJBD	
CC(=O)c1ccc(N[C@H]2CCC[C@@H]2c2ccccc2)c([N+](=O)[O-])c1	609514013	POUVAIUQHARPEY-SJORKVTESA-N	324.380	4.546	5	20	DJBD	
CC(C)n1ncc2cc(N[C@H](C)c3cccc([N+](=O)[O-])c3)ccc21	611482759	CGGADMAXVIMVFK-CYBMUJFWSA-N	324.384	4.699	5	20	DJBD	
CCC(=O)c1ccc(Oc2cc(Cl)ccc2[N+](=O)[O-])c(F)c1	804557866	JMQLMBQTOXXXGA-UHFFFAOYSA-N	323.707	4.772	5	20	DJBD	
Cc1cc(F)ccc1[C@@H]1CCCN1c1ccc([N+](=O)[O-])cc1F	864019357	CIGNVLUIRXRAGF-INIZCTEOSA-N	318.323	4.523	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1oc2ccccc2c1C	86625334	TWCAQXUXJKLAJJ-UHFFFAOYSA-N	324.336	4.519	5	20	DJBD	
CC[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F	178657682	UILBMRCLWQUUCA-APPDUMDISA-N	320.339	4.675	5	20	DJBD	
CSc1ccccc1NCc1cc(Cl)ccc1[N+](=O)[O-]	220265297	RJZDLTYHGBLOGS-UHFFFAOYSA-N	308.790	4.582	5	20	DJBD	
CSc1ccccc1[C@H](C)N[C@@H](C)c1ccccc1[N+](=O)[O-]	440614966	BIVYROLSAFDUDA-STQMWFEESA-N	316.426	4.729	5	20	DJBD	
Cc1ccc(CN(Cc2c(F)cccc2[N+](=O)[O-])C(C)C)s1	505797587	WCXHDNLMLIFZJV-UHFFFAOYSA-N	322.405	4.514	5	20	DJBD	
O=[N+]([O-])c1cccc(SCc2coc(-c3ccccc3)n2)c1	509655616	STLAHMNCZSRGBC-UHFFFAOYSA-N	312.350	4.542	5	20	DJBD	
OCC[C@@H]1CCC[C@H]1NCc1c2ccccc2cc2ccccc12	778216436	NSCJHDRJXIZQMB-KSFYIVLOSA-N	319.448	4.634	5	20	DJBD	
CSc1ccccc1NCc1ccc([N+](=O)[O-])cc1Cl	227948410	NGVKQVMFYGKIIC-UHFFFAOYSA-N	308.790	4.582	5	20	DJBD	
Cc1c([C@H](C)Nc2ccc3ccn(C)c3c2)cccc1[N+](=O)[O-]	443093405	MCKGCHIFPFQJDL-ZDUSSCGKSA-N	309.369	4.568	5	20	DJBD	
Cc1cc(F)ccc1Cc1nc(O)c2cc3ccccc3cc2n1	547484497	IHBCOSAMTVBIHD-UHFFFAOYSA-N	318.351	4.527	5	20	DJBD	
O=[N+]([O-])c1cc(C(F)F)ccc1N[C@@H]1CCCC(F)(F)C1	596166623	WVXUWMODNNLHOK-SECBINFHSA-N	306.259	4.522	5	20	DJBD	
C[C@@H](c1cccs1)N(C)Cc1ccc([N+](=O)[O-])c(Cl)c1	761507888	ZNOBLXWVJLKOGD-JTQLQIEISA-N	310.806	4.503	5	20	DJBD	
OCC[C@H]1CCC[C@@H]1NCc1c2ccccc2cc2ccccc12	778216443	NSCJHDRJXIZQMB-ZHRRBRCNSA-N	319.448	4.634	5	20	DJBD	
CC[C@@](C)(NCc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1	782497639	PJSMPMAFRUVSRR-QGZVFWFLSA-N	318.804	4.663	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1NCc1csc(C2CCCC2)n1	444420369	QSYACSPWSLCXJV-UHFFFAOYSA-N	317.414	4.629	5	20	DJBD	
Cc1cccc2c1CC[C@H]2Nc1ccc2cc([N+](=O)[O-])ccc2n1	609192784	GOVLHQAJNKWTMN-GOSISDBHSA-N	319.364	4.551	5	20	DJBD	
O=[N+]([O-])c1c(Cl)cccc1Oc1nc(C(F)(F)F)cs1	814901242	FNPASTWVXOMBBD-UHFFFAOYSA-N	324.667	4.516	5	20	DJBD	
Cc1sc(-c2cccc([N+](=O)[O-])c2)nc1-c1ccc(F)cc1	71971789	NCEIEFXWYCAXQP-UHFFFAOYSA-N	314.341	4.833	5	20	DJBD	
Cc1cccc(/C=C(/c2ccncc2)c2ccc([N+](=O)[O-])cc2)c1	215737222	DPCRQLMSMIYKDW-XSFVSMFZSA-N	316.360	4.887	5	20	DJBD	
C[C@H](Nc1ccccc1C(C)(F)F)c1cccc([N+](=O)[O-])c1	453302849	ZJHDJRDJTLRXRO-NSHDSACASA-N	306.312	4.880	5	20	DJBD	
Cc1c([C@H](C)N[C@@H](C)c2c(F)cccc2F)cccc1[N+](=O)[O-]	480911210	OZAVNNCNPYNGCF-RYUDHWBXSA-N	320.339	4.593	5	20	DJBD	
O=[N+]([O-])c1cccc(SCc2ncc(Cl)cc2Cl)c1	509731813	XGWGXSRLGCHLSF-UHFFFAOYSA-N	315.181	4.589	5	20	DJBD	
CCOCc1ccc(N[C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1	540753960	WOCISBLGQPASCO-CQSZACIVSA-N	314.385	4.613	5	20	DJBD	
O=[N+]([O-])c1ccc(F)cc1CNc1ccc2c3c(cccc13)CC2	742257934	PFDDFHFGXCMNSZ-UHFFFAOYSA-N	322.339	4.598	5	20	DJBD	
C[C@@H](CCC(C)(C)C)C(=O)Nc1cccc([N+](=O)[O-])c1Cl	813246455	CWMAPFKGHTXXAL-JTQLQIEISA-N	312.797	4.649	5	20	DJBD	
O=[N+]([O-])c1cccnc1SCc1c(Cl)cccc1Cl	49418465	FHRKOWMQXGVBLH-UHFFFAOYSA-N	315.181	4.589	5	20	DJBD	
C[C@@H](NC1(c2ccccc2Cl)CC1)c1ccc([N+](=O)[O-])cc1	592391894	SNFFYUCUCBWWIC-GFCCVEGCSA-N	316.788	4.588	5	20	DJBD	
CC(C)Oc1cccc(CSc2ccc([N+](=O)[O-])cc2)c1	604065610	YTIRQWXUAWLDBH-UHFFFAOYSA-N	303.383	4.674	5	20	DJBD	
CC(=O)c1ccc(NCc2cccc3ccccc23)c([N+](=O)[O-])c1	63736222	WHXXMDKSFMBAGE-UHFFFAOYSA-N	320.348	4.563	5	20	DJBD	
CSc1ccccc1[C@@H](C)N[C@@H](C)c1ccc([N+](=O)[O-])cc1	409839338	ZUYKPPBBILAJIE-QWHCGFSZSA-N	316.426	4.729	5	20	DJBD	
C[C@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(C2CC2)cc1	417356291	PASRIKHKZBNJRX-KBPBESRZSA-N	310.397	4.884	5	20	DJBD	
C[C@@H](Sc1ncccc1[N+](=O)[O-])c1ccc2ccccc2c1	520086002	OYDDNJUTWUBGFT-GFCCVEGCSA-N	310.378	4.996	5	20	DJBD	
CC[C@H](NCc1csc([N+](=O)[O-])c1)c1cc(C)ccc1C	599006461	IQILJQPUEFOHDA-HNNXBMFYSA-N	304.415	4.514	5	20	DJBD	
Cc1ccnc(Oc2ccc3oc4ccccc4c3c2)c1[N+](=O)[O-]	609668806	OLGJZVWLCFKIAA-UHFFFAOYSA-N	320.304	4.990	5	20	DJBD	
Cc1ccc([C@H](C)Nc2ccc([N+](=O)[O-])c3cnccc23)s1	53582357	ICRLFXWRUOTSFY-NSHDSACASA-N	313.382	4.686	5	20	DJBD	
O=[N+]([O-])c1ccc(/C=C\c2csc(Cl)c2Cl)nc1	431583672	SRFPTGCBDDQQNT-UPHRSURJSA-N	301.154	4.529	5	20	DJBD	
CCCC[C@H](CC)CC(=O)Nc1c(F)ccc([N+](=O)[O-])c1C	800143974	PSDKXZDFJWTBSC-LBPRGKRZSA-N	310.369	4.587	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H](C)c2ccc(Cl)cc2)cc1[N+](=O)[O-]	314053464	PJMPZZKPFHUGMQ-OLZOCXBDSA-N	318.804	4.968	5	20	DJBD	
C[C@H](Nc1ccc([N+](=O)[O-])cc1Cl)c1c(F)cccc1F	36971054	CLNHEDWWZBIXRF-QMMMGPOBSA-N	312.703	4.700	5	20	DJBD	
Cc1ccc([C@@H](C)NCc2c(Cl)cccc2[N+](=O)[O-])cc1F	120895615	BQLODQCKTPFSOT-LLVKDONJSA-N	322.767	4.547	5	20	DJBD	
Cc1ccccc1[C@@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)C(C)C	531711641	LBONXRCWBDHRQT-BEFAXECRSA-N	312.413	4.951	5	20	DJBD	
C[C@H](C(=O)Nc1ccc(C2CCC2)cc1)c1cccc([N+](=O)[O-])c1	571016566	QFOKSFBKSWTVMV-ZDUSSCGKSA-N	324.380	4.605	5	20	DJBD	
CC(C)(C)CSCc1coc(-c2ccc([N+](=O)[O-])cc2)n1	440585828	AJPYWYZAUNNZQK-UHFFFAOYSA-N	306.387	4.529	5	20	DJBD	
Cc1ccc([C@@H](C)Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)cc1	462778967	RAUSAQLYKMCAAD-LLVKDONJSA-N	322.311	4.678	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)Sc1nccn1C(C)C	484661710	DCBVQZOULHRDJN-GFCCVEGCSA-N	305.403	4.534	5	20	DJBD	
CC(C)c1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2Cl)cc1	813243695	UQGIOWORHYRALB-UHFFFAOYSA-N	318.760	4.624	5	20	DJBD	
CCCc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1	915826159	NZJAGURHZQKRLH-UHFFFAOYSA-N	324.336	4.546	5	20	DJBD	
CC(C)(C)[C@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1	42800664	STZFNOPVZGWAIK-QGZVFWFLSA-N	316.376	4.611	5	20	DJBD	
Cc1ccc([C@H](C)Nc2ccc([N+](=O)[O-])c3cccnc23)s1	53582195	IHDSBMJLWQEIEP-NSHDSACASA-N	313.382	4.686	5	20	DJBD	
O=[N+]([O-])c1cnc(Nc2cccc(Nc3ccccc3)c2)s1	472354979	XEAMFFIFICYIIR-UHFFFAOYSA-N	312.354	4.539	5	20	DJBD	
Cc1c(CNC(C)(C)c2cccc(Cl)c2)cccc1[N+](=O)[O-]	539285376	BBXAXQIQWGLFKE-UHFFFAOYSA-N	318.804	4.582	5	20	DJBD	
CC(=O)c1cc(N[C@@H](C)c2cccc(C)c2C)ccc1[N+](=O)[O-]	557602801	QVIXXVBPYTUYBJ-ZDUSSCGKSA-N	312.369	4.587	5	20	DJBD	
C[C@@H](Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1	37131326	QOFIZONHFICBCB-SNVBAGLBSA-N	321.174	4.530	5	20	DJBD	
CC[C@@H](N[C@@H](C)c1ccc(C)s1)c1cccc([N+](=O)[O-])c1	49159401	XUSDCNJCJHBXAD-SWLSCSKDSA-N	304.415	4.767	5	20	DJBD	
O=[N+]([O-])c1ccc(Sc2cccc(Cl)c2)c2ccncc12	303175188	RWLYIDJYCWRBQU-UHFFFAOYSA-N	316.769	4.948	5	20	DJBD	
CC(=O)c1cc(N[C@H](C)c2cc3ccccc3o2)ccc1[N+](=O)[O-]	553532022	KKWZQYINZRZVKH-LLVKDONJSA-N	324.336	4.717	5	20	DJBD	
CCOc1cccc(N[C@H](C)c2ccc(C)s2)c1[N+](=O)[O-]	134911714	PGQYDVCLSHIBOQ-LLVKDONJSA-N	306.387	4.537	5	20	DJBD	
CC(C)c1ccc(C(=O)Nc2ccccc2Cl)cc1[N+](=O)[O-]	439213137	IHIOIKNBRQUUFS-UHFFFAOYSA-N	318.760	4.624	5	20	DJBD	
CCCCCN(C(=O)Nc1cc([N+](=O)[O-])c(C)cc1C)C(C)C	463950345	LWJRDPGSGRMFEM-UHFFFAOYSA-N	321.421	4.644	5	20	DJBD	
C[C@@H](SCCCCOC(C)(C)C)c1ccccc1[N+](=O)[O-]	473796849	FKCVFPMZVFOPKL-CYBMUJFWSA-N	311.447	4.984	5	20	DJBD	
COc1ccc([N+](=O)[O-])cc1CSCCCCC(F)(F)F	507632582	HGOSQKOTPGYLGG-UHFFFAOYSA-N	323.336	4.569	5	20	DJBD	
O=C(c1cc2ccccc2c2cccnc12)N1CCc2ccccc21	46763074	YYKRIBMEQGGXTL-UHFFFAOYSA-N	324.383	4.591	5	20	DJBD	
Oc1nc([C@@H]2CCCC(F)(F)C2)nc2cc3ccccc3cc12	286945917	AHVQGVPQZGAPAU-CYBMUJFWSA-N	314.335	4.782	5	20	DJBD	
Cc1cnc(N[C@H](C)c2cccc3ccccc23)c([N+](=O)[O-])c1	463051170	AGUFOKSELDJFJF-CYBMUJFWSA-N	307.353	4.625	5	20	DJBD	
O=[N+]([O-])c1cccc2nc(/C=C/c3cc(F)ccc3F)ccc12	514572084	QVHSEACWZXOEDM-GQCTYLIASA-N	312.275	4.592	5	20	DJBD	
C[C@H](C(=O)Nc1cccc(C2CCC2)c1)c1cccc([N+](=O)[O-])c1	515335383	QIPUKFWLLYZKFX-ZDUSSCGKSA-N	324.380	4.605	5	20	DJBD	
Clc1c2ccccc2c(CNc2nnco2)c2ccccc12	788450398	ZAXFZTFZNGDOSV-UHFFFAOYSA-N	309.756	4.642	5	20	DJBD	
O=[N+]([O-])c1ccccc1CN[C@@H](c1cccs1)C1CCCC1	192836180	WHSFWZSRSFGCMG-QGZVFWFLSA-N	316.426	4.677	5	20	DJBD	
CSc1ccccc1[C@@H](C)Nc1ncc(Cl)cc1[N+](=O)[O-]	409658770	ZAPCQVYDBKYJAJ-SECBINFHSA-N	323.805	4.538	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1CSC1=Nc2ccccc2C1	740766411	JDCSNNUJOVBSSH-UHFFFAOYSA-N	318.785	4.768	5	20	DJBD	
CCOc1ccc(N[C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1F	776858740	YYELNMRSXJVPFI-LBPRGKRZSA-N	318.348	4.614	5	20	DJBD	
Cc1c([C@@H](C)N[C@@H](c2ccccc2)C2CC2)cccc1[N+](=O)[O-]	178494405	SRDOMZRAJYDHLR-KUHUBIRLSA-N	310.397	4.705	5	20	DJBD	
Cc1oc2ccccc2c1CN[C@H](C)c1cccc([N+](=O)[O-])c1C	468019323	GRQBMOOQZXDUNU-CYBMUJFWSA-N	324.380	4.809	5	20	DJBD	
C[C@H](c1ccccc1[N+](=O)[O-])N(C)Cc1ccc(Cl)s1	487522928	FABLMLULUXIGTQ-SNVBAGLBSA-N	310.806	4.503	5	20	DJBD	
CSCc1cccc(N[C@H](C)c2ccc([N+](=O)[O-])cc2)c1	539734495	PKOJYTAFMYLYJY-GFCCVEGCSA-N	302.399	4.631	5	20	DJBD	
Cc1cccc(NCc2ccc(-c3ccncc3)cc2)c1[N+](=O)[O-]	555169062	XZCPOQANEJDGDE-UHFFFAOYSA-N	319.364	4.577	5	20	DJBD	
C[C@@H]1C[C@@H]1[C@H](Nc1ncc([N+](=O)[O-])s1)c1ccc(Cl)cc1	443523517	PITPPKWEPVJREV-YDEJPDAXSA-N	323.805	4.514	5	20	DJBD	
O=[N+]([O-])c1ccc(CN2CCC[C@H]2c2ccsc2)c(Cl)c1	541069412	BGGKSBIQQZECQF-HNNXBMFYSA-N	322.817	4.647	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](C)CCCC(F)(F)F	572191528	GLUBTNIIAZQHQW-NWDGAFQWSA-N	318.339	4.675	5	20	DJBD	
Cc1cc(CN(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(C)s1	520385971	FRFHNEVIMPBJGS-UHFFFAOYSA-N	318.442	4.684	5	20	DJBD	
Cc1c([C@H](C)NCc2cccc3ccccc23)cccc1[N+](=O)[O-]	540496374	LGCOWPHQEGBBOA-HNNXBMFYSA-N	320.392	4.907	5	20	DJBD	
C[C@H](Nc1ccccc1[N+](=O)[O-])c1ccc(Br)cc1	25844602	FWAJJLUHYPGNSV-JTQLQIEISA-N	321.174	4.530	5	20	DJBD	
C[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(C2CC2)cc1	417357809	SDNANARXZJGGLZ-KBPBESRZSA-N	310.397	4.884	5	20	DJBD	
C[C@@H](Sc1ccc([N+](=O)[O-])cn1)c1ccc(F)c(Cl)c1	448097462	OGIWFPXCSTXGOA-MRVPVSSYSA-N	312.753	4.636	5	20	DJBD	
Cc1ccc2sc(/C=C\c3csc([N+](=O)[O-])c3)nc2c1	603893932	JWXMSKZAAGUTRR-HYXAFXHYSA-N	302.380	4.745	5	20	DJBD	
CC[C@H](NCc1cc(Cl)ccc1[N+](=O)[O-])c1ccc(F)cc1	1320039876	QNWNHAOMOKLQJM-HNNXBMFYSA-N	322.767	4.628	5	20	DJBD	
C[C@@H](NCc1ccc(-c2ccccc2)o1)c1ccc([N+](=O)[O-])cc1	480904608	XYPWXYYSPWWATR-CQSZACIVSA-N	322.364	4.706	5	20	DJBD	
CC[C@@H](Nc1ccc([N+](=O)[O-])cc1)c1ncc(-c2ccccc2)[nH]1	537092206	MSCJFUNYMKCRPU-MRXNPFEDSA-N	322.368	4.548	5	20	DJBD	
Oc1nc(-c2ccc(F)c(Cl)c2)nc2cc3ccccc3cc12	590320233	HIMOWRSGGIBKNK-UHFFFAOYSA-N	324.742	4.948	5	20	DJBD	
CC(C)c1cnc(SCc2ccc([N+](=O)[O-])cc2)n1C(C)C	610034408	IMILYLLZSKXWGN-UHFFFAOYSA-N	319.430	4.788	5	20	DJBD	
Cc1ccc(/C=C(\Cl)c2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1	7133280	WVLDXAYFMYRMSU-JYRVWZFOSA-N	313.744	4.516	5	20	DJBD	
CCN(Cc1ccccc1[N+](=O)[O-])[C@H](C)c1cc2ccccc2o1	64349037	QEGYEUXNSMAPRV-CQSZACIVSA-N	324.380	4.924	5	20	DJBD	
Cc1cc([C@@H](C)N[C@@H]2CCc3c2cccc3[N+](=O)[O-])c(C)s1	565842079	BYYLDMHMATYWPP-BDJLRTHQSA-N	316.426	4.611	5	20	DJBD	
O=[N+]([O-])c1ccc(SCCCc2ccccc2)c2ccncc12	609514594	MXNWGFZXXKGGGE-UHFFFAOYSA-N	324.405	4.868	5	20	DJBD	
C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[C@@H]1c1ccc(Cl)cc1	511590589	CTZXSKVIWZUDAR-BLLLJJGKSA-N	316.788	4.756	5	20	DJBD	
CCCCCC[C@@H](CC)C(=O)Nc1cc([N+](=O)[O-])ccc1OC	734992890	RGHXUNDDVPNYFD-CYBMUJFWSA-N	322.405	4.539	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1CNc1ccccc1C(F)F	864031026	VWTAAVJHPRXFSV-UHFFFAOYSA-N	312.703	4.798	5	20	DJBD	
CSc1ccc([C@@H](C)N[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1	315640777	ZCITXCLBZQUDJC-CHWSQXEVSA-N	316.426	4.729	5	20	DJBD	
CCCc1nc(CS[C@H](C)c2ccccc2[N+](=O)[O-])cs1	437268959	QFLFUYBRTJTWIG-LLVKDONJSA-N	322.455	4.998	5	20	DJBD	
CSc1ccc(N[C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1	447585907	KVWKQTLOYJKOBO-KRWDZBQOSA-N	314.410	4.806	5	20	DJBD	
CCCc1ccccc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1	514558493	SDZRTDYZMKBFCO-UHFFFAOYSA-N	324.336	4.546	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1ccc(Cl)cc1F	548635779	VOSGPXPIBYTRBK-LLVKDONJSA-N	322.767	4.547	5	20	DJBD	
C[C@@H](Nc1ncc([N+](=O)[O-])s1)c1ccc(F)c2ccccc12	574717796	HFQRPIKIAQLOQQ-SECBINFHSA-N	317.345	4.517	5	20	DJBD	
Cc1cc(C)c([N+](=O)[O-])cc1-c1nc(C2CCCCCC2)no1	904688581	UVTAUZHBSRZKML-UHFFFAOYSA-N	315.373	4.699	5	20	DJBD	
CC(C)c1ccc(SCC(=O)c2cccc([N+](=O)[O-])c2)cc1	195618218	UJFQCXFCJQIFDY-UHFFFAOYSA-N	315.394	4.693	5	20	DJBD	
C[C@H](Sc1ccnc2ccccc12)c1ccccc1[N+](=O)[O-]	463262904	UOYGEBASKPWFMQ-LBPRGKRZSA-N	310.378	4.996	5	20	DJBD	
CCn1c(SC2CCCC2)nc2cc3ccccc3cc2c1=O	516835065	JABYVWCIFJCIBE-UHFFFAOYSA-N	324.449	4.604	5	20	DJBD	
Cc1c(CN(C)[C@H](C)c2cccc(Cl)c2)cccc1[N+](=O)[O-]	603856666	RKKONNTWPVSSLA-CYBMUJFWSA-N	318.804	4.750	5	20	DJBD	
Cc1cccc([C@@H](C)NCc2cc(Cl)ccc2[N+](=O)[O-])c1C	775437541	QEYYLMUPFJEXAC-CYBMUJFWSA-N	318.804	4.716	5	20	DJBD	
CCCCC[C@H](C)CC(=O)Nc1c(F)ccc([N+](=O)[O-])c1C	800145202	FFFMWDQLYVBNFH-NSHDSACASA-N	310.369	4.587	5	20	DJBD	
CSc1ccc(NCc2cccc([N+](=O)[O-])c2C)cc1Cl	864017220	ZSTLIPSEAPNDDV-UHFFFAOYSA-N	322.817	4.891	5	20	DJBD	
CC[C@H](C)CN(CC)C(=O)c1cc2ccccc2c2cccnc12	490883930	DAOUVNUIMLSXJG-HNNXBMFYSA-N	320.436	4.896	5	20	DJBD	
C[C@H](CSCc1c(Cl)cccc1[N+](=O)[O-])C(F)(F)F	490913918	TUFYKNJWSKMPCA-SSDOTTSWSA-N	313.728	4.680	5	20	DJBD	
CC[C@@H](Cc1ccccc1)Nc1ccc([N+](=O)[O-])c2cnccc12	609039568	WULKIILXHHYIQH-HNNXBMFYSA-N	321.380	4.576	5	20	DJBD	
CCCCCC[C@H](CC)C(=O)N(C)Cc1ccccc1[N+](=O)[O-]	734997490	TUXNRTGYOXRXGC-HNNXBMFYSA-N	320.433	4.550	5	20	DJBD	
O=[N+]([O-])c1ccc(/C=C\Sc2nc3cc(Cl)ccc3o2)o1	825206702	SPCZTVSABROBKA-WAYWQWQTSA-N	322.729	4.745	5	20	DJBD	
CC(C)c1cccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1	8157773	RZEGTRVXJNMSLW-UHFFFAOYSA-N	318.760	4.624	5	20	DJBD	
C[C@H](N[C@@H]1CCc2c(Cl)cccc21)c1cccc([N+](=O)[O-])c1	173361769	FBVFGPRKBKWHKZ-APPDUMDISA-N	316.788	4.586	5	20	DJBD	
Cn1cc(NCc2c3ccccc3c(Cl)c3ccccc23)cn1	727470351	SMJLLSMABYHGCU-UHFFFAOYSA-N	321.811	4.992	5	20	DJBD	
O=[N+]([O-])c1ccc(CN[C@@H](c2cccs2)C2CC2)cc1Cl	783597353	BRRKZVJEHRZGNK-OAHLLOKOSA-N	322.817	4.551	5	20	DJBD	
CC[C@H](C)CCCCC(=O)Nc1c(F)ccc([N+](=O)[O-])c1C	800144551	WINMLUFWLCVKJA-NSHDSACASA-N	310.369	4.587	5	20	DJBD	
CC[C@@H](NCc1cc([N+](=O)[O-])ccc1Cl)c1ccsc1	834675867	LQFSUMFYTITDMV-CQSZACIVSA-N	310.806	4.551	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1cccc(Cl)c1F	1322645784	JMVXSJPHZZSABS-LLVKDONJSA-N	322.767	4.547	5	20	DJBD	
Cc1c(CN[C@H](C)c2oc3ccccc3c2C)cccc1[N+](=O)[O-]	326443758	MNCUVKUXFLEZRO-CQSZACIVSA-N	324.380	4.809	5	20	DJBD	
C[C@@H](O)CC(C)(C)CNCc1c2ccccc2cc2ccccc12	742373065	NBSNMPOQYWUMDZ-MRXNPFEDSA-N	321.464	4.880	5	20	DJBD	
Cc1cc([C@@H](C)N[C@H](C)c2ccc([N+](=O)[O-])cc2)c(C)s1	37122835	GFAKHLXANKXWNH-VXGBXAGGSA-N	304.415	4.685	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1CNc1c(F)cccc1Cl	122051932	LMEOHWJJERGQAD-UHFFFAOYSA-N	315.131	4.653	5	20	DJBD	
O=[N+]([O-])c1ccc(/C(=C/c2ccccc2F)c2ccncc2)cc1	218175460	KGGLSZQFZJEHSD-AQTBWJFISA-N	320.323	4.718	5	20	DJBD	
O=[N+]([O-])c1ccccc1CNc1ccccc1-c1ccccc1	390350494	XYOQDBFPURGPHB-UHFFFAOYSA-N	304.349	4.874	5	20	DJBD	
CC[C@H](Nc1cnn([C@H](C)CC)c1C)c1cccc([N+](=O)[O-])c1	477923079	NHZSZMGUIHZOLK-WBMJQRKESA-N	316.405	4.634	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H](C)CCCC(F)(F)F)cc1[N+](=O)[O-]	480215581	RVSGTMBGEDJFPY-NWDGAFQWSA-N	318.339	4.675	5	20	DJBD	
CC[C@H](N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1cccc(F)c1	525868735	BXUDNHQIGKDXIY-GUYCJALGSA-N	316.376	4.844	5	20	DJBD	
CSCc1cccc(NCc2ccc([N+](=O)[O-])c(Cl)c2)c1	761518172	YMUVLVPACMDHJT-UHFFFAOYSA-N	322.817	4.723	5	20	DJBD	
CCCOc1cccc(NCc2ccc(Cl)cc2[N+](=O)[O-])c1	864003146	GMPZMJULWSJQSW-UHFFFAOYSA-N	320.776	4.649	5	20	DJBD	
O=[N+]([O-])c1ccc2oc(/C(Cl)=C/c3cccc(F)c3)nc2c1	83536637	RNLMYVMKIDEEKB-GHXNOFRVSA-N	318.691	4.612	5	20	DJBD	
Cc1c([C@H](C)N[C@H](C)CCCC(F)(F)F)cccc1[N+](=O)[O-]	426060210	QXLYPGVRXULUFS-PWSUYJOCSA-N	318.339	4.675	5	20	DJBD	
CC[C@@H](NCc1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1F	461083864	DBBQEJTZUSVPFD-OAHLLOKOSA-N	322.767	4.628	5	20	DJBD	
O=[N+]([O-])c1c(Oc2ccc(Cl)cc2)ccc2ncccc12	485820971	RAAGKSAOYDHEJE-UHFFFAOYSA-N	300.701	4.589	5	20	DJBD	
O=[N+]([O-])c1ccc(CCSCCCCC(F)(F)F)cc1	539767806	IIWBTTAODLHQFF-UHFFFAOYSA-N	307.337	4.603	5	20	DJBD	
Cc1oc2ccccc2c1CNC(C)(C)c1ccc([N+](=O)[O-])cc1	545164663	ABNJZXBEZHWNOY-UHFFFAOYSA-N	324.380	4.674	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)cc1Oc1cnc2ccccc2c1	804645434	YYFXHLZDGIHZOK-UHFFFAOYSA-N	300.701	4.589	5	20	DJBD	
C[C@H](c1cccs1)N(C)Cc1ccc(Cl)c([N+](=O)[O-])c1	49726663	BKOUFJNISAPPTJ-SNVBAGLBSA-N	310.806	4.503	5	20	DJBD	
COc1ccc(CS[C@@H](C)c2ccc(F)cc2)cc1[N+](=O)[O-]	62696877	KSXGFYXBEGHEKM-NSHDSACASA-N	321.373	4.737	5	20	DJBD	
C[C@H](N[C@@H](C)c1ccc(F)c(Cl)c1)c1cccc([N+](=O)[O-])c1	79723962	XWNOUPUPUHXJIZ-QWRGUYRKSA-N	322.767	4.799	5	20	DJBD	
CCCCCS[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1	180731081	SKBATVFPAHRDAV-NSHDSACASA-N	321.402	4.629	5	20	DJBD	
Cc1cnc([C@H](Nc2ccc(Cl)cc2[N+](=O)[O-])C2CC2)s1	301581457	NSYFHRRRKNWOIV-CYBMUJFWSA-N	323.805	4.576	5	20	DJBD	
Cc1c(CNc2ccccc2OC(C)(C)C)cccc1[N+](=O)[O-]	462222279	FPCFPCGFNKZVBN-UHFFFAOYSA-N	314.385	4.693	5	20	DJBD	
Cc1ccc2[nH]c(CN[C@H](C)c3cccc([N+](=O)[O-])c3)cc2c1C	472053611	IITABLFKVULRDI-CQSZACIVSA-N	323.396	4.544	5	20	DJBD	
Cc1cc(C)cc([C@@H](C)NCc2c(Cl)cccc2[N+](=O)[O-])c1	494824186	ONHLQAKGSYXPMA-CYBMUJFWSA-N	318.804	4.716	5	20	DJBD	
C[C@H](NCc1ccc(C2CCC2)cc1)c1cccc([N+](=O)[O-])c1	555524261	NKDQATAZZYJSPR-AWEZNQCLSA-N	310.397	4.713	5	20	DJBD	
CCCCn1c(SCc2ccccc2[N+](=O)[O-])nc(C)c1C	71834530	LJKWAAWDNOMTJO-UHFFFAOYSA-N	319.430	4.501	5	20	DJBD	
C[C@H](N[C@H]1CCCCc2ccccc21)c1cccc([N+](=O)[O-])c1	321648335	QIMRGDXMAVYFSG-LIRRHRJNSA-N	310.397	4.713	5	20	DJBD	
C[C@@H](NCCc1ccc([N+](=O)[O-])cc1)c1cccc2ccccc12	324661609	GPXCLIMCOZUMPB-OAHLLOKOSA-N	320.392	4.641	5	20	DJBD	
Cc1ccnc(SCc2cccc3ccccc23)c1[N+](=O)[O-]	609669800	GALRZRBPPUFSSN-UHFFFAOYSA-N	310.378	4.744	5	20	DJBD	
COCC[C@@H](Sc1ccc([N+](=O)[O-])cc1F)c1ccccc1	618965348	XLSBYWKNLHGHSY-OAHLLOKOSA-N	321.373	4.604	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)c(CN2CCC[C@H]2c2ccccc2)c1	735492644	QGVARKGEAFQGPG-KRWDZBQOSA-N	316.788	4.585	5	20	DJBD	
C/C(=C\C(=O)OCc1nc2ccccc2c2ccccc12)C1CC1	919543837	GVUAEAXPRVIPBP-WYMLVPIESA-N	317.388	4.788	5	20	DJBD	
CSCc1ccc(N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1	183109382	ZOQRPMIUXMZREQ-GFCCVEGCSA-N	302.399	4.631	5	20	DJBD	
C[C@H](NCc1ccc(-c2ccccc2)o1)c1ccc([N+](=O)[O-])cc1	480904607	XYPWXYYSPWWATR-AWEZNQCLSA-N	322.364	4.706	5	20	DJBD	
Cc1nc(C)c(CS[C@H](C)c2cc([N+](=O)[O-])ccc2C)s1	486170611	LLCTUJWULYTFMT-LLVKDONJSA-N	322.455	4.971	5	20	DJBD	
CC(C)(C)OCc1ccc(NCc2ccccc2[N+](=O)[O-])cc1	610613314	APXUQKYGVAWRJH-UHFFFAOYSA-N	314.385	4.522	5	20	DJBD	
CC[C@H](NCc1cc(Cl)ccc1[N+](=O)[O-])c1ccc(C)cc1	774807866	XUSLAPMEUQZYPV-INIZCTEOSA-N	318.804	4.798	5	20	DJBD	
CCc1ccc(NCc2cc([N+](=O)[O-])ccc2OC(C)C)cc1	462204294	QSTPWCBPFRTDAX-UHFFFAOYSA-N	314.385	4.557	5	20	DJBD	
O=[N+]([O-])c1ccc(N2CCC[C@H]2c2cccs2)c(Cl)c1	912727791	GMSQWJKAZRQIEX-ZDUSSCGKSA-N	308.790	4.651	5	20	DJBD	
CC[C@H](N[C@H](C)c1cc([N+](=O)[O-])ccc1C)c1ccc(F)cc1	1116575512	CYLICUBAXRLAIN-ACJLOTCBSA-N	316.376	4.844	5	20	DJBD	
Cc1cc([C@H](C)N[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c(C)o1	119396034	FQXLKZUXGNZTCS-STQMWFEESA-N	302.374	4.525	5	20	DJBD	
Cc1ccc2c(c1)[C@@H](N[C@H]1CCCc3ccc([N+](=O)[O-])cc31)CC2	618571734	UBYBWMCOQQQALF-PMACEKPBSA-N	322.408	4.558	5	20	DJBD	
CC[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1C)c1ccc(F)cc1	1337727614	DQWWGASMPBGGQW-DYVFJYSZSA-N	316.376	4.844	5	20	DJBD	
COc1ccccc1[C@H](C)SCCc1ccc([N+](=O)[O-])cc1	463209258	IDZJMLCJWQNDSQ-ZDUSSCGKSA-N	317.410	4.640	5	20	DJBD	
C[C@@H](c1cccs1)N(C)Cc1c(Cl)cccc1[N+](=O)[O-]	494176520	PWNXROSAYXWDMZ-JTQLQIEISA-N	310.806	4.503	5	20	DJBD	
CC[C@@H](NCc1cc([N+](=O)[O-])ccc1Cl)c1cccc(F)c1	783252515	AIDQXPZNPXNPOP-MRXNPFEDSA-N	322.767	4.628	5	20	DJBD	
C[C@@H](NCc1cccc2ccccc12)c1cccc([N+](=O)[O-])c1	237343746	JQPJAMHSVRWXTC-CQSZACIVSA-N	306.365	4.599	5	20	DJBD	
C[C@@H](N[C@H]1CCCCc2ccccc21)c1cccc([N+](=O)[O-])c1	321648334	QIMRGDXMAVYFSG-KUHUBIRLSA-N	310.397	4.713	5	20	DJBD	
CC(C)[C@H](c1ccccc1)N(C)Cc1c(F)cccc1[N+](=O)[O-]	497448129	XWYZXZWGSHHLKR-GOSISDBHSA-N	316.376	4.563	5	20	DJBD	
O=[N+]([O-])c1ccc(N[C@H]2CC3(CCC3)Oc3ccccc32)s1	757792038	UZOWJWFQCGXFFQ-LBPRGKRZSA-N	316.382	4.515	5	20	DJBD	
Cc1c([C@H](C)Nc2ccc(OC(F)F)cc2)cccc1[N+](=O)[O-]	776802752	WHDPFETYOITVQN-NSHDSACASA-N	322.311	4.678	5	20	DJBD	
CN(Cc1ccc2ccccc2c1)Cc1cc(F)ccc1[N+](=O)[O-]	917016186	ILDUYGAUTXSZHM-UHFFFAOYSA-N	324.355	4.519	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H](C)c2cccc(C)c2C)cc1[N+](=O)[O-]	531711632	KIOIOLHVMCBYJM-JKSUJKDBSA-N	312.413	4.932	5	20	DJBD	
CSCc1cccc(N[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1	540834896	AQKMMBZQJBDXPU-ZDUSSCGKSA-N	316.426	4.939	5	20	DJBD	
C[C@@H](NCc1ccc([N+](=O)[O-])cc1)c1csc2ccccc12	731452416	YHHASWKMTXQOQS-GFCCVEGCSA-N	312.394	4.660	5	20	DJBD	
O=C(Nc1ccccc1-c1ccccc1)c1ccc([N+](=O)[O-])s1	15643873	UNIYHRIAMFFRJR-UHFFFAOYSA-N	324.361	4.576	5	20	DJBD	
C[C@H](Nc1ccc([N+](=O)[O-])cc1)c1nc(C(C)(C)C)cs1	301197018	OIAPFLUHEFBNHW-JTQLQIEISA-N	305.403	4.522	5	20	DJBD	
Cc1ccc2oc(C(=O)Nc3cc([N+](=O)[O-])c(C)cc3C)cc2c1	516414005	FSYDNSTYNXICER-UHFFFAOYSA-N	324.336	4.519	5	20	DJBD	
CCC[C@H](N[C@H](C)c1cnc(C)s1)c1cccc([N+](=O)[O-])c1	601298655	PYSPRIMWMVSZOQ-ABAIWWIYSA-N	319.430	4.552	5	20	DJBD	
CC(C)Oc1cccc([C@@H](C)Nc2ccsc2[N+](=O)[O-])c1	604433470	JALFGBVRBAGIHH-LLVKDONJSA-N	306.387	4.617	5	20	DJBD	
CC(=O)c1ccc2cc(Oc3sccc3[N+](=O)[O-])ccc2c1	611413391	NLUHQAWTWYFLNT-UHFFFAOYSA-N	313.334	4.804	5	20	DJBD	
O[C@@H]1CCC[C@@H](CNCc2c3ccccc3cc3ccccc23)C1	238101229	DJGNRTVGEZJIMX-VQIMIIECSA-N	319.448	4.634	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)c1cccc(C)c1C	492934506	CDKGAIJKKMOYBC-CVEARBPZSA-N	312.413	4.932	5	20	DJBD	
C[C@H](c1cc2ccccc2o1)N(C)Cc1cccc([N+](=O)[O-])c1	603459908	KMNLKIAJEGLDSF-CYBMUJFWSA-N	310.353	4.534	5	20	DJBD	
Cc1nc(N[C@@H](C)c2csc3ccccc23)ccc1[N+](=O)[O-]	760461338	PILJZGUSDJKBPO-JTQLQIEISA-N	313.382	4.686	5	20	DJBD	
C[C@H]1CCCCN(C(=O)c2cc3ccccc3c3cccnc23)C1	479263008	YVUUMNLZRHNPIS-HNNXBMFYSA-N	318.420	4.650	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H](c2cccs2)C2CC2)cc1[N+](=O)[O-]	480233074	PIPJQZGRWMHXHX-YVEFUNNKSA-N	316.426	4.767	5	20	DJBD	
O=[N+]([O-])c1ccc(/C(=C\c2ccc(F)cc2)c2ccncc2)cc1	502192267	OXBNYOWUDGDYSS-CPNJWEJPSA-N	320.323	4.718	5	20	DJBD	
CC(F)(F)c1ccccc1N[C@H]1CCc2c1cccc2[N+](=O)[O-]	594506445	RPCYQRCRCBEZHD-AWEZNQCLSA-N	318.323	4.806	5	20	DJBD	
C[C@H](c1cccs1)N(C)Cc1ccc([N+](=O)[O-])c(Cl)c1	761507889	ZNOBLXWVJLKOGD-SNVBAGLBSA-N	310.806	4.503	5	20	DJBD	
C[C@H]1C[C@@H](NCc2cc([N+](=O)[O-])ccc2Cl)c2ccccc21	808706312	HAOAOANLFSJUDR-APPDUMDISA-N	316.788	4.586	5	20	DJBD	
CCC[C@@H](N[C@@H](C)c1ccsc1)c1cccc([N+](=O)[O-])c1	61361084	QFOKHTHCPKSUKB-BLLLJJGKSA-N	304.415	4.848	5	20	DJBD	
CCC[C@@H](NCc1cccc([N+](=O)[O-])c1C)c1ccsc1	478499521	KROOKXDUHFOGEO-OAHLLOKOSA-N	304.415	4.596	5	20	DJBD	
CSc1ccccc1[C@H](C)Nc1ccc([N+](=O)[O-])cc1F	864016968	FETXQUBVVLHOQE-JTQLQIEISA-N	306.362	4.629	5	20	DJBD	
O=[N+]([O-])c1ccc(N[C@H]2CSc3ccccc32)c(Cl)c1	83748549	HMRMJPKGDUZMKC-ZDUSSCGKSA-N	306.774	4.507	5	20	DJBD	
CC(C)[C@H](NCc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1	315538634	WAKGSSQTRAXOQV-KRWDZBQOSA-N	318.804	4.735	5	20	DJBD	
CCc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(C(C)C)s1	464725419	XQAYVVPZGBOVKB-UHFFFAOYSA-N	318.398	4.594	5	20	DJBD	
C[C@H](N[C@H]1CCc2sc(Cl)cc21)c1ccc([N+](=O)[O-])cc1	571486379	CIPYBJHVXGIJNS-ZANVPECISA-N	322.817	4.648	5	20	DJBD	
C[C@H](c1ccco1)N(Cc1cc(Cl)ccc1[N+](=O)[O-])C1CC1	754873680	XOYVJDHHZPENNM-LLVKDONJSA-N	320.776	4.567	5	20	DJBD	
Cc1csc(Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1	57366420	CGVOFOGQPVTPSD-UHFFFAOYSA-N	320.317	4.530	5	20	DJBD	
CSc1ccccc1[C@@H](C)N[C@H](C)c1ccc([N+](=O)[O-])cc1	409839337	ZUYKPPBBILAJIE-CHWSQXEVSA-N	316.426	4.729	5	20	DJBD	
O=[N+]([O-])c1ccc(/C=C/c2csc(Cl)c2Cl)nc1	431583671	SRFPTGCBDDQQNT-OWOJBTEDSA-N	301.154	4.529	5	20	DJBD	
CCN(Cc1c[nH]c2ccccc12)[C@@H](C)c1ccccc1[N+](=O)[O-]	442885846	MKLAAAICDZYBDV-AWEZNQCLSA-N	323.396	4.659	5	20	DJBD	
CC[C@H](Nc1ccc([N+](=O)[O-])c(C)n1)c1ccc(Cl)s1	471063421	PXRLHJPAHAAVDF-VIFPVBQESA-N	311.794	4.576	5	20	DJBD	
CC(C)[C@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1	319770422	XEOIGLRCYHPCOU-ACJLOTCBSA-N	316.376	4.782	5	20	DJBD	
CC(C)[C@H](NCc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1	533230131	JAYHCMWPWAMWIT-KRWDZBQOSA-N	318.804	4.735	5	20	DJBD	
Cc1ccc(NCc2ccccc2[N+](=O)[O-])cc1C(F)(F)F	315325757	LREWTSDAMDJVCG-UHFFFAOYSA-N	310.275	4.534	5	20	DJBD	
Cc1c(CSc2ccc3ccccc3n2)cccc1[N+](=O)[O-]	46875660	JFQLGIGIHZNAFQ-UHFFFAOYSA-N	310.378	4.744	5	20	DJBD	
CC[C@@H](C)CN(C)C(=O)c1cc2ccccc2c2cccnc12	171874131	NYOQFHVOPHIFFU-CQSZACIVSA-N	306.409	4.506	5	20	DJBD	
CCC[C@H](NCc1ccc(F)c(F)c1)c1cccc([N+](=O)[O-])c1	320369215	IQLQKKXHOLPWGX-KRWDZBQOSA-N	320.339	4.504	5	20	DJBD	
Cc1ccc(-c2nc(/C=C\c3ccc([N+](=O)[O-])cn3)cs2)cc1	439508982	DOAYDZSPDUMGSA-SREVYHEPSA-N	323.377	4.592	5	20	DJBD	
Cc1cc(C)cc([C@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2C)c1	482658333	PUAVSTCDXIFXLZ-HOTGVXAUSA-N	312.413	4.932	5	20	DJBD	
CCC[C@H](CC)NCc1ccc(-c2ccccc2[N+](=O)[O-])o1	521827657	RDQYOZXSYGNLNP-ZDUSSCGKSA-N	302.374	4.523	5	20	DJBD	
C[C@H](N[C@H](C)c1cccc(C2CC2)c1)c1ccccc1[N+](=O)[O-]	551103588	LYWYVEOVJALHTL-KGLIPLIRSA-N	310.397	4.884	5	20	DJBD	
CC(C)(C)Nc1ccccc1NCc1cc(F)ccc1[N+](=O)[O-]	766131886	HNBSNQWZYWDXOB-UHFFFAOYSA-N	317.364	4.556	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H](C)c2cc(F)cc(F)c2)cc1[N+](=O)[O-]	90217581	SQTBYOOERCBAKK-NWDGAFQWSA-N	320.339	4.593	5	20	DJBD	
CC[C@@H](NCc1ccc([N+](=O)[O-])c(F)c1)c1cccc(Cl)c1	801529095	ZOQXFILGAPWESB-OAHLLOKOSA-N	322.767	4.628	5	20	DJBD	
CC(C)[C@@H](NCc1ccccc1[N+](=O)[O-])c1cc2ccccc2o1	538461981	CNRDJFFLYCLVMB-LJQANCHMSA-N	324.380	4.828	5	20	DJBD	
C/C(=C\c1nc(-c2ccc(C)c([N+](=O)[O-])c2)no1)c1ccccc1	546985104	HYYZQZGGFUVKDC-JLHYYAGUSA-N	321.336	4.514	5	20	DJBD	
CC(C)CCOc1ccc(NCc2cccc([N+](=O)[O-])c2)cc1	744449104	AFLOYKCUHQMLQL-UHFFFAOYSA-N	314.385	4.632	5	20	DJBD	
Cc1c([C@H](C)NCc2ccc(F)c(Cl)c2)cccc1[N+](=O)[O-]	155168709	HNGPUKMCAUTNEM-NSHDSACASA-N	322.767	4.547	5	20	DJBD	
CCC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(F)c1	471560617	RGZYMJAFRDCGKW-UHFFFAOYSA-N	323.707	4.772	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)SCc1nc(C)c(C)s1	486075044	LFWYFCDGCSNFRQ-LBPRGKRZSA-N	322.455	4.971	5	20	DJBD	
O=[N+]([O-])c1cncc(Cl)c1SCc1ccc(Cl)cc1	589103668	CBCHAPYYURYHTP-UHFFFAOYSA-N	315.181	4.589	5	20	DJBD	
Cc1c([C@H](C)N[C@@H](C)c2cccc(F)c2F)cccc1[N+](=O)[O-]	90963321	YPBKXSFCTRJLQH-RYUDHWBXSA-N	320.339	4.593	5	20	DJBD	
CCC(CC)S[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1	131809129	DFNAPXJRCCUMFS-SNVBAGLBSA-N	321.402	4.628	5	20	DJBD	
CC[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1F	180247005	YLENORYDLDPYGP-YVEFUNNKSA-N	302.349	4.536	5	20	DJBD	
O=[N+]([O-])c1ccsc1SCc1cccc(OC(F)F)c1	302042233	WWNKNTPPDPLDNN-UHFFFAOYSA-N	317.338	4.550	5	20	DJBD	
COc1ccccc1[C@@H](C)SCCc1ccc([N+](=O)[O-])cc1	463209257	IDZJMLCJWQNDSQ-CYBMUJFWSA-N	317.410	4.640	5	20	DJBD	
Cc1ccc2c(c1)[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)CCC2	490247904	OYWSIKYOLAGXKY-LIRRHRJNSA-N	310.397	4.631	5	20	DJBD	
O=Cc1cccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c1Cl	814903483	LRXSZSNCQBBNMG-UHFFFAOYSA-N	312.108	4.506	5	20	DJBD	
O=[N+]([O-])c1cc2ccccc2nc1Oc1ccc(F)cc1Cl	473512286	JUHQXKKJGKWEKY-UHFFFAOYSA-N	318.691	4.728	5	20	DJBD	
Cc1c(CSCc2ccc(F)c(F)c2)cccc1[N+](=O)[O-]	522758344	SRSURQPCHJHDPF-UHFFFAOYSA-N	309.337	4.615	5	20	DJBD	
CCCNCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1	61003448	IERGDRLFPTXZEE-UHFFFAOYSA-N	320.776	4.540	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1c(C)cccc1C(C)C	67020587	QZVDNAJNAOHYOH-UHFFFAOYSA-N	312.369	4.587	5	20	DJBD	
COc1ccc(CSc2cccc(Cl)c2)cc1[N+](=O)[O-]	72076707	PYDCDZQIDITWIP-UHFFFAOYSA-N	309.774	4.549	5	20	DJBD	
CSc1ccc(C)c(N[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1	539681712	RPEKJAGWRVWHSV-LBPRGKRZSA-N	302.399	4.798	5	20	DJBD	
c1ccc2c(c1)nc(CS[C@H]1CCCOC1)c1ccccc12	542788196	XBWOENADNWJABI-AWEZNQCLSA-N	309.434	4.800	5	20	DJBD	
C[C@@H]1C[C@@H](NCc2c3ccccc3cc3ccccc23)CCN1C	742374735	DXTCSOSZQZOAJM-APWZRJJASA-N	318.464	4.565	5	20	DJBD	
C[C@H](Nc1ccc(Br)cc1)c1cccc([N+](=O)[O-])c1	20090334	XILHSMJWMQXJFR-JTQLQIEISA-N	321.174	4.530	5	20	DJBD	
Cc1ccc([C@@H]2CCCCCN2Cc2cccc([N+](=O)[O-])c2)o1	303756257	NCYZZZFNOWJICV-KRWDZBQOSA-N	314.385	4.614	5	20	DJBD	
Cc1cc([C@@H](C)Nc2ccnc3c([N+](=O)[O-])cccc23)c(C)o1	322164668	NBKDYQDQBXFAIG-LLVKDONJSA-N	311.341	4.526	5	20	DJBD	
Cc1ccc(-c2ncco2)cc1N[C@@H](C)c1ccccc1[N+](=O)[O-]	533954235	ZUYSOMCJVCKPIW-ZDUSSCGKSA-N	323.352	4.731	5	20	DJBD	
Cc1ccc2c(c1)CC[C@H]2N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1	537941193	KRBGUPVJONHBIH-RDTXWAMCSA-N	310.397	4.550	5	20	DJBD	
CSc1cc(Cl)ccc1NCc1cccc([N+](=O)[O-])c1C	864033728	DFTUFYWNDVQTMR-UHFFFAOYSA-N	322.817	4.891	5	20	DJBD	
Cc1cc([C@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)c(C)s1	37122803	IRDOZOTWNXUFER-NEPJUHHUSA-N	304.415	4.685	5	20	DJBD	
Cc1cccc(Cl)c1NCc1ccc(Cl)cc1[N+](=O)[O-]	90533037	OZPROCKOQOZJRR-UHFFFAOYSA-N	311.168	4.822	5	20	DJBD	
C[C@H](NCc1csc2ccccc12)c1ccc([N+](=O)[O-])cc1	536805801	KKCCTDPHSMZYDQ-LBPRGKRZSA-N	312.394	4.660	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)CC1CCCCCC1	573961278	DJMSCKFOTVANBU-UHFFFAOYSA-N	304.390	4.511	5	20	DJBD	
O=[N+]([O-])c1ccc2nc(Oc3ccc(F)cc3Cl)sc2c1	111103359	GWMXZTWDMWCTPH-UHFFFAOYSA-N	324.720	4.789	5	20	DJBD	
Cc1c(CN[C@@H](c2ccccc2)C2CCC2)cccc1[N+](=O)[O-]	532687820	DTHOXJQBYLBUHV-IBGZPJMESA-N	310.397	4.534	5	20	DJBD	
Cc1ccc(N[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1OC(F)F	538553793	LDWBXYQHWKLEBQ-NSHDSACASA-N	322.311	4.678	5	20	DJBD	
O=[N+]([O-])c1cc(NCC2CCC(C(F)(F)F)CC2)ccc1F	769884711	GUDOROCFOMHKTB-UHFFFAOYSA-N	320.286	4.515	5	20	DJBD	
CC(=O)c1ccc(N[C@@H](C)c2cc(C)sc2C)c([N+](=O)[O-])c1	25497796	UDBUSGDDXPLPRA-JTQLQIEISA-N	318.398	4.649	5	20	DJBD	
CC(C)c1ccc(CN[C@@H]2CCCc3ccccc32)cc1[N+](=O)[O-]	409468776	DJMGSIZKDXMCDX-LJQANCHMSA-N	324.424	4.885	5	20	DJBD	
CSc1cccc(NCc2ccc(C)c([N+](=O)[O-])c2)c1C	539227767	WCVDGCDTNZSUCK-UHFFFAOYSA-N	302.399	4.546	5	20	DJBD	
Cc1cc([C@H](C)N[C@@H]2CCc3c2cccc3[N+](=O)[O-])c(C)s1	565842082	BYYLDMHMATYWPP-MEDUHNTESA-N	316.426	4.611	5	20	DJBD	
C[C@H](N[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccsc1	619754112	CRFMOKBOACXGSC-ZBEGNZNMSA-N	316.426	4.730	5	20	DJBD	
CCCCC[C@@H](CC)C(=O)Nc1c(F)ccc([N+](=O)[O-])c1C	800143691	DOPJYAPEVHUHBC-GFCCVEGCSA-N	310.369	4.587	5	20	DJBD	
Cc1c(CNc2ccc(Cl)c(Cl)c2)cccc1[N+](=O)[O-]	35648700	MFXHMQFGLHOBHP-UHFFFAOYSA-N	311.168	4.822	5	20	DJBD	
CC[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1	79723734	XMDOEPDYJWKGCB-YVEFUNNKSA-N	302.349	4.536	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)SCc1c(C)noc1C	180682196	KRTCJIQITXYYSX-GFCCVEGCSA-N	306.387	4.502	5	20	DJBD	
Cc1ccc(C)c([C@@H](C)N(C)Cc2c(F)cccc2[N+](=O)[O-])c1	505790070	KPOIEYJKFWIGQH-CQSZACIVSA-N	316.376	4.544	5	20	DJBD	
C[C@H](Sc1ncccc1[N+](=O)[O-])c1cccc2ccccc12	520940702	BXEQGCSJPUTOQF-LBPRGKRZSA-N	310.378	4.996	5	20	DJBD	
CC[C@@H](NCc1cc([N+](=O)[O-])ccc1Cl)c1ccc(F)cc1	748820433	JQSUGPNIZVEDDK-MRXNPFEDSA-N	322.767	4.628	5	20	DJBD	
O=[N+]([O-])c1cc(C(F)(F)F)ccc1Oc1cc(F)cc(F)c1	495319140	KLYLPFKVJGUUSC-UHFFFAOYSA-N	319.185	4.684	5	20	DJBD	
CSCc1cccc(N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1	537532619	AHKVXODAADFSAJ-ZDUSSCGKSA-N	316.426	4.939	5	20	DJBD	
Cc1cc([C@@H](C)NCc2ccc([N+](=O)[O-])c(Cl)c2)ccc1F	761527284	ROLBXTQMBHFBDN-LLVKDONJSA-N	322.767	4.547	5	20	DJBD	
CC(C)(C)[C@H](NCc1ccc([N+](=O)[O-])c(F)c1)c1ccccc1	788494426	PKCRYRBBWQNEGB-QGZVFWFLSA-N	316.376	4.611	5	20	DJBD	
CCCOc1ccccc1NCc1ccc(Cl)cc1[N+](=O)[O-]	863998503	ZMUAERAIFRCSJA-UHFFFAOYSA-N	320.776	4.649	5	20	DJBD	
CN(C(=O)c1cc2ccccc2c2cccnc12)c1ccccc1	45766385	JRTTWOKVWKDEKU-UHFFFAOYSA-N	312.372	4.665	5	20	DJBD	
C[C@H]1CC[C@@H](N(C)C(=O)c2cc3ccccc3c3cccnc23)C1	464477291	DHFMBVIVBXDAMR-GOEBONIOSA-N	318.420	4.649	5	20	DJBD	
CC(C)Oc1ccccc1[C@@H](C)Nc1ccc([N+](=O)[O-])cc1	603862452	VVVNGISKNINZQJ-CYBMUJFWSA-N	300.358	4.555	5	20	DJBD	
CCOc1ccc(N[C@H](C)c2cccc([N+](=O)[O-])c2C)cc1F	776858739	YYELNMRSXJVPFI-GFCCVEGCSA-N	318.348	4.614	5	20	DJBD	
CC(C)(NCc1cccc(C(F)F)c1)c1ccccc1[N+](=O)[O-]	292157149	OCZGZNQTMLBJSB-UHFFFAOYSA-N	320.339	4.557	5	20	DJBD	
Cc1cc2occ(C(=O)Nc3cc([N+](=O)[O-])ccc3C)c2cc1C	472212486	DVRRNOWIZVHKSB-UHFFFAOYSA-N	324.336	4.519	5	20	DJBD	
O=[N+]([O-])c1ccc(/C(=C\c2cccc(F)c2)c2ccncc2)cc1	502180566	AXSQKHCNNGRRQH-CPNJWEJPSA-N	320.323	4.718	5	20	DJBD	
CSc1cc(Cl)ccc1NCc1cccc([N+](=O)[O-])c1	600856576	AUGLKBDNCZPHRT-UHFFFAOYSA-N	308.790	4.582	5	20	DJBD	
Cc1ccc2c(c1)[C@@H](Nc1ccc3ncccc3c1[N+](=O)[O-])CC2	609288456	XMWJCZRTZYOFOT-KRWDZBQOSA-N	319.364	4.551	5	20	DJBD	
CC[C@H](NCc1cc([N+](=O)[O-])ccc1Cl)c1ccsc1	834675861	LQFSUMFYTITDMV-AWEZNQCLSA-N	310.806	4.551	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H](C)c2sccc2C)cc1[N+](=O)[O-]	90217589	UVNAFSULBASPHS-QWHCGFSZSA-N	304.415	4.685	5	20	DJBD	
C[C@H](N[C@H]1CCc2cc(Cl)ccc21)c1ccc([N+](=O)[O-])cc1	178649598	NSGGEJBZIHCZFR-GTNSWQLSSA-N	316.788	4.586	5	20	DJBD	
CC[C@@H](Nc1cc(C)c([N+](=O)[O-])cc1Cl)c1c(C)noc1C	301830051	PLFHPQBICPTTCN-GFCCVEGCSA-N	323.780	4.725	5	20	DJBD	
C[C@@H](SCc1cccc(F)c1F)c1ccccc1[N+](=O)[O-]	437295175	TZQGSRBHGAZBQI-SNVBAGLBSA-N	309.337	4.867	5	20	DJBD	
Cc1cc(C)cc([C@@H](C)N[C@H](C)c2cc([N+](=O)[O-])ccc2C)c1	492849872	DTCJHRQQDRXFFI-HZPDHXFCSA-N	312.413	4.932	5	20	DJBD	
COCC1=CCN(Cc2c3ccccc3cc3ccccc23)CC1	775993847	CSQFVGGRVSDUHH-UHFFFAOYSA-N	317.432	4.772	5	20	DJBD	
Cc1cc(/C=C\c2ccc3cccc([N+](=O)[O-])c3n2)cc(C)c1O	96792281	IVODCWMKPXWISJ-VURMDHGXSA-N	320.348	4.636	5	20	DJBD	
CSCc1ccc(N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1	183109361	ZOQRPMIUXMZREQ-LBPRGKRZSA-N	302.399	4.631	5	20	DJBD	
Cc1c(CN[C@@H](C)c2ccc3ccccc3c2)cccc1[N+](=O)[O-]	326361615	HCENABZWMFLCQG-HNNXBMFYSA-N	320.392	4.907	5	20	DJBD	
CCSc1cccc(N[C@H](C)c2cccc([N+](=O)[O-])c2)c1	537523545	MGWVHBVPOMHIFS-GFCCVEGCSA-N	302.399	4.880	5	20	DJBD	
CSCc1ccc(N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1	540835838	SCRMDMZMYVQDKN-ZDUSSCGKSA-N	316.426	4.939	5	20	DJBD	
CSc1cccc(C)c1NCc1ccc(C)c([N+](=O)[O-])c1	864010756	LPYPSQYCPFKRKO-UHFFFAOYSA-N	302.399	4.546	5	20	DJBD	
Cc1ccsc1/C=C/c1nc2cc([N+](=O)[O-])ccc2s1	7746211	OBSGJGRRIRGECV-SNAWJCMRSA-N	302.380	4.745	5	20	DJBD	
O=[N+]([O-])c1ccc(SCc2ccccc2Br)cc1	42203487	BUAHSIWKYASMBF-UHFFFAOYSA-N	324.199	4.650	5	20	DJBD	
O=[N+]([O-])c1ccc(/C(=C/c2ccsc2)c2ccncc2)cc1	125859204	KQKWWFSGKFUKKS-BOPFTXTBSA-N	308.362	4.640	5	20	DJBD	
O=[N+]([O-])c1ccc2oc(/C(Cl)=C\c3ccsc3)nc2c1	255573759	HFKIUVVCEYARCN-BJMVGYQFSA-N	306.730	4.534	5	20	DJBD	
C[C@@H](Sc1c(F)cc(F)cc1F)c1ccccc1[N+](=O)[O-]	571135366	UGNIFJLEMRHLIF-MRVPVSSYSA-N	313.300	4.865	5	20	DJBD	
CCCCCC(C)(C)c1nnc(-c2cccc([N+](=O)[O-])c2)o1	1328157433	PFZIPBXLOHEMLT-UHFFFAOYSA-N	303.362	4.503	5	20	DJBD	
O=[N+]([O-])c1ccc(OCCC(F)(F)F)c(-c2cccs2)c1	553567235	UTPUXQVAPSQYEN-UHFFFAOYSA-N	317.288	4.655	5	20	DJBD	
CSc1ccccc1NCc1ccc(Cl)cc1[N+](=O)[O-]	232274252	SBUVZXWRTWNIPB-UHFFFAOYSA-N	308.790	4.582	5	20	DJBD	
Cc1ccc([C@@H](C)Nc2cccc(OC(F)F)c2)cc1[N+](=O)[O-]	320165989	YHMLFSCUMFTVQN-LLVKDONJSA-N	322.311	4.678	5	20	DJBD	
Cc1cccc([C@H](C)NCc2ccc(Cl)cc2[N+](=O)[O-])c1C	539289785	QIGWVTYXMLMQGS-ZDUSSCGKSA-N	318.804	4.716	5	20	DJBD	
C[C@H](NC1(c2ccc(Cl)cc2)CC1)c1cccc([N+](=O)[O-])c1	553858639	FEMUHGPZCBECHE-LBPRGKRZSA-N	316.788	4.588	5	20	DJBD	
O=[N+]([O-])c1ccc2oc(/C(Cl)=C/c3ccc(F)cc3)nc2c1	83536648	OYMIHVBYXLTCFK-GHXNOFRVSA-N	318.691	4.612	5	20	DJBD	
Cc1ccnc(N[C@@H](C)c2oc3ccccc3c2C)c1[N+](=O)[O-]	301294501	OSMAJIVVDGSCJH-LBPRGKRZSA-N	311.341	4.526	5	20	DJBD	
C[C@@H](NCc1ccc(C(C)(C)C)cc1)c1cccc([N+](=O)[O-])c1	321946733	GFSFVVGDKXWYQA-CQSZACIVSA-N	312.413	4.743	5	20	DJBD	
CC[C@H](Nc1ncc(C)cc1[N+](=O)[O-])c1cccc(Cl)c1	463053373	LACWMTXVQWKTHX-ZDUSSCGKSA-N	305.765	4.515	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)Nc1cccc(OC(F)F)c1	537398727	NCHIDRFVRVXZBW-LLVKDONJSA-N	322.311	4.678	5	20	DJBD	
Cc1cc(N[C@H](C)c2ccccc2[N+](=O)[O-])ccc1OC(C)C	743481121	WNJUNVZFZXQKPO-CQSZACIVSA-N	314.385	4.864	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H](C)c2cc([N+](=O)[O-])ccc2C)s1	765305406	OWCLRAFIPSWYJN-OLZOCXBDSA-N	304.415	4.685	5	20	DJBD	
CC[C@](C)(NCc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1	775388438	RQYNUPNTXAPYPB-KRWDZBQOSA-N	318.804	4.663	5	20	DJBD	
Cc1ccc(CNc2cccc(Cl)c2Cl)cc1[N+](=O)[O-]	37243494	KOGIMPHOVZGEHN-UHFFFAOYSA-N	311.168	4.822	5	20	DJBD	
O=C(Nc1ccccc1F)c1cc2ccccc2c2cccnc12	45763134	CJAQNQYABHYTRO-UHFFFAOYSA-N	316.335	4.779	5	20	DJBD	
CC(C)Oc1ccccc1N[C@@H](C)c1ccccc1[N+](=O)[O-]	315884427	ORVJBMIJHNCGLZ-ZDUSSCGKSA-N	300.358	4.555	5	20	DJBD	
CSc1cc(Cl)ccc1NCc1ccc(C)c([N+](=O)[O-])c1	600860659	JWUKNBKMLLFJGR-UHFFFAOYSA-N	322.817	4.891	5	20	DJBD	
O=[N+]([O-])c1cc(/C=C/c2nc(-c3ccccc3)cs2)cs1	603894494	ZJWMGOOLEYFMNO-VOTSOKGWSA-N	314.391	4.950	5	20	DJBD	
Cc1cc(NCc2ccc(C)c([N+](=O)[O-])c2)c2ccccc2c1	864038026	FXWJNEPEPXSTJA-UHFFFAOYSA-N	306.365	4.977	5	20	DJBD	
C[C@H](CC1CC1)NCc1ccc(-c2ccccc2[N+](=O)[O-])s1	497320631	WZCXYPBUWGVSEO-GFCCVEGCSA-N	316.426	4.602	5	20	DJBD	
CCCC(=O)COC(=O)c1c2ccccc2cc2ccccc12	738579019	KNVYWDLGPQQNMP-UHFFFAOYSA-N	306.361	4.519	5	20	DJBD	
CCC(CC)[C@@H](NCc1cccc([N+](=O)[O-])c1)c1ccccc1	319811208	PGAIMGFFCLTSPH-LJQANCHMSA-N	312.413	4.862	5	20	DJBD	
Cc1ccc2c(c1)CC[C@@H]2N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1	537941192	KRBGUPVJONHBIH-KSSFIOAISA-N	310.397	4.550	5	20	DJBD	
C[C@H](CCC(C)(C)C)C(=O)Nc1cccc([N+](=O)[O-])c1Cl	813246458	CWMAPFKGHTXXAL-SNVBAGLBSA-N	312.797	4.649	5	20	DJBD	
CC[C@H](N[C@@H](C)c1cc([N+](=O)[O-])ccc1C)c1ccc(F)cc1	1116575513	CYLICUBAXRLAIN-UGSOOPFHSA-N	316.376	4.844	5	20	DJBD	
Cc1cc([C@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2C)c(C)s1	122852324	MMVRYYSCLNTNHN-STQMWFEESA-N	318.442	4.993	5	20	DJBD	
C[C@@H](N[C@H](C)c1cc2ccccc2o1)c1cccc([N+](=O)[O-])c1	152773008	MCRDJNBKYCRYFC-CHWSQXEVSA-N	310.353	4.753	5	20	DJBD	
O=[N+]([O-])c1ccc2oc(CSc3ccc(Cl)cc3)nc2c1	434798209	YGGDAMWVVMBZJL-UHFFFAOYSA-N	320.757	4.682	5	20	DJBD	
C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@H]1c1ccc(Cl)cc1	511590807	CTZXSKVIWZUDAR-WBMJQRKESA-N	316.788	4.756	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H](C)c2ccc3c(c2)CCC3)cc1[N+](=O)[O-]	540221439	GKSTUYZBZWREHF-GJZGRUSLSA-N	324.424	4.804	5	20	DJBD	
O=[N+]([O-])c1ccccc1CN1CCC[C@@H]1c1cccc(Cl)c1	603855157	DBTCECFXSNTNTI-MRXNPFEDSA-N	316.788	4.585	5	20	DJBD	
C[C@@H](SCc1ccccc1[N+](=O)[O-])c1ccc(F)c(F)c1	609237669	JYCFTAVSSZOKKN-SNVBAGLBSA-N	309.337	4.867	5	20	DJBD	
O=C(c1c2ccccc2cc2ccccc12)N1C2CCC1CC2	1153492725	WXHUWCGWWKQZRD-UHFFFAOYSA-N	301.389	4.760	5	20	DJBD	
C[C@@H](N[C@H]1CCc2c(Cl)cccc21)c1cccc([N+](=O)[O-])c1	173361816	FBVFGPRKBKWHKZ-DIFFPNOSSA-N	316.788	4.586	5	20	DJBD	
O=[N+]([O-])c1cccc(Cl)c1CNc1ccc2ccoc2c1	442876434	XRQONQCKKGWUIY-UHFFFAOYSA-N	302.717	4.607	5	20	DJBD	
Cc1csc(CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1	379279782	QBVWYGXTTMZWFU-UHFFFAOYSA-N	316.304	4.596	5	20	DJBD	
O=[N+]([O-])c1ccccc1/C=C/CN1CCC[C@@H]1c1ccsc1	507167401	LCXVLIHBVUTLQH-WUTVXBCWSA-N	314.410	4.507	5	20	DJBD	
O=[N+]([O-])c1ccccc1Oc1cnc2ccc(Cl)cc2c1	561320977	RKVSFFUXDXLJLJ-UHFFFAOYSA-N	300.701	4.589	5	20	DJBD	
O=[N+]([O-])c1cc(CN[C@H](c2cccs2)C2CC2)ccc1Cl	812358080	HBMNZGLZWDLVPK-HNNXBMFYSA-N	322.817	4.551	5	20	DJBD	
CCSCc1ccc(NCc2cccc([N+](=O)[O-])c2C)cc1	864030168	IQXPFRPBSIFGKK-UHFFFAOYSA-N	316.426	4.768	5	20	DJBD	
Cc1ccc(C(F)(F)F)cc1NCc1ccc([N+](=O)[O-])cc1	316943537	GICMURRZKJFMKX-UHFFFAOYSA-N	310.275	4.534	5	20	DJBD	
CC(C)[C@H](C)N(C)C(=O)c1cc2ccccc2c2cccnc12	524421520	YVBBXMSSYREWLM-AWEZNQCLSA-N	306.409	4.505	5	20	DJBD	
CCC(CC)CNC(=O)c1cc2ccccc2c2cccnc12	591291229	CKBGFQZZTLLKTL-UHFFFAOYSA-N	306.409	4.554	5	20	DJBD	
CN(CCCCCO)Cc1c2ccccc2cc2ccccc12	789763162	FZTCUQLYUPGNNE-UHFFFAOYSA-N	307.437	4.587	5	20	DJBD	
C[C@@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1cc2ccccc2o1	577886682	RRFLRSBZPQAMGS-MLGOLLRUSA-N	322.364	4.679	5	20	DJBD	
CCn1c(C)nc([N+](=O)[O-])c1SCc1ccc(C(C)C)cc1	584000507	IUHICFJZUYTKSK-UHFFFAOYSA-N	319.430	4.535	5	20	DJBD	
CC[C@@H](CC(F)(F)F)Nc1ccc(C(F)F)cc1[N+](=O)[O-]	596192179	MEARDLSWUPPYNE-QMMMGPOBSA-N	312.238	4.675	5	20	DJBD	
C[C@@H]1C[C@H](NCc2c3ccccc3cc3ccccc23)CCN1C	742374738	DXTCSOSZQZOAJM-VQIMIIECSA-N	318.464	4.565	5	20	DJBD	
CC(C)(C)c1ccccc1-c1nnc(-c2cccc([N+](=O)[O-])c2)o1	1341333538	ZHURBDSGPWAUOG-UHFFFAOYSA-N	323.352	4.609	5	20	DJBD	
Cc1c(CN[C@H]2CC[C@@H](C)c3ccccc32)cccc1[N+](=O)[O-]	323044577	DEWYKUSOVHKDIZ-ACJLOTCBSA-N	310.397	4.631	5	20	DJBD	
Cc1ccc([C@H](C)NCc2c(Cl)cccc2[N+](=O)[O-])c(C)c1	494804284	CCSIOTUMVYDEFE-ZDUSSCGKSA-N	318.804	4.716	5	20	DJBD	
C[C@H](NCc1ccccc1[N+](=O)[O-])c1ccccc1C(C)(C)C	539093398	PEHICGZHHWQMGI-AWEZNQCLSA-N	312.413	4.743	5	20	DJBD	
CSc1ccc([C@@H](C)Nc2ncc([N+](=O)[O-])cc2Cl)cc1	543090280	GZZYNAVLEMCGSA-SECBINFHSA-N	323.805	4.538	5	20	DJBD	
CCOCc1cccc(N[C@H](C)c2cccc([N+](=O)[O-])c2C)c1	182947396	SBFQXHZLOWIDSI-CQSZACIVSA-N	314.385	4.613	5	20	DJBD	
C[C@H](N[C@H](C)c1csc(Cl)c1)c1cccc([N+](=O)[O-])c1	191213841	XFBQFSRALZAHSX-VHSXEESVSA-N	310.806	4.722	5	20	DJBD	
CC(/C=C\c1nc2ccccc2o1)=C/c1cccc([N+](=O)[O-])c1	469111871	WLQMTZQBJIPBTG-ZRQQEUPBSA-N	306.321	4.853	5	20	DJBD	
C[C@@H]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)CC1	521718777	MSTBWPFQFHVJFN-OAHLLOKOSA-N	318.420	4.650	5	20	DJBD	
Oc1cccc(CNCc2c3ccccc3cc3ccccc23)c1	725850986	FPYVHDHZKTWSON-UHFFFAOYSA-N	313.400	4.988	5	20	DJBD	
CCCC[C@@H](CC)CC(=O)Nc1c(F)ccc([N+](=O)[O-])c1C	800143973	PSDKXZDFJWTBSC-GFCCVEGCSA-N	310.369	4.587	5	20	DJBD	
O=[N+]([O-])c1ccc(F)cc1CSc1nc2ccccc2s1	915790496	JAXBPAZPAHFTQH-UHFFFAOYSA-N	320.370	4.636	5	20	DJBD	
Cc1c([C@H](C)N[C@@H](C)c2ccc(F)cc2F)cccc1[N+](=O)[O-]	153560852	JZKOEJXREWULGI-RYUDHWBXSA-N	320.339	4.593	5	20	DJBD	
O=[N+]([O-])c1ccc(/C(=C\c2ccsc2)c2ccncc2)cc1	255518923	KQKWWFSGKFUKKS-GZTJUZNOSA-N	308.362	4.640	5	20	DJBD	
CCC[C@H](NCc1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1	315093882	RXEDPHFRUXZDOC-KRWDZBQOSA-N	318.804	4.879	5	20	DJBD	
CC(C)c1ccc([C@@H]2CCCN2c2ncc([N+](=O)[O-])s2)cc1	409719489	YWLKYCDYTWVGEI-AWEZNQCLSA-N	317.414	4.516	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2ncnc3sc4ccccc4c23)cc1	440641027	VHMKDRBWVAZPGH-UHFFFAOYSA-N	323.333	4.545	5	20	DJBD	
O=[N+]([O-])c1cccc(SCc2ncc(-c3ccccc3)o2)c1	509090697	SDLFCNAARSNJQU-UHFFFAOYSA-N	312.350	4.542	5	20	DJBD	
CSc1cccc(N[C@H](C)c2cccc([N+](=O)[O-])c2C)c1	540710046	UVUKGJQDXPXIIJ-GFCCVEGCSA-N	302.399	4.798	5	20	DJBD	
CC(C)c1ccc(CN[C@H](C)Cc2cccs2)cc1[N+](=O)[O-]	603586031	CIUMEDBSDNCMJQ-CYBMUJFWSA-N	318.442	4.501	5	20	DJBD	
CC(C)[C@H](NCc1ccc([N+](=O)[O-])c(Cl)c1)c1ccccc1	761520446	GDIYSNGVVCGFLH-KRWDZBQOSA-N	318.804	4.735	5	20	DJBD	
O=C(c1c2ccccc2cc2ccccc12)N1[C@H]2C=CC[C@H]1CC2	800012938	SIGZJMBUFDFKCP-ROUUACIJSA-N	313.400	4.926	5	20	DJBD	
COc1cc(N[C@H](C)c2ccc(Cl)c(F)c2)ccc1[N+](=O)[O-]	1324644764	OQORSYFRDXBTOU-SECBINFHSA-N	324.739	4.569	5	20	DJBD	
O=[N+]([O-])c1ccc(CSc2nc3ccccc3s2)cc1F	94775510	WGLMPIINZBAQGZ-UHFFFAOYSA-N	320.370	4.636	5	20	DJBD	
CC[C@H](Nc1ccc(Cl)cc1[N+](=O)[O-])c1nc(C)cs1	301175866	GIESDIBGSJNILM-JTQLQIEISA-N	311.794	4.576	5	20	DJBD	
Cc1cc(N[C@@H](C)c2cc3ccccc3s2)ncc1[N+](=O)[O-]	301437169	MXRWNOXOBIZSEY-NSHDSACASA-N	313.382	4.686	5	20	DJBD	
Cc1nc(C)c(CS[C@@H](C)c2ccccc2[N+](=O)[O-])s1	437435947	ZMPDNPMUXKBFIS-JTQLQIEISA-N	308.428	4.663	5	20	DJBD	
CC[C@H](Nc1ccc([N+](=O)[O-])c(N)c1F)c1ccc(Cl)cc1	471249691	IXQMICUEEAFOIR-NSHDSACASA-N	323.755	4.533	5	20	DJBD	
Cc1ccccc1[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)C1CC1	531717388	QUYKPWHFMZHZOX-LIRRHRJNSA-N	310.397	4.705	5	20	DJBD	
CC[C@H](Nc1ccc([N+](=O)[O-])cc1)c1ncc(-c2ccccc2)[nH]1	537092205	MSCJFUNYMKCRPU-INIZCTEOSA-N	322.368	4.548	5	20	DJBD	
CCC[C@H](Nc1cccc(OC)c1F)c1cccc([N+](=O)[O-])c1	769982876	XQAOMUUWIOPARU-AWEZNQCLSA-N	318.348	4.696	5	20	DJBD	
C[C@H](SCCC1SCCS1)c1ccccc1[N+](=O)[O-]	853797173	KATTYFQFBCGQRG-JTQLQIEISA-N	315.485	4.585	5	20	DJBD	
Cc1cc([N+](=O)[O-])c(C)cc1-c1noc(C(F)=C2CCCC2)n1	1347667226	AYXBLTIGOBCLSX-UHFFFAOYSA-N	317.320	4.516	5	20	DJBD	
C[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1	20545600	KRNGZNCKUMEFER-NWDGAFQWSA-N	304.777	4.660	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H](C)c1ccc(F)cc1F	153560509	VEOCAUKIEWFMQJ-VXGBXAGGSA-N	320.339	4.593	5	20	DJBD	
CCC[C@@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccsc1	191223048	UONQJQPETJYWEN-MLGOLLRUSA-N	304.415	4.848	5	20	DJBD	
Cc1cc([C@H](C)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)s1	195614587	KJRUKNSTIIGHQJ-OLZOCXBDSA-N	318.442	4.993	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H](C)c2ccc(Cl)cc2)cc1[N+](=O)[O-]	314053466	PJMPZZKPFHUGMQ-STQMWFEESA-N	318.804	4.968	5	20	DJBD	
CC[C@@H](NCc1cccc([N+](=O)[O-])c1C)c1ccc(Cl)s1	544452734	XXODCULJJADSOJ-GFCCVEGCSA-N	324.833	4.859	5	20	DJBD	
Cc1ccc2c(c1)[C@@H](N[C@H](C)c1cccc([N+](=O)[O-])c1C)CC2	611335763	ZTLRZHIIQCRECG-KDOFPFPSSA-N	310.397	4.550	5	20	DJBD	
CCOc1ccc(S[C@@H](C)c2ccccc2[N+](=O)[O-])cc1	742452376	OJKXUORCACAEPU-LBPRGKRZSA-N	303.383	4.847	5	20	DJBD	
CCC[C@@H](C)C(=O)OCc1nc2ccccc2c2ccccc12	919232269	RADUPNHXYIKWHT-CQSZACIVSA-N	307.393	4.867	5	20	DJBD	
C[C@H](SCc1ccc(Cl)cn1)c1ccccc1[N+](=O)[O-]	1337350084	CDQFVQOKEWVKCF-JTQLQIEISA-N	308.790	4.638	5	20	DJBD	
CSc1ccc(CSCc2ccc([N+](=O)[O-])cc2)cc1	58689491	WTIXUPMTVPOFRV-UHFFFAOYSA-N	305.424	4.750	5	20	DJBD	
CCOc1cc(N[C@@H](C)c2ccc(C)s2)ccc1[N+](=O)[O-]	111048333	AIEOBYXOVHGPAI-NSHDSACASA-N	306.387	4.537	5	20	DJBD	
CC[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1cc(F)ccc1F	173437943	RWTWVPLJWNBEQO-DIFFPNOSSA-N	320.339	4.675	5	20	DJBD	
O=[N+]([O-])c1ccc(CNc2ccc(-c3ccccc3)cc2)cc1	390589262	ZRHRDDPKAVPPIT-UHFFFAOYSA-N	304.349	4.874	5	20	DJBD	
CCN(C(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1)C1CCCCC1	439138836	XFIXFMVLUQLTKG-UHFFFAOYSA-N	318.417	4.513	5	20	DJBD	
Cc1cnc(Oc2ccc(Cl)c3ccccc23)c([N+](=O)[O-])c1	463054211	LSGHGBWZKIYJEO-UHFFFAOYSA-N	314.728	4.897	5	20	DJBD	
C[C@@H](CC1CCCCC1)c1nnc(-c2cccc([N+](=O)[O-])c2)o1	1117204149	WDMRQJNAHJSZSP-LBPRGKRZSA-N	315.373	4.719	5	20	DJBD	
C[C@H](N[C@H](C)c1cc2ccccc2o1)c1ccccc1[N+](=O)[O-]	122079899	UTLLVNHIFWUXEC-QWHCGFSZSA-N	310.353	4.753	5	20	DJBD	
O=[N+]([O-])c1ccccc1N1CCC[C@@H]1c1ccc(Cl)cc1	603848440	OOZIAXSKFCCPFD-CQSZACIVSA-N	302.761	4.590	5	20	DJBD	
Cc1cc(F)ccc1[C@H](C)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1	815595013	FVFHYWQAMFCNLB-KBPBESRZSA-N	316.376	4.763	5	20	DJBD	
C[C@@H](NC1(C)CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1	1320668994	DCFXFTKXWOVZLM-LLVKDONJSA-N	302.399	4.526	5	20	DJBD	
CC[C@@H](Nc1ccc(Cl)cc1[N+](=O)[O-])c1nc(C)cs1	301175867	GIESDIBGSJNILM-SNVBAGLBSA-N	311.794	4.576	5	20	DJBD	
Cc1cc(N[C@@H](C)c2ccc(OC(C)C)cc2)ccc1[N+](=O)[O-]	321270146	GNSANMDJYUWYNR-AWEZNQCLSA-N	314.385	4.864	5	20	DJBD	
CC[C@H](C)n1ncc(N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1C	477915182	IGYVJJDOCAJKOE-QWHCGFSZSA-N	316.405	4.552	5	20	DJBD	
CCC[C@H](C)N(C)C(=O)c1cc2ccccc2c2cccnc12	78898432	BZNHEGYCIPGWTO-AWEZNQCLSA-N	306.409	4.649	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1Oc1ccccc1OC(F)F	302788618	XORPFSBXJSZCRT-UHFFFAOYSA-N	315.659	4.642	5	20	DJBD	
O=C(c1ccc([N+](=O)[O-])cc1)N(c1ccccc1)C1CCCCC1	498095747	RSVAMZVUEKSRRG-UHFFFAOYSA-N	324.380	4.574	5	20	DJBD	
COc1cc(CSc2ccc([N+](=O)[O-])cc2)ccc1SC	553581307	WKOSSBBTGZKTEN-UHFFFAOYSA-N	321.423	4.618	5	20	DJBD	
C[C@H](Nc1ccc(CC(F)(F)F)cc1)c1ccccc1[N+](=O)[O-]	610342120	ZJTVHMHUIVYMAX-NSHDSACASA-N	324.302	4.873	5	20	DJBD	
O=[N+]([O-])c1ccc2nc(SCCC(F)(F)Cl)sc2c1	863229153	SHQYBDMWZOFBMP-UHFFFAOYSA-N	324.761	4.518	5	20	DJBD	
O=C(O[C@@H]1CCCCC1=O)c1c2ccccc2cc2ccccc12	3376946	WVNAPOMJIUOVRP-LJQANCHMSA-N	318.372	4.662	5	20	DJBD	
Cc1cc([C@@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2C)c(C)s1	122852132	MMVRYYSCLNTNHN-QWHCGFSZSA-N	318.442	4.993	5	20	DJBD	
C[C@H](SCc1cccc([N+](=O)[O-])c1)c1nc2ccccc2o1	183257716	IQEOSOJKFCZPAG-NSHDSACASA-N	314.366	4.730	5	20	DJBD	
O=[N+]([O-])c1ccccc1CNc1ccc2c(c1)Cc1ccccc1-2	391919493	OCMMEFAEWQQBFW-UHFFFAOYSA-N	316.360	4.778	5	20	DJBD	
CC(C)[C@H](NCc1ccccc1[N+](=O)[O-])c1cc2ccccc2o1	538461980	CNRDJFFLYCLVMB-IBGZPJMESA-N	324.380	4.828	5	20	DJBD	
CCC(=O)c1ccc(N[C@@H](C)c2ccc(C)s2)c([N+](=O)[O-])c1	795072131	GXGZWYGIPNRSPM-NSHDSACASA-N	318.398	4.731	5	20	DJBD	
CCCOc1ccccc1N[C@@H](C)c1cccc([N+](=O)[O-])c1	387719259	MONBEYZCRLGZLB-ZDUSSCGKSA-N	300.358	4.557	5	20	DJBD	
Cc1ccnc(Oc2ccc(Oc3ccccc3)cc2)c1[N+](=O)[O-]	518506808	YSGLMIJKNBSTTD-UHFFFAOYSA-N	322.320	4.883	5	20	DJBD	
Cc1cc(N[C@@H](C)c2ccccc2[N+](=O)[O-])ccc1OC(C)C	743481120	WNJUNVZFZXQKPO-AWEZNQCLSA-N	314.385	4.864	5	20	DJBD	
CCC(=O)[C@H](C)OC(=O)c1c2ccccc2cc2ccccc12	918867662	FKZHJGWEDDEREL-ZDUSSCGKSA-N	306.361	4.517	5	20	DJBD	
Cc1ccsc1CNc1ccc([N+](=O)[O-])cc1C(F)(F)F	108934201	GWTNGTYCMKVINJ-UHFFFAOYSA-N	316.304	4.596	5	20	DJBD	
C[C@@H](CC1CC1)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1	497320853	YRRKSVJBBAYJMA-LBPRGKRZSA-N	316.426	4.602	5	20	DJBD	
O=[N+]([O-])c1cccc2nc(/C=C/c3c(F)cccc3F)ccc12	8321801	UPWGMSIDOWRYTM-VQHVLOKHSA-N	312.275	4.592	5	20	DJBD	
Cc1cc([C@H](C)N[C@H](C)c2cc([N+](=O)[O-])ccc2C)c(C)o1	119395902	FQXLKZUXGNZTCS-OLZOCXBDSA-N	302.374	4.525	5	20	DJBD	
C[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1csc(Cl)c1	191213827	XFBQFSRALZAHSX-ZJUUUORDSA-N	310.806	4.722	5	20	DJBD	
CCc1cc(Oc2ncc([N+](=O)[O-])cc2Cl)ccc1Cl	303758251	JZUPSFZUQSNTRU-UHFFFAOYSA-N	313.140	4.651	5	20	DJBD	
Cc1ccc2c(c1)CC[C@H]2N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1	537941190	KRBGUPVJONHBIH-KBXCAEBGSA-N	310.397	4.550	5	20	DJBD	
CC[C@@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(F)cc1F	540339601	PISBYKZQECHDER-MEDUHNTESA-N	320.339	4.675	5	20	DJBD	
C[C@@H](Nc1ccc2nc(C3CC3)oc2c1)c1cccc([N+](=O)[O-])c1	182896016	HUQCTGBQHFEBFL-LLVKDONJSA-N	323.352	4.787	5	20	DJBD	
O=[N+]([O-])c1c(Oc2ccc(F)c(Cl)c2)ccc2ncccc12	480335468	ONHCMSMACZRNMB-UHFFFAOYSA-N	318.691	4.728	5	20	DJBD	
Cc1ccc([C@H](C)NCc2ccc3occc3c2)cc1[N+](=O)[O-]	512044714	HIECLJQIELFWPN-ZDUSSCGKSA-N	310.353	4.500	5	20	DJBD	
O=[N+]([O-])c1cccc(-c2nc(-c3ccccc3F)cs2)c1	71971797	XVADKDJKWKDDDS-UHFFFAOYSA-N	300.314	4.524	5	20	DJBD	
CC[C@H](NCc1ccccc1[N+](=O)[O-])c1ccc(Cl)s1	89512095	FWODSHIVAYPWMB-NSHDSACASA-N	310.806	4.551	5	20	DJBD	
Cc1cccc([C@H](C)Nc2ccc([N+](=O)[O-])c3cccnc23)c1C	303633172	FWKBWYYNIVMKRU-AWEZNQCLSA-N	321.380	4.933	5	20	DJBD	
CCc1nc(CS[C@H](C)c2ccccc2[N+](=O)[O-])cs1	437259852	OZJVPIAJMNWZHO-SNVBAGLBSA-N	308.428	4.608	5	20	DJBD	
Cc1ccc(C[C@@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2C)s1	531713029	YHVBFPYCLCOKTP-BXUZGUMPSA-N	318.442	4.555	5	20	DJBD	
C/C=C\c1ccc(NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])cc1	565425765	FJGUCRVZGUJPQZ-DAXSKMNVSA-N	324.380	4.544	5	20	DJBD	
CC(C)(C)SCCSc1ccc2ncccc2c1[N+](=O)[O-]	784684395	JDFMDMVZUDVZJR-UHFFFAOYSA-N	322.455	4.767	5	20	DJBD	
Cc1noc([C@H](C)NCc2c3ccccc3cc3ccccc23)n1	792177922	XLLXEQJXCYZYDV-ZDUSSCGKSA-N	317.392	4.535	5	20	DJBD	
Cc1cc([C@@H](C)NCc2ccc([N+](=O)[O-])cc2Cl)c(C)s1	49963659	CGUOPVIQOKEWSS-SNVBAGLBSA-N	324.833	4.777	5	20	DJBD	
Cc1cc(C)cc(NCc2cc([N+](=O)[O-])ccc2OC(C)C)c1	462221987	KNLGNRUBFQESKD-UHFFFAOYSA-N	314.385	4.611	5	20	DJBD	
C[C@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccccc1Cl	582855964	HHUBNMWLYNSTQA-MEDUHNTESA-N	316.788	4.586	5	20	DJBD	
CC[C@H](Cc1ccccc1)Nc1ccc([N+](=O)[O-])c2cnccc12	609039569	WULKIILXHHYIQH-OAHLLOKOSA-N	321.380	4.576	5	20	DJBD	
CC[C@H](Nc1ccc2ccn(C)c2c1)c1cccc([N+](=O)[O-])c1	443199792	FFFYWQGHGVCQQT-KRWDZBQOSA-N	309.369	4.650	5	20	DJBD	
O=C(Nc1cccc([N+](=O)[O-])c1)c1cscc1-c1ccccc1	463126641	UPTABHGPKNQAME-UHFFFAOYSA-N	324.361	4.576	5	20	DJBD	
Cc1ccc2c(c1)CC[C@H]2Nc1ccc([N+](=O)[O-])c2cccnc12	511714467	VJHFBQKJGJNAHH-MRXNPFEDSA-N	319.364	4.551	5	20	DJBD	
C[C@@H](C(=O)Nc1ccc(C2CCC2)cc1)c1cccc([N+](=O)[O-])c1	571016565	QFOKSFBKSWTVMV-CYBMUJFWSA-N	324.380	4.605	5	20	DJBD	
COC(=O)[C@](C)(F)c1cccc2c1ccc1c(F)cc(F)cc12	98178041	LZLMUPDHMXYBTB-GOSISDBHSA-N	318.294	4.629	5	20	DJBD	
O=[N+]([O-])c1cccc2c1ccn2Cc1ccc(C(F)(F)F)cc1	112653516	YBQVDJQQPIZTBA-UHFFFAOYSA-N	320.270	4.617	5	20	DJBD	
CSCc1ccc(N[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1	178653590	JXSOLAMZLXIAII-LBPRGKRZSA-N	302.399	4.631	5	20	DJBD	
O=[N+]([O-])c1cccc(F)c1CSc1cccc2cccnc12	501148761	IOXMALHFIYTHGD-UHFFFAOYSA-N	314.341	4.574	5	20	DJBD	
Cc1cc2cc([C@H](C)NCc3ccc([N+](=O)[O-])cc3)oc2cc1C	537991892	QHTZARDGYQXDJP-AWEZNQCLSA-N	324.380	4.809	5	20	DJBD	
O=[N+]([O-])c1cccc(CNc2ccc(SC(F)F)cc2)c1	35038251	RWHLBJQYRJWGFM-UHFFFAOYSA-N	310.325	4.522	5	20	DJBD	
CC(C)n1ncc2ccc(N[C@@H](C)c3ccc([N+](=O)[O-])cc3)cc21	183006670	UKYBDQUTXYNPFO-ZDUSSCGKSA-N	324.384	4.699	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1N1CCC[C@@H]1c1cccs1	301239236	IFQZRCCOVJBIKY-GFCCVEGCSA-N	308.790	4.651	5	20	DJBD	
CCC[C@@H](NCc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1	315159282	USDJDUBLKZPXFD-MRXNPFEDSA-N	318.804	4.879	5	20	DJBD	
CC[C@H](CN[C@@H](C)c1cccc([N+](=O)[O-])c1C)CC(F)(F)F	414255569	FRMAZHIPBSRLAM-RYUDHWBXSA-N	318.339	4.532	5	20	DJBD	
CC(C)c1cccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c1	490829546	UYDYIVFTYJZLFC-UHFFFAOYSA-N	324.336	4.717	5	20	DJBD	
CC(C)[C@H](NCc1ccccc1[N+](=O)[O-])c1ccccc1Cl	538116486	KREKQQXCBVDMTD-KRWDZBQOSA-N	318.804	4.735	5	20	DJBD	
C[C@@H](O)[C@@H]1CCCN(Cc2c3ccccc3cc3ccccc23)C1	780893306	VZZCGCPKNUELRX-VQIMIIECSA-N	319.448	4.586	5	20	DJBD	
CCC[C@H](N[C@@H]1CCCc2occc21)c1cccc([N+](=O)[O-])c1	120788032	DCOKRVOFEUHVIG-DLBZAZTESA-N	314.385	4.696	5	20	DJBD	
CSc1ccccc1NCc1c(Cl)cccc1[N+](=O)[O-]	230932586	KHDZKCOLTSZPFL-UHFFFAOYSA-N	308.790	4.582	5	20	DJBD	
CC(C)(C)C[C@H](NCc1cccc([N+](=O)[O-])c1)c1ccccc1	320096871	VMBFGWHWOFIPMG-SFHVURJKSA-N	312.413	4.862	5	20	DJBD	
Cc1cc2cc([C@H](C)NCc3ccccc3[N+](=O)[O-])oc2cc1C	540192329	DULJIPPBXNWXNI-AWEZNQCLSA-N	324.380	4.809	5	20	DJBD	
O=C(N[C@@H]1CCCSC1)c1c2ccccc2cc2ccccc12	748806558	OIIXFINELDLNSG-MRXNPFEDSA-N	321.445	4.618	5	20	DJBD	
CC[C@@H](Nc1ccccc1OC(F)F)c1cccc([N+](=O)[O-])c1	320121401	DSAGXBYCFNDBQQ-CYBMUJFWSA-N	322.311	4.759	5	20	DJBD	
O=[N+]([O-])c1cccc(Cl)c1OCc1cccc(C(F)F)c1	475971844	KNEPBMCPMWVZNZ-UHFFFAOYSA-N	313.687	4.765	5	20	DJBD	
Cc1ccoc1C(=O)OCc1nc2ccccc2c2ccccc12	16416887	CTERPFBBTZRZFE-UHFFFAOYSA-N	317.344	4.646	5	20	DJBD	
CC(C)(CNc1ccc([N+](=O)[O-])c2cnccc12)c1ccccc1	25503406	VCIPXULQWGKFNW-UHFFFAOYSA-N	321.380	4.533	5	20	DJBD	
O=[N+]([O-])c1cccc2ccc(/C=C/c3cc(F)ccc3F)nc12	59269818	AJFUIXLZIZXAOK-VMPITWQZSA-N	312.275	4.592	5	20	DJBD	
CC(C)c1ccc(CN[C@H]2CCCc3ccccc32)cc1[N+](=O)[O-]	61003493	DJMGSIZKDXMCDX-IBGZPJMESA-N	324.424	4.885	5	20	DJBD	
CC(C)c1ccccc1NC(=O)c1cccc(Cl)c1[N+](=O)[O-]	175503357	RCSFMFQKCXQUQY-UHFFFAOYSA-N	318.760	4.624	5	20	DJBD	
CCCN(CCC)C(=O)c1cc2ccccc2c2cccnc12	509529025	LNUVQDNAEPICEL-UHFFFAOYSA-N	306.409	4.650	5	20	DJBD	
CSc1ccc(C)c(N[C@@H](C)c2ccccc2[N+](=O)[O-])c1	539398829	FAAOZJYHMDZASK-LBPRGKRZSA-N	302.399	4.798	5	20	DJBD	
C[C@H](NCc1cc2ccccc2s1)c1ccc([N+](=O)[O-])cc1	550857313	RJTJBABFGBJOMD-LBPRGKRZSA-N	312.394	4.660	5	20	DJBD	
O=[N+]([O-])c1c(Cl)cc(Cl)cc1CSc1ccccn1	809947864	NVNIDWUVHFSFHL-UHFFFAOYSA-N	315.181	4.589	5	20	DJBD	
Cc1ccc(CN[C@@H](C)c2cc3ccccc3o2)cc1[N+](=O)[O-]	61027713	LFDQBXZNENUWIH-ZDUSSCGKSA-N	310.353	4.500	5	20	DJBD	
O=C(Nc1cccc(-c2ccccc2)c1)c1csc([N+](=O)[O-])c1	515492116	UQPNONLRNRISPN-UHFFFAOYSA-N	324.361	4.576	5	20	DJBD	
CC(C)(C)OCc1cccc(NCc2csc([N+](=O)[O-])c2)c1	922912923	OSOPYPVRQMVBJC-UHFFFAOYSA-N	320.414	4.584	5	20	DJBD	
C[C@H](N[C@@H](C)c1ccc(F)cc1Cl)c1cccc([N+](=O)[O-])c1	119703213	ZITNNFPTOKCDJM-QWRGUYRKSA-N	322.767	4.799	5	20	DJBD	
Cc1ccc2c(c1)CC[C@@H]2Nc1ccc2cc([N+](=O)[O-])ccc2n1	511714511	VPCNWKWQONJIJX-SFHVURJKSA-N	319.364	4.551	5	20	DJBD	
Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccc2ccccc2c1	514642713	OQJUWSGXOQSMIO-UHFFFAOYSA-N	320.348	4.617	5	20	DJBD	
CC[C@H](C)CSCc1coc(-c2ccc([N+](=O)[O-])cc2)n1	534794282	QTEKZOGFKMXJKU-NSHDSACASA-N	306.387	4.529	5	20	DJBD	
CC[C@H](Nc1ccc2cnn(CC)c2c1)c1cccc([N+](=O)[O-])c1	539734452	RGZYMCBHUSKMAU-KRWDZBQOSA-N	324.384	4.528	5	20	DJBD	
O=[N+]([O-])c1ccc(SCc2ccc(C(F)F)cc2)c(F)c1	618962675	BDGJCXYSVBQIJX-UHFFFAOYSA-N	313.300	4.964	5	20	DJBD	
C[C@@H](NC(=O)c1c2ccccc2cc2ccccc12)c1ccc[nH]1	760735666	DIERCGZENZGYCZ-CQSZACIVSA-N	314.388	4.812	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(C)c1-c1nc(C2CCCCCC2)no1	904686630	JTZOWSJBZTWLHZ-UHFFFAOYSA-N	315.373	4.699	5	20	DJBD	
C[C@H]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)CC1	62927991	MSTBWPFQFHVJFN-HNNXBMFYSA-N	318.420	4.650	5	20	DJBD	
CC[C@@H](NCc1coc2ccccc12)c1cccc([N+](=O)[O-])c1	121668157	BJHXZSVOTDBBDI-QGZVFWFLSA-N	310.353	4.582	5	20	DJBD	
C[C@H](N[C@@H]1CC[C@@H](C)c2ccccc21)c1cccc([N+](=O)[O-])c1	322132112	YVOZDBSXTWHVQA-BIENJYKASA-N	310.397	4.884	5	20	DJBD	
CC[C@H](C)n1ncc(N[C@H](CC)c2cccc([N+](=O)[O-])c2)c1C	477923075	NHZSZMGUIHZOLK-BLLLJJGKSA-N	316.405	4.634	5	20	DJBD	
Cc1c([C@H](C)N[C@H](C)c2ccccc2Cl)cccc1[N+](=O)[O-]	479766603	QEDHCRBSICNNRK-QWHCGFSZSA-N	318.804	4.968	5	20	DJBD	
C[C@H](c1cccs1)N(C)Cc1cc(Cl)ccc1[N+](=O)[O-]	746657203	CYDTULNZJMPVRY-SNVBAGLBSA-N	310.806	4.503	5	20	DJBD	
O=[N+]([O-])c1ccc(F)cc1CNc1ccc(Cl)cc1Cl	35308016	IXSPGVNTSNAFHN-UHFFFAOYSA-N	315.131	4.653	5	20	DJBD	
CO[C@@H](CS[C@@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1	583765645	AVWUNZOGBXLBDD-GUYCJALGSA-N	317.410	4.777	5	20	DJBD	
O=[N+]([O-])c1cccc(CN2CCC[C@@H]2c2ccc(Cl)cc2)c1	603497571	AVVAGHXHFSPVQZ-QGZVFWFLSA-N	316.788	4.585	5	20	DJBD	
C[C@@H](SCc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F	609237584	FZXRSCVYLKDBHO-SNVBAGLBSA-N	309.337	4.867	5	20	DJBD	
COc1ccc(CS[C@@H](C)c2cccs2)cc1[N+](=O)[O-]	737402414	LUYNDSVGCAJHOT-JTQLQIEISA-N	309.412	4.659	5	20	DJBD	
COc1ccc2ccccc2c1CNc1ccc([N+](=O)[O-])c(C)c1	392060137	CBPZNPMJNGSTNB-UHFFFAOYSA-N	322.364	4.677	5	20	DJBD	
CCC[C@H](c1ccccc1)c1nnc(-c2cccc([N+](=O)[O-])c2)o1	1117179268	PNECYTFFZBDBPM-MRXNPFEDSA-N	323.352	4.577	5	20	DJBD	
COc1cc(/C=C(\C)c2ccc3ccccc3n2)ccc1[N+](=O)[O-]	1322676022	PTXIAEDULKNYHF-ACCUITESSA-N	320.348	4.712	5	20	DJBD	
CCN(CC(F)F)C(=O)c1c2ccccc2cc2ccccc12	1342346370	KBCOQBSNAMVDAL-UHFFFAOYSA-N	313.347	4.720	5	20	DJBD	
CCC[C@@H](N[C@H](CC)c1ccncc1)c1cccc([N+](=O)[O-])c1	163721331	OQPZYCOPHUCYPZ-QZTJIDSGSA-N	313.401	4.572	5	20	DJBD	
C[C@H](Nc1ccccc1[N+](=O)[O-])c1ccc(-c2ccncc2)cc1	301414696	BEFNYHBBJQYYJL-AWEZNQCLSA-N	319.364	4.830	5	20	DJBD	
Cc1cccc([C@@H]2CCCN2Cc2ccccc2[N+](=O)[O-])c1C	610215043	BKOOSEQYWMWSPM-IBGZPJMESA-N	310.397	4.549	5	20	DJBD	
CC[C@@](C)(NCc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1	730817785	VMAUCUARQXGVAN-QGZVFWFLSA-N	318.804	4.663	5	20	DJBD	
C[C@@H](N[C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1	20526140	KSKWSUFMOWZJFS-VXGBXAGGSA-N	304.777	4.660	5	20	DJBD	
CCCC(CCC)SCC(=O)Nc1cc([N+](=O)[O-])ccc1C	64047944	KLPJXOXCAFNJRW-UHFFFAOYSA-N	324.446	4.544	5	20	DJBD	
Cc1cnc(Oc2ccc3c(c2)[nH]c2ccccc23)c([N+](=O)[O-])c1	742428835	RICLQMYCHMFKCZ-UHFFFAOYSA-N	319.320	4.725	5	20	DJBD	
CCCCCN(C(=O)c1ccc([N+](=O)[O-])cc1F)[C@@H](C)CCC	523030010	QZGVPIOBLYKNQZ-ZDUSSCGKSA-N	324.396	4.555	5	20	DJBD	
O=[N+]([O-])c1c(Cl)cccc1OCc1ccc(C(F)F)cc1	814775245	HTVFTUVREQOFSH-UHFFFAOYSA-N	313.687	4.765	5	20	DJBD	
CCCOc1cccc(N[C@H](C)c2cccc([N+](=O)[O-])c2)c1	315523138	IGKAHRPCVSDDEZ-CYBMUJFWSA-N	300.358	4.557	5	20	DJBD	
CC[C@H](C)Oc1cccc(NCc2ccc([N+](=O)[O-])cc2F)c1	391940897	OFGZYRVTRICQFP-LBPRGKRZSA-N	318.348	4.523	5	20	DJBD	
O=[N+]([O-])c1cccc(NCc2nc(C3CCCCC3)cs2)c1	435883626	LSSCJAUVNAUHLL-UHFFFAOYSA-N	317.414	4.711	5	20	DJBD	
CCC[C@H](NCc1ccc(C)c(F)c1)c1cccc([N+](=O)[O-])c1	480412003	MWPBEOFBFDAJIE-SFHVURJKSA-N	316.376	4.673	5	20	DJBD	
Cc1ccc2oc(N[C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)nc2c1	487639389	HDKIGTQITKCOLD-LBPRGKRZSA-N	311.341	4.526	5	20	DJBD	
CCC[C@@H](NCc1c(Cl)cccc1[N+](=O)[O-])c1ccccc1	494793224	JMJBPCZEXFYGEP-MRXNPFEDSA-N	318.804	4.879	5	20	DJBD	
Cc1c(NCc2cccc([N+](=O)[O-])c2)cccc1C(F)(F)F	864018882	BYFDQSWXRSFGKS-UHFFFAOYSA-N	310.275	4.534	5	20	DJBD	
CC(C)Oc1ccc([C@@H](C)Nc2ccccc2[N+](=O)[O-])cc1	315740777	NUTAISAIDOXVRU-CYBMUJFWSA-N	300.358	4.555	5	20	DJBD	
CC1(C)CCCN(C(=O)c2cc3ccccc3c3cccnc23)C1	494155989	HVFNLGNOAWPFSS-UHFFFAOYSA-N	318.420	4.650	5	20	DJBD	
CSc1ccc(C)c(N[C@H](C)c2ccccc2[N+](=O)[O-])c1	539398826	FAAOZJYHMDZASK-GFCCVEGCSA-N	302.399	4.798	5	20	DJBD	
CCC[C@@H](Nc1ccc(Cl)cc1[N+](=O)[O-])c1ccccn1	615942253	QHUVNLGFRGZTFW-CYBMUJFWSA-N	305.765	4.597	5	20	DJBD	
CCCCCN(C(=O)Nc1cc(C)c([N+](=O)[O-])cc1C)C(C)C	475555613	XUIKIRBEWWBDPO-UHFFFAOYSA-N	321.421	4.644	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](C)c1ccccc1Cl	489965731	NJDZENKIXOEGSK-QWHCGFSZSA-N	318.804	4.968	5	20	DJBD	
O=[N+]([O-])c1ccc(CSCc2ccc3ccccc3n2)cc1	513820610	SRBKZXZSZQTHBK-UHFFFAOYSA-N	310.378	4.576	5	20	DJBD	
C[C@H](c1ccco1)N(Cc1ccc(Cl)c([N+](=O)[O-])c1)C1CC1	768548906	KFQDWYLGAYCIBH-LLVKDONJSA-N	320.776	4.567	5	20	DJBD	
C[C@@H](Nc1ncc([N+](=O)[O-])s1)c1cc(Cl)ccc1Cl	409647184	ZYIQPQLTCCVLAY-ZCFIWIBFSA-N	318.185	4.531	5	20	DJBD	
O=C(Nc1ccc([N+](=O)[O-])cc1)c1cscc1-c1ccccc1	463281420	HQFSNSRCDKBPSP-UHFFFAOYSA-N	324.361	4.576	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)cc1/C=C\c1nc2ccccc2o1	739426086	IJTWOTOPVKJYRG-YVMONPNESA-N	300.701	4.560	5	20	DJBD	
Cc1ccccc1NC(=O)Nc1cc([N+](=O)[O-])c(Cl)cc1C	821507517	BZTFKCSCBYCSHJ-UHFFFAOYSA-N	319.748	4.509	5	20	DJBD	
Cc1ccc(N[C@@H]2CCSc3ccc(F)cc32)c([N+](=O)[O-])c1	1262673073	YEKUDWAMSYGHDU-CYBMUJFWSA-N	318.373	4.691	5	20	DJBD	
O=[N+]([O-])c1ccc(CNc2ccc3ccoc3c2)c(Cl)c1	442861101	CYIFDMWRBIDYLX-UHFFFAOYSA-N	302.717	4.607	5	20	DJBD	
C[C@@H](N[C@@H]1CCc2ccc(Cl)cc21)c1cccc([N+](=O)[O-])c1	479254711	WEMLWZZRLYOGRC-PIGZYNQJSA-N	316.788	4.586	5	20	DJBD	
CC(C)(C)C[C@H](Nc1ccc([N+](=O)[O-])cn1)c1ccc(F)cc1	603864685	HGRPPBWPQWRKIW-HNNXBMFYSA-N	317.364	4.718	5	20	DJBD	
CC[C@@H](N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1cccs1	49529261	UJFHJSOWYVDRCK-GXTWGEPZSA-N	304.415	4.767	5	20	DJBD	
CSc1cccc(NCc2ccc([N+](=O)[O-])cc2Cl)c1	49963079	OSRYNQCUEDRYTG-UHFFFAOYSA-N	308.790	4.582	5	20	DJBD	
C[C@H](N[C@@H](C)c1csc(Cl)c1)c1ccc([N+](=O)[O-])cc1	297288819	LSLVADASFIQLTK-UWVGGRQHSA-N	310.806	4.722	5	20	DJBD	
Cc1ccc(C[C@@H](C)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1	315330310	VSNAZPNLNLHCHZ-TZMCWYRMSA-N	318.442	4.555	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2nc3ccccc3o2)c2ccccc12	465053869	PWCFZVJBVPMOPW-UHFFFAOYSA-N	306.277	4.682	5	20	DJBD	
Cc1ccccc1[C@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)C(C)C	531711645	LBONXRCWBDHRQT-DNVCBOLYSA-N	312.413	4.951	5	20	DJBD	
CCC[C@@H](Nc1ccc(SC)cn1)c1cccc([N+](=O)[O-])c1	579101739	INODFQOJCVOOSG-OAHLLOKOSA-N	317.414	4.665	5	20	DJBD	
CC[C@@H](NCc1cc(Cl)ccc1[N+](=O)[O-])c1ccc(C)cc1	774807867	XUSLAPMEUQZYPV-MRXNPFEDSA-N	318.804	4.798	5	20	DJBD	
CC(C)[C@@H](NCc1csc([N+](=O)[O-])c1)c1ccc(Cl)cc1	37562836	SKENEVLMEFPFCM-OAHLLOKOSA-N	324.833	4.797	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)cc1OCc1ccc(Cl)s1	109744310	UJNFWDGIQABIQT-UHFFFAOYSA-N	304.154	4.542	5	20	DJBD	
C[C@H](Nc1ncc([N+](=O)[O-])s1)c1ccc(Cl)cc1Cl	226769244	JBHXMMDNMSSZLF-LURJTMIESA-N	318.185	4.531	5	20	DJBD	
CC[C@H](Nc1cc(C)c([N+](=O)[O-])cn1)c1cccc(Cl)c1	470856714	HENSGDYXIHCAIW-ZDUSSCGKSA-N	305.765	4.515	5	20	DJBD	
Cc1ccnc(S[C@H](C)c2ccc(Cl)cc2)c1[N+](=O)[O-]	522416645	MBCMDFSRNXCEEC-SNVBAGLBSA-N	308.790	4.805	5	20	DJBD	
C[C@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(Cl)c(F)c1	539296196	YRMPRQPIAAVSBQ-QWRGUYRKSA-N	322.767	4.799	5	20	DJBD	
C[C@@H](NCc1ccccc1[N+](=O)[O-])c1ccc(F)c2ccccc12	551063071	ITCSWOKMOPCMEN-CYBMUJFWSA-N	324.355	4.738	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)cc1CSC1=Nc2ccccc2C1	746388673	FXYONTOSFPRGMF-UHFFFAOYSA-N	318.785	4.768	5	20	DJBD	
CCC[C@H](C)c1noc([C@H](C)Sc2ccc([N+](=O)[O-])cc2)n1	761842163	ITAIYJRIVVAGSK-QWRGUYRKSA-N	321.402	4.735	5	20	DJBD	
C[C@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1	20526139	KSKWSUFMOWZJFS-RYUDHWBXSA-N	304.777	4.660	5	20	DJBD	
O=[N+]([O-])c1cccc(CSc2nc3cc(Cl)ccc3o2)c1	69607269	RWZRRQOUMRGMLD-UHFFFAOYSA-N	320.757	4.682	5	20	DJBD	
C[C@H](Sc1ccc([N+](=O)[O-])cc1F)c1ncc(C(C)(C)C)o1	185150761	WQRDMRCWQOHLHP-VIFPVBQESA-N	324.377	4.873	5	20	DJBD	
O=[N+]([O-])c1ccccc1Oc1ccc(Oc2ccccc2)nc1	428659218	GQZXNIDDNNNLEG-UHFFFAOYSA-N	308.293	4.574	5	20	DJBD	
O=[N+]([O-])c1c(Oc2ccc(F)cc2Cl)ccc2ncccc12	485846852	QDYXOFQQWVMSNA-UHFFFAOYSA-N	318.691	4.728	5	20	DJBD	
Cc1ccccc1[C@H](N[C@H](C)c1ccccc1[N+](=O)[O-])C1CC1	537290849	LTXRNXVKFFJKSW-AUUYWEPGSA-N	310.397	4.705	5	20	DJBD	
CC[C@H](Nc1ccc([N+](=O)[O-])cc1F)c1cc(F)ccc1F	303782652	DCMNAFMALRUPOA-AWEZNQCLSA-N	310.275	4.575	5	20	DJBD	
C[C@@H](Nc1ccc(CC(F)(F)F)cc1)c1cccc([N+](=O)[O-])c1	173441490	MTDTYRVUQWMBTN-LLVKDONJSA-N	324.302	4.873	5	20	DJBD	
C[C@H](N[C@@H](C)c1ccc(Cl)c(F)c1)c1ccc([N+](=O)[O-])cc1	569559555	SDIDRQLAALRRSP-QWRGUYRKSA-N	322.767	4.799	5	20	DJBD	
O=C(N[C@H]1CCCSC1)c1c2ccccc2cc2ccccc12	748806546	OIIXFINELDLNSG-INIZCTEOSA-N	321.445	4.618	5	20	DJBD	
Cc1ccc(/C=C(/Cl)c2nc3cc([N+](=O)[O-])ccc3o2)cc1	751518700	YPPWNGPZNMOHEI-MDWZMJQESA-N	314.728	4.781	5	20	DJBD	
CC[C@H](Nc1cccc(OC(F)F)c1)c1cccc([N+](=O)[O-])c1	319761479	DNBUCSFGBGXIDA-HNNXBMFYSA-N	322.311	4.759	5	20	DJBD	
CCOC1CC(CS[C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1	507132790	PDVUAUPYQCBDKB-OPFPJEHXSA-N	309.431	4.513	5	20	DJBD	
Cc1ccccc1[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)C1CC1	532510983	BFVFHSIOPRKZKE-LIRRHRJNSA-N	310.397	4.705	5	20	DJBD	
CCCC[C@H](CCC)CNc1cc(C)c([N+](=O)[O-])cc1C(=O)O	1776771961	GGUDBVBCFSXONW-ZDUSSCGKSA-N	322.405	4.620	5	20	DJBD	
O=[N+]([O-])c1ccc(-c2csc(-c3ccc(F)cc3)n2)cc1	7845420	CWHRIBUWSLJUAS-UHFFFAOYSA-N	300.314	4.524	5	20	DJBD	
CSc1ccc([C@H](C)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1	315640780	ZCITXCLBZQUDJC-STQMWFEESA-N	316.426	4.729	5	20	DJBD	
Cc1ccc(-c2ncc(/C=C/c3ccc([N+](=O)[O-])cn3)s2)cc1	439528405	QOBVNHWGFDZONM-VQHVLOKHSA-N	323.377	4.592	5	20	DJBD	
CCCCCC[C@@H](C)CC(=O)N(C)Cc1ccccc1[N+](=O)[O-]	727664108	NRANLGFLIWCKCF-OAHLLOKOSA-N	320.433	4.550	5	20	DJBD	
C[C@H]1C[C@H](NCc2c3ccccc3cc3ccccc23)CCO1	769710746	PFFZYFYUZQEAMG-MAUKXSAKSA-N	305.421	4.650	5	20	DJBD	
CSc1ccc(COc2ccc(Cl)cc2[N+](=O)[O-])cc1	60709677	BDOAOOOGHZRRCB-UHFFFAOYSA-N	309.774	4.549	5	20	DJBD	
CC(C)[C@@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1	390683024	VBIZNRKHOGCWBU-FZKQIMNGSA-N	316.376	4.782	5	20	DJBD	
CC[C@H](CN[C@H](C)c1cccc([N+](=O)[O-])c1C)CC(F)(F)F	414255564	FRMAZHIPBSRLAM-NEPJUHHUSA-N	318.339	4.532	5	20	DJBD	
Cc1cc(OCc2oc(C(C)C)nc2C)c(Cl)cc1[N+](=O)[O-]	450957043	GOAUIYLZHKUDDG-UHFFFAOYSA-N	324.764	4.555	5	20	DJBD	
Cc1cc([C@H](C)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cs1	453143235	DOPJURWKWNSSLB-OLZOCXBDSA-N	304.415	4.685	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)SC[C@@H](C)C(F)(F)F	486168185	DPZVRXYPGGLCHT-ZJUUUORDSA-N	307.337	4.896	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2c(F)c(F)cc(F)c2F)c(Cl)c1	603472541	GNJCQPFLMBRBRV-UHFFFAOYSA-N	321.613	4.597	5	20	DJBD	
C[C@@H](N[C@H](C)c1ccc(F)cc1Cl)c1ccc([N+](=O)[O-])cc1	178657488	RIGPGWDXFXCIIS-GHMZBOCLSA-N	322.767	4.799	5	20	DJBD	
C[C@@H](N[C@H](C)c1ccc(Cl)c(F)c1)c1cccc([N+](=O)[O-])c1	317211140	GIZVWQQJTUTHQZ-GHMZBOCLSA-N	322.767	4.799	5	20	DJBD	
Cc1ccc([C@H](C)NCc2c(Cl)cccc2[N+](=O)[O-])cc1C	494814199	ZIBNZVNMJVLACD-ZDUSSCGKSA-N	318.804	4.716	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)c(CN2CCC[C@@H]2c2ccsc2)c1	735491303	HWXBSIQGXVPQRT-OAHLLOKOSA-N	322.817	4.647	5	20	DJBD	
Cc1nc2cc(N[C@@H](C)c3ccccc3[N+](=O)[O-])ccc2s1	781103556	TXRIIKQZKMPJSE-JTQLQIEISA-N	313.382	4.686	5	20	DJBD	
CC(C)c1ccc(NC(=O)CCC(C)(C)[N+](=O)[O-])c(C(C)C)c1	822482901	LDCGAZIJXPRLOA-UHFFFAOYSA-N	320.433	4.707	5	20	DJBD	
C[C@@H](N[C@H](C)c1c(F)cccc1Cl)c1ccccc1[N+](=O)[O-]	531443635	GGPZYFKMKOPHNV-GHMZBOCLSA-N	322.767	4.799	5	20	DJBD	
CSc1cccc(N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1C	537478002	RBODDRZWZNYBFO-LBPRGKRZSA-N	302.399	4.798	5	20	DJBD	
Cc1nc(SCc2cc(Cl)ccc2[N+](=O)[O-])sc1C	746390023	NIOYQZZETZGAAA-UHFFFAOYSA-N	314.819	4.614	5	20	DJBD	
C[C@H](Nc1ccc(Br)cc1)c1ccc([N+](=O)[O-])cc1	37176941	PHOWQDHCSJGUBF-JTQLQIEISA-N	321.174	4.530	5	20	DJBD	
Cc1cc([C@@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2C)c(C)s1	122852531	MMVRYYSCLNTNHN-CHWSQXEVSA-N	318.442	4.993	5	20	DJBD	
CC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(C)c1	471542819	PBABZFSZVODMLC-UHFFFAOYSA-N	305.717	4.552	5	20	DJBD	
Cc1c([C@@H](C)N[C@H](c2ccccc2)C(C)C)cccc1[N+](=O)[O-]	480162295	KZXMTLQPEYUURN-BEFAXECRSA-N	312.413	4.951	5	20	DJBD	
CCC(C)(C)c1ccc(Oc2ncc([N+](=O)[O-])cn2)c(Cl)c1	546175001	ZTHHUYYODWYMLP-UHFFFAOYSA-N	321.764	4.518	5	20	DJBD	
CSc1ccc(Oc2nc3ccc([N+](=O)[O-])cc3s2)cc1	731206010	VEYPEMFAMVWQDH-UHFFFAOYSA-N	318.379	4.719	5	20	DJBD	
C[C@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1Cl	20526157	WYMAVFOHSVNVMD-RYUDHWBXSA-N	304.777	4.660	5	20	DJBD	
C[C@H](N[C@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1Cl	20526159	WYMAVFOHSVNVMD-NWDGAFQWSA-N	304.777	4.660	5	20	DJBD	
O=[N+]([O-])c1ccccc1NC(c1cccs1)c1cccs1	37298541	UQOKJLIFDAXIHV-UHFFFAOYSA-N	316.407	4.919	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(OCc2cccc(C(F)(F)F)c2)c1	58458849	NPBCDNDMTDCPBY-UHFFFAOYSA-N	311.259	4.501	5	20	DJBD	
Cc1c([C@@H](C)N[C@H]2CCCc3sccc32)cccc1[N+](=O)[O-]	134966795	VNGPUUBHLOPDJQ-DOMZBBRYSA-N	316.426	4.693	5	20	DJBD	
CC[C@@H](N[C@@H]1CCCc2ccccc21)c1cccc([N+](=O)[O-])c1	195548119	LQSYDPJUAOTBRC-RTBURBONSA-N	310.397	4.713	5	20	DJBD	
CCCc1nccn1Cc1nc2ccccc2c2ccccc12	534499367	QWHIJDAXALGZPC-UHFFFAOYSA-N	301.393	4.585	5	20	DJBD	
CC[C@H](NCc1ccc([N+](=O)[O-])c(F)c1)c1cccc(Cl)c1	801529094	ZOQXFILGAPWESB-HNNXBMFYSA-N	322.767	4.628	5	20	DJBD	
C[C@@H](Nc1ccc([N+](=O)[O-])cc1F)c1cccc(C2CC2)c1	864019102	NTENLGCRFCYBEE-LLVKDONJSA-N	300.333	4.784	5	20	DJBD	
O=[N+]([O-])c1ccccc1N[C@H]1CCSc2ccc(Cl)cc21	35046778	UJZXNNGWLHVWAL-LBPRGKRZSA-N	320.801	4.897	5	20	DJBD	
O=C(Nc1ccccc1-c1cccs1)c1ccc([N+](=O)[O-])cc1	198180901	VFCZSXSIBSHTCW-UHFFFAOYSA-N	324.361	4.576	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)c1ccccc1Cl	489965732	NJDZENKIXOEGSK-STQMWFEESA-N	318.804	4.968	5	20	DJBD	
C[C@@H](Sc1cccc([N+](=O)[O-])c1)c1ncc(C(C)(C)C)o1	509670327	YYEMIGVIZDVGFW-SNVBAGLBSA-N	306.387	4.734	5	20	DJBD	
Cc1nc(Sc2c(Cl)cc(Cl)cc2[N+](=O)[O-])oc1C	552909715	NNDKAOLWFYRFBK-UHFFFAOYSA-N	319.169	4.658	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)Nc1ccccc1OC(F)F	554354761	IGPJOLQMXUSTAR-LLVKDONJSA-N	322.311	4.678	5	20	DJBD	
C[C@H](SCc1ccccc1[N+](=O)[O-])c1c(F)cccc1F	604434581	IIILSALDITVNSJ-JTQLQIEISA-N	309.337	4.867	5	20	DJBD	
C[C@@H](Nc1ccc(OCC2CC2)cc1)c1ccccc1[N+](=O)[O-]	743476390	ASSOMPQLHQSXFW-CYBMUJFWSA-N	312.369	4.557	5	20	DJBD	
O=[N+]([O-])c1cc(CN2CCC[C@H]2c2ccsc2)ccc1Cl	768541491	HWCIGESQTGTQQE-AWEZNQCLSA-N	322.817	4.647	5	20	DJBD	
CC(C)[C@H](NCc1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1	393370759	LZRTWUIDSUODQA-KRWDZBQOSA-N	318.804	4.735	5	20	DJBD	
CC(C)[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])c2ccccc21	447572255	AWSZJRFDELBLHN-QZTJIDSGSA-N	310.397	4.569	5	20	DJBD	
C[C@@H](Sc1ncccc1[N+](=O)[O-])c1cccc(Cl)c1F	478910494	KWYKXDNBNIMPBR-MRVPVSSYSA-N	312.753	4.636	5	20	DJBD	
Cc1ccc2c(c1)[C@H](N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)CC2	540221211	VAQFWAFWVRKFIP-KBXCAEBGSA-N	310.397	4.550	5	20	DJBD	
CCC(C)(C)C(=O)OCc1nc2ccccc2c2ccccc12	726832226	UQQCIOABBRHHQZ-UHFFFAOYSA-N	307.393	4.867	5	20	DJBD	
CC[C@@H](Nc1cc(C)c([N+](=O)[O-])cc1F)c1ccccc1OC	864001925	UZVZKQOOPUYLNU-CQSZACIVSA-N	318.348	4.614	5	20	DJBD	
O=[N+]([O-])c1cnc(Oc2cc(C(F)(F)F)ccc2Cl)s1	195506095	QSZHBLLSKUAYOB-UHFFFAOYSA-N	324.667	4.516	5	20	DJBD	
CCCOc1ccccc1NCc1ccc([N+](=O)[O-])cc1Cl	600848632	FYYVJHKBVRVPFR-UHFFFAOYSA-N	320.776	4.649	5	20	DJBD	
O=[N+]([O-])c1ccccc1/C=C/C=C/c1ccc2cccc(O)c2n1	508598726	NTGKXBFSSQKSGJ-UGLGFUFDSA-N	318.332	4.575	5	20	DJBD	
CC(C)Oc1ccc(Nc2ccc([N+](=O)[O-])c3cnccc23)cc1	515480424	NRMTZCAUQCDHOR-UHFFFAOYSA-N	323.352	4.674	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1ccc2ccccc2c1	539047917	XCEAUUTVQKKOIG-HNNXBMFYSA-N	320.392	4.907	5	20	DJBD	
COc1ccc(CSc2ccc(C)c(C)c2)cc1[N+](=O)[O-]	603722736	WWWODBMUOYHEDW-UHFFFAOYSA-N	303.383	4.513	5	20	DJBD	
Cc1cccc([C@H]2CCCN2Cc2ccccc2[N+](=O)[O-])c1C	610215044	BKOOSEQYWMWSPM-LJQANCHMSA-N	310.397	4.549	5	20	DJBD	
COc1cc(N[C@@H](C)c2cccc3ccccc23)ccc1[N+](=O)[O-]	462923279	AENONEKKYHKEJR-ZDUSSCGKSA-N	322.364	4.930	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1CN1CCC[C@H]1c1ccccc1	609705297	RVBSADQWDXVMRD-INIZCTEOSA-N	316.788	4.585	5	20	DJBD	
O=[N+]([O-])c1cc(C(F)(F)F)ccc1Oc1ccc(F)cc1	90513	DUWDCTXDXKGPQI-UHFFFAOYSA-N	301.195	4.545	5	20	DJBD	
O=[N+]([O-])c1cccc(CSc2nc(-c3ccccc3)co2)c1	436247528	UTSZWXVVANXFFS-UHFFFAOYSA-N	312.350	4.542	5	20	DJBD	
CCOc1ccccc1NCc1ccc(C(C)C)c([N+](=O)[O-])c1	522282923	ATKPIBUPTMYQPH-UHFFFAOYSA-N	314.385	4.729	5	20	DJBD	
C[C@@H](NCc1ccc2sccc2c1)c1ccc([N+](=O)[O-])cc1	577564343	AZJCMZURLZRKFB-GFCCVEGCSA-N	312.394	4.660	5	20	DJBD	
Cc1cc(N[C@H](C)c2ncc(-c3ccccc3)o2)ccc1[N+](=O)[O-]	92656527	HKCIUFOGHHHPBI-CYBMUJFWSA-N	323.352	4.731	5	20	DJBD	
CCC[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccsc1	191222998	UONQJQPETJYWEN-LRDDRELGSA-N	304.415	4.848	5	20	DJBD	
C[C@H](N[C@@H](c1ccccc1)C1CCC1)c1cccc([N+](=O)[O-])c1	531960964	JYSBCQMFMQLZFB-LIRRHRJNSA-N	310.397	4.787	5	20	DJBD	
CCOc1cc(S[C@H](C)c2cccs2)ccc1[N+](=O)[O-]	771218258	GJSCVKPWHIOPBG-SNVBAGLBSA-N	309.412	4.908	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)cc1CNc1ccc(C2CC2)cc1	771871683	HHQMNBCSTSKQIL-UHFFFAOYSA-N	302.761	4.738	5	20	DJBD	
CC[C@H](NCc1cc([N+](=O)[O-])ccc1Cl)c1cccc(F)c1	783252514	AIDQXPZNPXNPOP-INIZCTEOSA-N	322.767	4.628	5	20	DJBD	
CN(C(=O)c1c2ccccc2cc2ccccc12)c1nccs1	173300363	YJQZUKGLRSCBKH-UHFFFAOYSA-N	318.401	4.726	5	20	DJBD	
CC(=O)c1ccc(N[C@@H](C)c2cccc(C)c2C)c([N+](=O)[O-])c1	303732462	VFYMMANYGFMDEJ-ZDUSSCGKSA-N	312.369	4.587	5	20	DJBD	
Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)[C@@H](C)CC1CCCC1	736159750	ZTLDCGCQHBDKSW-NSHDSACASA-N	324.808	4.712	5	20	DJBD	
CC1(C)C[C@H](NC2(c3ccccc3)CC2)c2cc([N+](=O)[O-])ccc21	433244877	ZAGZGWWRJTUWIT-SFHVURJKSA-N	322.408	4.596	5	20	DJBD	
C[C@H](SCc1nc(C2CC2)cs1)c1ccccc1[N+](=O)[O-]	541290813	NGRPPDXPAKZEMC-JTQLQIEISA-N	320.439	4.923	5	20	DJBD	
C[C@@H](SCc1ccc([N+](=O)[O-])cc1)c1cc(F)ccc1F	609237595	GTPQGWJAKXOHPD-SNVBAGLBSA-N	309.337	4.867	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[C@H]1c1cccc(F)c1	611516409	SYWPLXHGVBLCFM-ACJLOTCBSA-N	314.360	4.550	5	20	DJBD	
CCOc1cc(NCc2ccc(Cl)cc2[N+](=O)[O-])ccc1C	864027462	FKPCSZDNAXDRBB-UHFFFAOYSA-N	320.776	4.567	5	20	DJBD	
O[C@H]1CCC[C@@H](CNCc2c3ccccc3cc3ccccc23)C1	238014965	DJGNRTVGEZJIMX-APWZRJJASA-N	319.448	4.634	5	20	DJBD	
O=[N+]([O-])c1ccc(CNc2ccccc2Oc2ccccc2)cc1	323871110	RNEWRIMPGTWLAG-UHFFFAOYSA-N	320.348	4.999	5	20	DJBD	
CC(=O)c1cc(N[C@@H](C)c2cc(C)cc(C)c2)ccc1[N+](=O)[O-]	553407921	FIHQOUZWVDZUPP-ZDUSSCGKSA-N	312.369	4.587	5	20	DJBD	
CC[C@](C)(NCc1cc(Cl)ccc1[N+](=O)[O-])c1ccccc1	775390194	JRYQFTQOUJIXIX-KRWDZBQOSA-N	318.804	4.663	5	20	DJBD	
O=[N+]([O-])c1cc(-c2nc3cc(Cl)c(Cl)cc3[nH]2)cs1	513863253	FYXLJDIDMRYIGK-UHFFFAOYSA-N	314.153	4.506	5	20	DJBD	
C[C@@H](SCc1ccc2c(c1)COC2)c1ccccc1[N+](=O)[O-]	778055845	ZTFQBOVEVKXBMC-GFCCVEGCSA-N	315.394	4.619	5	20	DJBD	
Cc1ccc(CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])s1	37365416	HCPUZWRLBGRQFY-UHFFFAOYSA-N	316.304	4.596	5	20	DJBD	
Cc1ccc(OCc2cccc(C(F)(F)F)c2)c([N+](=O)[O-])c1	71798048	VZCHURLGBZYXKK-UHFFFAOYSA-N	311.259	4.501	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H](C)c2cc(F)ccc2F)cc1[N+](=O)[O-]	78968593	LORSCBFNXIDBTM-RYUDHWBXSA-N	320.339	4.593	5	20	DJBD	
CC[C@@H](NCc1ccccc1[N+](=O)[O-])c1cccc(Cl)c1F	461112835	XPZCHBQDQDZVAO-CQSZACIVSA-N	322.767	4.628	5	20	DJBD	
CC(C)Oc1ccc(NCc2ccc([N+](=O)[O-])c(Cl)c2)cc1	761514493	KONRSADRGUBWES-UHFFFAOYSA-N	320.776	4.648	5	20	DJBD	
CCn1ccnc1SCc1nc2ccccc2c2ccccc12	821686084	IOENVVGIUBHOLU-UHFFFAOYSA-N	319.433	4.897	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)c(CSCc2cc(C3CC3)no2)c1	853786918	HPHZYYNECKNVDU-UHFFFAOYSA-N	324.789	4.547	5	20	DJBD	
Cc1cc(N[C@H](C)c2cccc3ccccc23)ncc1[N+](=O)[O-]	301428243	MTWCKZSOGOYRDD-CYBMUJFWSA-N	307.353	4.625	5	20	DJBD	
C[C@H](NCc1ccc(C(C)(C)C)cc1)c1cccc([N+](=O)[O-])c1	321946716	GFSFVVGDKXWYQA-AWEZNQCLSA-N	312.413	4.743	5	20	DJBD	
CCC[C@H](NCc1cccc([N+](=O)[O-])c1C)c1ccsc1	478499519	KROOKXDUHFOGEO-HNNXBMFYSA-N	304.415	4.596	5	20	DJBD	
CCOCc1ccc(N[C@H](C)c2cccc([N+](=O)[O-])c2C)cc1	537451289	XBIAHTLLSPQQBY-CQSZACIVSA-N	314.385	4.613	5	20	DJBD	
Cc1c([C@@H](C)Nc2ccsc2[N+](=O)[O-])oc2ccccc12	604433504	QHCZRPWBVWIBLP-SNVBAGLBSA-N	302.355	4.884	5	20	DJBD	
Cc1ccc2c(c1)[C@@H](Nc1ccc3cc([N+](=O)[O-])ccc3n1)CC2	609288473	ZDLHIUYSNJIJCZ-SFHVURJKSA-N	319.364	4.551	5	20	DJBD	
CC[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F	160789719	RWDXQCCZRYWLAA-APPDUMDISA-N	320.339	4.675	5	20	DJBD	
Cc1ccc(CNC(C)(C)c2ccccc2[N+](=O)[O-])cc1Cl	492310544	HCJQYOGLGMPFPI-UHFFFAOYSA-N	318.804	4.582	5	20	DJBD	
CSc1ccc(C)c(NCc2c(F)cc([N+](=O)[O-])cc2F)c1	506248937	ZGDIILLXPJAOHR-UHFFFAOYSA-N	324.352	4.515	5	20	DJBD	
CC(C)[C@@H](NCc1ccccc1[N+](=O)[O-])c1ccccc1Cl	538116487	KREKQQXCBVDMTD-QGZVFWFLSA-N	318.804	4.735	5	20	DJBD	
CC(C)[C@H](CC1CCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1F	609693664	BTLYLCJQEFBDRZ-AWEZNQCLSA-N	322.380	4.525	5	20	DJBD	
CSCCCN(C)C(=O)c1c2ccccc2cc2ccccc12	798739955	GKBGLNQVBSFCOY-UHFFFAOYSA-N	323.461	4.818	5	20	DJBD	
Cc1c(CN[C@@H](C)c2cccc3ccccc23)cccc1[N+](=O)[O-]	326367360	INNYXFSZEGNJBW-HNNXBMFYSA-N	320.392	4.907	5	20	DJBD	
CC[C@@H](N[C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(F)cc1F	540339599	PISBYKZQECHDER-BDJLRTHQSA-N	320.339	4.675	5	20	DJBD	
COc1ccccc1SCc1ccc([N+](=O)[O-])cc1Cl	543861143	DDTHGPWWHTVCOV-UHFFFAOYSA-N	309.774	4.549	5	20	DJBD	
O=[N+]([O-])c1c(F)cccc1N[C@H]1CCSc2c(F)cccc21	301078076	HHERENNRNPIJFS-LBPRGKRZSA-N	322.336	4.522	5	20	DJBD	
Cc1ccc(N[C@H](C)c2ncc(-c3ccccc3)o2)c([N+](=O)[O-])c1	301806304	FETVJHFEVRVBAO-CYBMUJFWSA-N	323.352	4.731	5	20	DJBD	
CCC(CC)c1cc(CNc2ccc([N+](=O)[O-])cc2Cl)on1	462897851	SULKLSTZYSEFRM-UHFFFAOYSA-N	323.780	4.752	5	20	DJBD	
CC[C@@H](NCc1cc([N+](=O)[O-])ccc1Cl)c1ccccc1F	779128134	NPYQKJJEYIAKGL-MRXNPFEDSA-N	322.767	4.628	5	20	DJBD	
Cc1ccc(CNc2ccc([N+](=O)[O-])cc2C(F)(F)F)s1	48805705	LLOJZPRSDTZMJO-UHFFFAOYSA-N	316.304	4.596	5	20	DJBD	
Cc1ccc([C@@H](C)NCc2ccc(F)cc2Cl)cc1[N+](=O)[O-]	136290775	BXYJMRFMQNDVES-LLVKDONJSA-N	322.767	4.547	5	20	DJBD	
Cc1ccsc1/C=C\c1nc2cc([N+](=O)[O-])ccc2s1	211813023	OBSGJGRRIRGECV-PLNGDYQASA-N	302.380	4.745	5	20	DJBD	
C[C@@H](Nc1ncc([N+](=O)[O-])s1)c1cccc(Cl)c1Cl	443519068	NCVJIOSDIBSZLR-ZCFIWIBFSA-N	318.185	4.531	5	20	DJBD	
O=[N+]([O-])c1cc(-c2nnc(-c3cccc4ccccc34)o2)cs1	1345889483	LAELFOOZORDEMG-UHFFFAOYSA-N	323.333	4.527	5	20	DJBD	
O=[N+]([O-])c1cccc(F)c1CSc1nc2ccccc2s1	78411938	RVYOLIXBHPDNCR-UHFFFAOYSA-N	320.370	4.636	5	20	DJBD	
C[C@@H](Nc1ccc([N+](=O)[O-])cc1)c1ccc(C(F)(F)F)cc1	220300469	DWZNZUZRNUOLFN-SNVBAGLBSA-N	310.275	4.787	5	20	DJBD	
CCN(Cc1c[nH]c2ccccc12)[C@H](C)c1cccc([N+](=O)[O-])c1	442882708	SBXYLNXGRKUUDJ-CQSZACIVSA-N	323.396	4.659	5	20	DJBD	
C[C@H](N[C@@H](C)c1c(F)cccc1Cl)c1ccccc1[N+](=O)[O-]	531443637	GGPZYFKMKOPHNV-QWRGUYRKSA-N	322.767	4.799	5	20	DJBD	
CCc1cccc(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1	600849964	JRWWZACLDOYYEO-UHFFFAOYSA-N	324.302	4.788	5	20	DJBD	
Cc1cc(C)cc([C@@H](C)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1	531719735	IDYMKYKRUSMIGM-JKSUJKDBSA-N	312.413	4.932	5	20	DJBD	
CSc1cccc(N[C@H](C)c2ccccc2[N+](=O)[O-])c1C	538097536	NKIBNRBLFUDWNH-GFCCVEGCSA-N	302.399	4.798	5	20	DJBD	
Cc1ccc2c(c1)[C@H](N[C@@H](C)c1cc([N+](=O)[O-])ccc1C)CC2	611335710	PUOYJTKKQSIQMK-IFXJQAMLSA-N	310.397	4.550	5	20	DJBD	
Cc1ccc(CNc2ccccc2OC(C)(C)C)cc1[N+](=O)[O-]	864028445	QIASTQDVMGVVPR-UHFFFAOYSA-N	314.385	4.693	5	20	DJBD	
C[C@H](N[C@H]1CCc2c(Cl)cccc21)c1cccc([N+](=O)[O-])c1	173361797	FBVFGPRKBKWHKZ-GTNSWQLSSA-N	316.788	4.586	5	20	DJBD	
O=[N+]([O-])c1ccc(-c2noc(-c3cccc4ccsc34)n2)cc1	554788721	JWPVGHCKGIESJP-UHFFFAOYSA-N	323.333	4.527	5	20	DJBD	
CSc1ccc([C@H](C)Nc2cccc(F)c2[N+](=O)[O-])cc1	798406385	DVGWRBKELCXZBG-JTQLQIEISA-N	306.362	4.629	5	20	DJBD	
O=[N+]([O-])c1cccc(-c2nc(-c3ccc(F)cc3)cs2)c1	71971786	QYUNNJJZADMEBS-UHFFFAOYSA-N	300.314	4.524	5	20	DJBD	
CC[C@H](N[C@@H](c1ccccc1)C1CC1)c1cccc([N+](=O)[O-])c1	195614324	WNTYHWOGRVJMSH-OALUTQOASA-N	310.397	4.787	5	20	DJBD	
CCN(Cc1ccccc1[N+](=O)[O-])[C@@H](C)c1cc2ccccc2o1	518578098	QEGYEUXNSMAPRV-AWEZNQCLSA-N	324.380	4.924	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC(C)(C)c1cccs1	543501134	FMADCFLAKHEEKU-LBPRGKRZSA-N	304.415	4.551	5	20	DJBD	
CC(C)Oc1cccc([C@@H](C)Nc2ccccc2[N+](=O)[O-])c1	603859944	MELTXQVJNGZZQN-CYBMUJFWSA-N	300.358	4.555	5	20	DJBD	
O=[N+]([O-])c1ccc(CSC2=Nc3ccccc3CS2)cc1	16047268	TWXMHOBHFOXABJ-UHFFFAOYSA-N	316.407	4.763	5	20	DJBD	
Cc1ccc([C@@H](C)NCc2ccc(C(F)F)cc2)cc1[N+](=O)[O-]	183992513	LCQNTYOLCORTJR-GFCCVEGCSA-N	320.339	4.692	5	20	DJBD	
O=[N+]([O-])c1cccc(CNc2ccc(Oc3ccccc3)cc2)c1	391743163	SXZYAPHWYHJVBC-UHFFFAOYSA-N	320.348	4.999	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(OCc2ccc(C(F)(F)F)cc2)c1	71815320	JTNLXIQOEQPDEC-UHFFFAOYSA-N	311.259	4.501	5	20	DJBD	
O=[N+]([O-])c1cccc(-c2nc(-c3ccc(F)cc3F)cs2)c1	302988462	RJVYZQLVSHSVMC-UHFFFAOYSA-N	318.304	4.664	5	20	DJBD	
Cc1ccc2oc(CN[C@@H](C)c3cccc([N+](=O)[O-])c3)cc2c1	553277675	TUZKFCNDDBZMIE-ZDUSSCGKSA-N	310.353	4.500	5	20	DJBD	
CCC[C@@H](C)c1noc([C@@H](C)Sc2ccc([N+](=O)[O-])cc2)n1	761842159	ITAIYJRIVVAGSK-GHMZBOCLSA-N	321.402	4.735	5	20	DJBD	
O=[N+]([O-])c1ccc(/C=C\c2cnc(C3CCCCC3)s2)nc1	531249132	POFVITKYSQPONL-CLFYSBASSA-N	315.398	4.664	5	20	DJBD	
CC(=O)c1ccc(N[C@H]2CCC[C@H]2c2ccccc2)c([N+](=O)[O-])c1	609514012	POUVAIUQHARPEY-IRXDYDNUSA-N	324.380	4.546	5	20	DJBD	
CCCC(C)(C)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1	609544498	RCCGEZADSXLEPV-UHFFFAOYSA-N	302.374	4.523	5	20	DJBD	
Oc1nc(-c2cccc(Cl)c2)nc2cc3ccccc3cc12	614115804	FOYZZXPKTXHICT-UHFFFAOYSA-N	306.752	4.809	5	20	DJBD	
CSc1ccc(NCc2ccc(Cl)cc2[N+](=O)[O-])cc1	50443086	JNTOBSRPJZBWND-UHFFFAOYSA-N	308.790	4.582	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)c1ccc(F)cc1F	153560402	VEOCAUKIEWFMQJ-RYUDHWBXSA-N	320.339	4.593	5	20	DJBD	
Cc1c(CN[C@H](C)c2ccc(F)c(Cl)c2)cccc1[N+](=O)[O-]	180735297	ZTUPMCLMUKJJSH-LLVKDONJSA-N	322.767	4.547	5	20	DJBD	
CC(C)[C@@H](Nc1ccc([N+](=O)[O-])c2cnccc12)c1ccccc1	248216776	GPSZFUYEHDGGKZ-LJQANCHMSA-N	321.380	4.952	5	20	DJBD	
C[C@@H](N[C@H](c1ccccc1)C1CCC1)c1ccc([N+](=O)[O-])cc1	482448959	GXYLFTAHJIBTRK-AUUYWEPGSA-N	310.397	4.787	5	20	DJBD	
C[C@@H](SCCOc1ccccc1[N+](=O)[O-])c1ccccc1F	507879946	MODGWXRACNNIKE-GFCCVEGCSA-N	321.373	4.607	5	20	DJBD	
Cc1c([C@@H](C)N[C@H]2CCCc3ccccc32)cccc1[N+](=O)[O-]	531677926	XYJCASMELPHVIK-KDOFPFPSSA-N	310.397	4.631	5	20	DJBD	
CC(C)Sc1ccc([C@@H](C)Nc2ncccc2[N+](=O)[O-])cc1	301208111	SORKKMVYQQRWFU-GFCCVEGCSA-N	317.414	4.663	5	20	DJBD	
Cc1nc(N[C@@H](C)c2cc3ccccc3s2)ccc1[N+](=O)[O-]	301651361	JXSYHVCYYOPXEO-NSHDSACASA-N	313.382	4.686	5	20	DJBD	
CCC[C@@H](Nc1ccc(F)c(OC)c1)c1cccc([N+](=O)[O-])c1	323626236	DORFDOOYHQRMFY-MRXNPFEDSA-N	318.348	4.696	5	20	DJBD	
COc1ccccc1[C@H](C)SCc1cccc([N+](=O)[O-])c1C	463209671	KYPSFHYBOLDOGI-ZDUSSCGKSA-N	317.410	4.906	5	20	DJBD	
C[C@H](O)CC(C)(C)CNCc1c2ccccc2cc2ccccc12	742373060	NBSNMPOQYWUMDZ-INIZCTEOSA-N	321.464	4.880	5	20	DJBD	
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H](C)c1ccsc1	872068963	KGQGUBLNFVCPKB-GHMZBOCLSA-N	322.455	4.790	5	20	DJBD	
COc1ccc(F)cc1[C@H](C)Nc1ccc([N+](=O)[O-])cc1Cl	603866880	NFCSPILTRNCBGJ-VIFPVBQESA-N	324.739	4.569	5	20	DJBD	
O=[N+]([O-])c1ccc(CSCCC(Cl)(Cl)Cl)cc1	767131881	OLXLJJVUOBJSGH-UHFFFAOYSA-N	314.621	4.588	5	20	DJBD	
CCOc1ccc(SCc2cccc([N+](=O)[O-])c2C)cc1	915794696	QZECWVNPZIDFGB-UHFFFAOYSA-N	303.383	4.594	5	20	DJBD	
C[C@H](Nc1ccc(Br)cc1)c1ccccc1[N+](=O)[O-]	20526048	SZTQACHBOIAUEY-JTQLQIEISA-N	321.174	4.530	5	20	DJBD	
COc1ccc(CSC/C=C\c2ccccc2)cc1[N+](=O)[O-]	552480729	CQXCAPBIYXFJLZ-YVMONPNESA-N	315.394	4.550	5	20	DJBD	
CO[C@H](CSCc1cccc([N+](=O)[O-])c1C)c1ccccc1	573110146	VGSHOVGYQOJSCD-QGZVFWFLSA-N	317.410	4.524	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)cc(Cl)c1Oc1cncc(Cl)c1	575011588	CDOZQSYZBBLSJM-UHFFFAOYSA-N	319.531	4.742	5	20	DJBD	
CC[C@H](NCc1ccc([N+](=O)[O-])c(F)c1)c1ccc(Cl)cc1	801527521	MITPCLBVZXPBDK-HNNXBMFYSA-N	322.767	4.628	5	20	DJBD	
Cc1cc(Cl)c(C(C)C)cc1Oc1c([N+](=O)[O-])c(C)nn1C	78727432	QRPWIFKKONSZFT-UHFFFAOYSA-N	323.780	4.514	5	20	DJBD	
Cc1csc(CNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)c1	379275660	OJMZMKCJBPAKED-UHFFFAOYSA-N	316.304	4.596	5	20	DJBD	
CC[C@@H](C)n1ncc(N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1C	477915179	IGYVJJDOCAJKOE-OLZOCXBDSA-N	316.405	4.552	5	20	DJBD	
C[C@H](NCc1ccc2ccccc2c1)c1ccc([N+](=O)[O-])cc1	157323553	NAQMHMZZCCFTCB-AWEZNQCLSA-N	306.365	4.599	5	20	DJBD	
CC[C@H]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)C1	478292947	YBHBNCSXQVACNF-HNNXBMFYSA-N	318.420	4.650	5	20	DJBD	
C[C@H](c1ccccc1[N+](=O)[O-])N1CCC(c2ccsc2)CC1	486009979	VWJZIZBDNQOUQF-CYBMUJFWSA-N	316.426	4.597	5	20	DJBD	
CC[C@@H](C)CSCc1coc(-c2ccc([N+](=O)[O-])cc2)n1	534794281	QTEKZOGFKMXJKU-LLVKDONJSA-N	306.387	4.529	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1CNc1cccc(F)c1Cl	690270538	AOXDMJKAGYFGTK-UHFFFAOYSA-N	315.131	4.653	5	20	DJBD	
Cc1ccc(CN[C@@H](C)c2c(F)cccc2Cl)cc1[N+](=O)[O-]	748098786	NZUKWWMDZWNIBO-NSHDSACASA-N	322.767	4.547	5	20	DJBD	
CCC(CC)(CC)SCC(=O)Nc1c(C)cccc1[N+](=O)[O-]	762972509	KJMCCCBPBFCXPW-UHFFFAOYSA-N	324.446	4.544	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H](C)c2ccccc2Cl)cc1[N+](=O)[O-]	219863394	CWOAXNDBXRCANB-STQMWFEESA-N	318.804	4.968	5	20	DJBD	
O=[N+]([O-])c1cnc(Oc2ccc(Cl)cc2Cl)c(Cl)c1	301258656	FFXVYLWBWWUAAJ-UHFFFAOYSA-N	319.531	4.742	5	20	DJBD	
CC(C)OCc1cccc(N[C@@H](C)c2ccccc2[N+](=O)[O-])c1	525761190	BONUIOTXJDOOOE-AWEZNQCLSA-N	314.385	4.693	5	20	DJBD	
C/C(=C/c1cccc([N+](=O)[O-])c1)CN(C)C1CCC(F)(F)CC1	563328650	NDZIXAVWKUQBKT-RAXLEYEMSA-N	324.371	4.508	5	20	DJBD	
Cc1c(CSc2cccc3cccnc23)cccc1[N+](=O)[O-]	603722426	MSPIUPANOVRTDC-UHFFFAOYSA-N	310.378	4.744	5	20	DJBD	
CCC[C@H](C)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1	608834818	MHEIEJAXXPRUQR-LBPRGKRZSA-N	304.415	4.602	5	20	DJBD	
Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)c1ccoc1C(C)C	796693832	ZUSGIYCLQRDLRP-UHFFFAOYSA-N	322.748	4.525	5	20	DJBD	
Cc1ccc([C@H](C)NCc2coc3ccccc23)cc1[N+](=O)[O-]	121669830	CYLIOUZARRZBPN-ZDUSSCGKSA-N	310.353	4.500	5	20	DJBD	
Cc1c([C@@H](C)N[C@H](C)c2ccc(F)cc2F)cccc1[N+](=O)[O-]	153560943	JZKOEJXREWULGI-VXGBXAGGSA-N	320.339	4.593	5	20	DJBD	
CC[C@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F	178657694	UILBMRCLWQUUCA-DIFFPNOSSA-N	320.339	4.675	5	20	DJBD	
CC[C@@H](N[C@H](C)CCCC(F)(F)F)c1cccc([N+](=O)[O-])c1	480179880	MAPFGYRCWROJLD-BXUZGUMPSA-N	318.339	4.757	5	20	DJBD	
Cc1ccc([C@H](C)Nc2ccccc2OC(F)F)cc1[N+](=O)[O-]	390330035	ZLWPWCJICDMPBY-NSHDSACASA-N	322.311	4.678	5	20	DJBD	
C[C@@H]1C[C@H](NCc2cc([N+](=O)[O-])ccc2Cl)c2ccccc21	808706313	HAOAOANLFSJUDR-DIFFPNOSSA-N	316.788	4.586	5	20	DJBD	
Cc1c([C@@H](C)N[C@H](c2ccccc2)C2CC2)cccc1[N+](=O)[O-]	178494420	SRDOMZRAJYDHLR-AUUYWEPGSA-N	310.397	4.705	5	20	DJBD	
Cc1csc(CNc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1	393319703	ZOYIOBMILYARBK-UHFFFAOYSA-N	316.304	4.596	5	20	DJBD	
O=[N+]([O-])c1cccc(SCc2coc(-c3cccs3)n2)c1	509667982	VTEDPMHKLFRBJT-UHFFFAOYSA-N	318.379	4.604	5	20	DJBD	
C/C=C\c1ccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1	557936736	PDDWMPNTMKDEHN-IHWYPQMZSA-N	316.744	4.534	5	20	DJBD	
CC(C)Oc1ccc([N+](=O)[O-])cc1CSc1cccs1	609750656	YRJBDGZFZIUWGY-UHFFFAOYSA-N	309.412	4.736	5	20	DJBD	
C[C@H](N[C@H](C)c1ccc2ccccc2n1)c1cccc([N+](=O)[O-])c1	178687166	HPICIUROOBKSTB-UONOGXRCSA-N	321.380	4.555	5	20	DJBD	
CC(C)OCc1ccc(N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1	180169348	SSMDASZINQKPGQ-CQSZACIVSA-N	314.385	4.693	5	20	DJBD	
CC(C)(C)c1ccccc1NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1	215491420	YDMCZNWKYVGFOA-RAXLEYEMSA-N	324.380	4.544	5	20	DJBD	
C[C@H](N[C@H](C)c1ccc(Cl)c(F)c1)c1cccc([N+](=O)[O-])c1	317211147	GIZVWQQJTUTHQZ-WDEREUQCSA-N	322.767	4.799	5	20	DJBD	
C[C@H]1CC[C@H](N(C)C(=O)c2cc3ccccc3c3cccnc23)C1	464477292	DHFMBVIVBXDAMR-HOCLYGCPSA-N	318.420	4.649	5	20	DJBD	
O=[N+]([O-])c1cccc(Cl)c1CN1CCC[C@@H]1c1ccsc1	494166338	YQNNXXKXPUVVQU-CQSZACIVSA-N	322.817	4.647	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)Nc1cccc(OC(F)F)c1	537398730	NCHIDRFVRVXZBW-NSHDSACASA-N	322.311	4.678	5	20	DJBD	
COc1cc(C)c(N[C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1F	775565194	FSSXJOPCMSIUMO-GFCCVEGCSA-N	318.348	4.532	5	20	DJBD	
CCc1ccc([C@H](C)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1	195613683	NRWBZGPLUYVICE-GJZGRUSLSA-N	312.413	4.877	5	20	DJBD	
O=[N+]([O-])c1cccc2ccc(/C=C\c3scnc3C3CC3)nc12	447352716	BDXGMOKBLNRGCM-HJWRWDBZSA-N	323.377	4.647	5	20	DJBD	
Cc1ccccc1[C@@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])C1CC1	537290853	LTXRNXVKFFJKSW-LIRRHRJNSA-N	310.397	4.705	5	20	DJBD	
CCC[C@@H](CCO)CNCc1c2ccccc2cc2ccccc12	742709687	NCFUMVZLYCNPBI-KRWDZBQOSA-N	321.464	4.881	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H]2CCCc3ccc([N+](=O)[O-])cc32)s1	774141538	VEORLVQEMIGYIR-LRDDRELGSA-N	316.426	4.693	5	20	DJBD	
COC(=O)c1c2[nH]c3ccccc3c2cc2[nH]c3ccccc3c12	95830398	VQALHCRBHYIUEC-UHFFFAOYSA-N	314.344	4.742	5	20	DJBD	
Cc1cc([C@@H](C)Nc2nc3ccc([N+](=O)[O-])cc3s2)c(C)o1	111190638	IGPQHCWSGIEVRN-SECBINFHSA-N	317.370	4.587	5	20	DJBD	
CCC(CC)c1noc([C@H](C)Sc2ccc([N+](=O)[O-])cc2)n1	547089014	GVQYFIANIUODDY-JTQLQIEISA-N	321.402	4.735	5	20	DJBD	
C[C@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])c1cccc(C2CC2)c1	551103587	LYWYVEOVJALHTL-KBPBESRZSA-N	310.397	4.884	5	20	DJBD	
Cc1oc2ccccc2c1CNC(C)(C)c1ccccc1[N+](=O)[O-]	430127128	WHECJGWKAOEDES-UHFFFAOYSA-N	324.380	4.674	5	20	DJBD	
Cc1ccc(N[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1OC(F)F	538553787	LDWBXYQHWKLEBQ-LLVKDONJSA-N	322.311	4.678	5	20	DJBD	
CC(C)Nc1ccc([N+](=O)[O-])cc1N[C@@H](C)c1ccccc1F	864039574	HBIIZWCHBJZMNF-LBPRGKRZSA-N	317.364	4.727	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1cc2ccccc2o1	133777087	VPAFMJWWHJZKME-ZDUSSCGKSA-N	310.353	4.500	5	20	DJBD	
Cc1c([C@H](C)N[C@H](c2ccccc2)C2CC2)cccc1[N+](=O)[O-]	178494425	SRDOMZRAJYDHLR-IFXJQAMLSA-N	310.397	4.705	5	20	DJBD	
Cc1c(CN[C@@H](CCC(C)C)c2ccoc2)cccc1[N+](=O)[O-]	353690976	SMJQCHVJRGHZOC-KRWDZBQOSA-N	316.401	4.763	5	20	DJBD	
CCc1ccc(Oc2nc3ccccc3s2)c([N+](=O)[O-])c1	522405929	MMEHXKSGYPLNID-UHFFFAOYSA-N	300.339	4.559	5	20	DJBD	
Cc1c(NC(=O)c2ccc(C3=CCCC3)cc2)cccc1[N+](=O)[O-]	583471456	KYDNWIZSVAWVEY-UHFFFAOYSA-N	322.364	4.723	5	20	DJBD	
COc1ccc(-c2nc3cccc(Cl)c3s2)cc1[N+](=O)[O-]	609315954	UERKNNROPASCPV-UHFFFAOYSA-N	320.757	4.534	5	20	DJBD	
C[C@H](N[C@H](C)c1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1	19995573	QRMVPIIJCUGLII-NEPJUHHUSA-N	304.777	4.660	5	20	DJBD	
CC[C@@H](NCc1ccc(C)c([N+](=O)[O-])c1)c1cccc(Cl)c1	237008003	DHTKJWQZVGEOGX-MRXNPFEDSA-N	318.804	4.798	5	20	DJBD	
CC(=O)c1ccc(N2CCCC[C@@H]2c2ccccc2)c([N+](=O)[O-])c1	762816252	NXNOEVJIHTWJBP-QGZVFWFLSA-N	324.380	4.529	5	20	DJBD	
O=[N+]([O-])c1ccc(NCc2ccc3sccc3c2)c(F)c1	864018348	QFGBVZGNXNTTJU-UHFFFAOYSA-N	302.330	4.561	5	20	DJBD	
C[C@H](N[C@@H](C)c1ccc(Cl)s1)c1cccc([N+](=O)[O-])c1	37508482	CRKCOBHLYOIZLK-UWVGGRQHSA-N	310.806	4.722	5	20	DJBD	
CCC[C@H](NCc1ccc(C)s1)c1cccc([N+](=O)[O-])c1	50225212	GRDXPTPFVYZURU-INIZCTEOSA-N	304.415	4.596	5	20	DJBD	
Cc1ccc2cc([C@@H](C)NCc3ccccc3[N+](=O)[O-])oc2c1	426039642	OFOUZIJNVOFPSL-CYBMUJFWSA-N	310.353	4.500	5	20	DJBD	
CCC[C@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccsc1	453250028	XLCUJDCROUDVCW-LRDDRELGSA-N	304.415	4.848	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)SCCc1scnc1C	507103224	LJHQXACYXMWYEB-LBPRGKRZSA-N	322.455	4.705	5	20	DJBD	
Cc1ccc2oc(CN[C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)cc2c1	561527244	NSSABESFYQIEIW-AWEZNQCLSA-N	324.380	4.809	5	20	DJBD	
O=[N+]([O-])c1cccc(CSCc2ccc3ncccc3c2)c1	1116625387	FGZAVJUPEXYATE-UHFFFAOYSA-N	310.378	4.576	5	20	DJBD	
COc1cccc(SCc2cc([N+](=O)[O-])ccc2Cl)c1	36964975	BWNLXTGTZGLATA-UHFFFAOYSA-N	309.774	4.549	5	20	DJBD	
CC(=O)c1ccc(Sc2cccc(Cl)c2)c([N+](=O)[O-])c1	54185638	RKBBEUZZRRTFND-UHFFFAOYSA-N	307.758	4.602	5	20	DJBD	
O=[N+]([O-])c1ccc(NCc2cccc(C(F)F)c2)c(Cl)c1	131784182	PFNFTFFQDAVNGM-UHFFFAOYSA-N	312.703	4.798	5	20	DJBD	
Cc1ccc([C@@H](C)Nc2ccc3cc([N+](=O)[O-])ccc3n2)s1	301111270	WKGUBERHMPXGIM-LLVKDONJSA-N	313.382	4.686	5	20	DJBD	
C[C@@H](Nc1ccccc1[N+](=O)[O-])c1ccccc1C(F)(F)F	315952336	YPGFYEWYHSVXEV-SNVBAGLBSA-N	310.275	4.787	5	20	DJBD	
C[C@H](NCCc1ccc([N+](=O)[O-])cc1)c1cccc2ccccc12	324661608	GPXCLIMCOZUMPB-HNNXBMFYSA-N	320.392	4.641	5	20	DJBD	
C[C@@H](NCc1cccc([N+](=O)[O-])c1)c1ccc(F)c2ccccc12	556064965	TWQBNLPWKWAHQH-CYBMUJFWSA-N	324.355	4.738	5	20	DJBD	
C[C@H](SCc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F	609238095	TUYPZCZYGYHAMZ-JTQLQIEISA-N	309.337	4.867	5	20	DJBD	
Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)C[C@@H](C)CC(C)C	736158232	KBSDTLHAILHIQD-JTQLQIEISA-N	312.797	4.567	5	20	DJBD	
O=C(CCC1CCCCC1)Nc1cccc([N+](=O)[O-])c1Cl	752986083	YQOJUQZITXTWSN-UHFFFAOYSA-N	310.781	4.547	5	20	DJBD	
C[C@H](NCc1ccc([N+](=O)[O-])c(F)c1)c1cccc2ccccc12	801526665	VEJTZKZLLBGHEX-ZDUSSCGKSA-N	324.355	4.738	5	20	DJBD	
C[C@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1Cl	37177048	WSBPRKZWXZAGQP-NEPJUHHUSA-N	304.777	4.660	5	20	DJBD	
Cc1cccc(C(=O)Nc2ccc3oc(C)c(C)c3c2)c1[N+](=O)[O-]	186788803	OZMDMJVOQHCJKF-UHFFFAOYSA-N	324.336	4.519	5	20	DJBD	
Cc1c(CN[C@H](CCC(C)C)c2ccoc2)cccc1[N+](=O)[O-]	353690986	SMJQCHVJRGHZOC-QGZVFWFLSA-N	316.401	4.763	5	20	DJBD	
O=[N+]([O-])c1cccc(SCc2cc(-c3ccccc3)on2)c1	509665593	GPVMXLCVEKWKCB-UHFFFAOYSA-N	312.350	4.542	5	20	DJBD	
CCCCCN(C(=O)c1cc(F)cc([N+](=O)[O-])c1)[C@@H](C)CCC	524681073	SNECROCCHJROER-ZDUSSCGKSA-N	324.396	4.555	5	20	DJBD	
CCC(=O)c1ccc(NCc2cc3ccccc3o2)c([N+](=O)[O-])c1	527034842	AQHDTJBIDXCDCZ-UHFFFAOYSA-N	324.336	4.546	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2C)s1	765303291	FMGHXPZMQFGPSE-QWHCGFSZSA-N	304.415	4.685	5	20	DJBD	
C[C@@H]1CC[C@@H](N(C)C(=O)c2cc3ccccc3c3cccnc23)C1	464477290	DHFMBVIVBXDAMR-GDBMZVCRSA-N	318.420	4.649	5	20	DJBD	
O=[N+]([O-])c1cc(CN2CCC[C@@H]2c2cccs2)ccc1Cl	761245897	KJYKLTOYIPJYOU-CYBMUJFWSA-N	322.817	4.647	5	20	DJBD	
Cc1c([C@H](C)Nc2ccc(OC(C)C)cc2)cccc1[N+](=O)[O-]	776812065	UBYLHWWHUKRBJD-AWEZNQCLSA-N	314.385	4.864	5	20	DJBD	
CCC[C@@H](c1ccccc1)c1nnc(-c2cccc([N+](=O)[O-])c2)o1	1117179266	PNECYTFFZBDBPM-INIZCTEOSA-N	323.352	4.577	5	20	DJBD	
CC(C)(C)OCc1ccc(NCc2csc([N+](=O)[O-])c2)cc1	84052109	SAKWFYPQXHZXKI-UHFFFAOYSA-N	320.414	4.584	5	20	DJBD	
CCCOc1cccc(N[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1	315426241	KERSLFOLVWNFHS-ZDUSSCGKSA-N	300.358	4.557	5	20	DJBD	
CCc1ccc([C@@H](NCc2cccc([N+](=O)[O-])c2)C(C)C)cc1	320127632	FZESLISTHQUDCM-IBGZPJMESA-N	312.413	4.644	5	20	DJBD	
CC[C@@H](Nc1ccc([N+](=O)[O-])c(C)n1)c1ccc(Cl)s1	471063420	PXRLHJPAHAAVDF-SECBINFHSA-N	311.794	4.576	5	20	DJBD	
O=[N+]([O-])c1ncccc1Oc1cccc(Oc2ccccc2)c1	603836706	HFLSHLDJVFPMND-UHFFFAOYSA-N	308.293	4.574	5	20	DJBD	
Fc1cccc(CNCc2c3ccccc3cc3ccccc23)n1	747926424	SGSDZSQPZRCCEY-UHFFFAOYSA-N	316.379	4.817	5	20	DJBD	
CCCCCC(C)(C)CNc1cc(C)c([N+](=O)[O-])cc1C(=O)O	1776779267	ZTUKWWYWCRTUTA-UHFFFAOYSA-N	322.405	4.620	5	20	DJBD	
CSc1ccccc1[C@@H](C)N[C@@H](C)c1cccc([N+](=O)[O-])c1	194866943	WNUVVEUWJKOVDB-QWHCGFSZSA-N	316.426	4.729	5	20	DJBD	
CC[C@@H](Nc1cc(C)c([N+](=O)[O-])cn1)c1ccc(Cl)cc1	470870448	XEKZUHNWFYGEBQ-CYBMUJFWSA-N	305.765	4.515	5	20	DJBD	
Cc1cccc2c1CC[C@@H]2N[C@H]1CCCc2ccc([N+](=O)[O-])cc21	562603586	SUUDMYIZLIEGRU-PMACEKPBSA-N	322.408	4.558	5	20	DJBD	
CC(C)C[C@H](NCc1ccc([N+](=O)[O-])c(F)c1)c1ccccc1	801529144	ZXRQLLBEYIIFNC-KRWDZBQOSA-N	316.376	4.611	5	20	DJBD	
CCOCCCCNCc1c2ccccc2cc2ccccc12	916837106	WMMVEEGXKHVHLM-UHFFFAOYSA-N	307.437	4.899	5	20	DJBD	
Cc1c(CSCCCCC(F)(F)F)cccc1[N+](=O)[O-]	507634731	OFYFZJKZMNUYQZ-UHFFFAOYSA-N	307.337	4.869	5	20	DJBD	
CSc1ccc([C@H](C)Nc2ncc(Cl)cc2[N+](=O)[O-])cc1	542854692	UBZMECFBWMPXQN-VIFPVBQESA-N	323.805	4.538	5	20	DJBD	
COc1ccc2cc(N[C@H](C)c3cccc([N+](=O)[O-])c3)ccc2c1	797023583	WNMYBFWWMSOCQE-CYBMUJFWSA-N	322.364	4.930	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1CNc1ccc(C2CC2)cc1	864023863	RHZQWQJPVPKPEV-UHFFFAOYSA-N	302.761	4.738	5	20	DJBD	
Cc1ccc(N[C@@H](C)c2ccc([N+](=O)[O-])cc2)c2cccnc12	320111619	WVRFOGKCUPOWJJ-ZDUSSCGKSA-N	307.353	4.625	5	20	DJBD	
Cc1ccccc1[C@H](C)Nc1ccc([N+](=O)[O-])c2ncccc12	320591949	XCIGPYOKFOFJQW-ZDUSSCGKSA-N	307.353	4.625	5	20	DJBD	
O=[N+]([O-])c1ccc(NCc2ccccc2OC2CCCC2)cc1	515499110	QMLDFUDVYPFDLZ-UHFFFAOYSA-N	312.369	4.528	5	20	DJBD	
CSc1c(F)cc(NCc2cccc([N+](=O)[O-])c2C)cc1F	541294783	SXJOUXBUYNIXPC-UHFFFAOYSA-N	324.352	4.515	5	20	DJBD	
CC(=O)c1cc(N[C@@H](C)c2cc(C)sc2C)ccc1[N+](=O)[O-]	557520300	XKSUSOXYJZJMJZ-JTQLQIEISA-N	318.398	4.649	5	20	DJBD	
Cc1ccc2c(c1)[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1C)CC2	611335762	ZTLRZHIIQCRECG-KBXCAEBGSA-N	310.397	4.550	5	20	DJBD	
CC(C)(C)CCNC(=O)c1cc2ccccc2c2cccnc12	643165511	NUBCKIJZZUTDAT-UHFFFAOYSA-N	306.409	4.554	5	20	DJBD	
Cc1c(CNc2ccc3nc(C4CC4)oc3c2)cccc1[N+](=O)[O-]	864018285	YOODOXWEAQVZKB-UHFFFAOYSA-N	323.352	4.534	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)c(Oc2cncc(Cl)c2)c(Cl)c1	141805264	QMOXFQDRAPITCF-UHFFFAOYSA-N	319.531	4.742	5	20	DJBD	
CC[C@H](N[C@H](C)c1cccc(F)c1F)c1cccc([N+](=O)[O-])c1	179560080	SJSBXILCTQLOJJ-BZNIZROVSA-N	320.339	4.675	5	20	DJBD	
CC[C@@H](N[C@H](C)c1ccccc1[N+](=O)[O-])c1cc(F)ccc1F	537094405	CRYHSDFGVIXOCS-BDJLRTHQSA-N	320.339	4.675	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H](C)c2cc(F)cc(F)c2)cc1[N+](=O)[O-]	90217579	SQTBYOOERCBAKK-RYUDHWBXSA-N	320.339	4.593	5	20	DJBD	
C[C@H](CCc1ccccc1[N+](=O)[O-])Nc1cccc2ccncc12	537523179	GWYIRLRYNVILQG-CQSZACIVSA-N	321.380	4.576	5	20	DJBD	
CN(CCC1CC1)C(=O)c1c2ccccc2cc2ccccc12	1319454674	XJDJHXUHYBLGCU-UHFFFAOYSA-N	303.405	4.865	5	20	DJBD	
C[C@@H](N[C@@H]1CCc2sc(Cl)cc21)c1cccc([N+](=O)[O-])c1	123378054	RTBBNFICGOYAPM-NOZJJQNGSA-N	322.817	4.648	5	20	DJBD	
O=C(Nc1ccsc1)c1cc2ccccc2c2cccnc12	172396234	PLSIZQZZOSHUGI-UHFFFAOYSA-N	304.374	4.702	5	20	DJBD	
Cc1c([C@H](C)N[C@@H](CC(F)(F)F)C(C)C)cccc1[N+](=O)[O-]	437092435	MCMNNGTTXSAMRG-AAEUAGOBSA-N	318.339	4.531	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1NC(=O)Nc1ccc(C(C)C)cc1	502589690	UVRBPPIIUUIFQH-UHFFFAOYSA-N	313.357	4.671	5	20	DJBD	
CCC[C@H](N[C@@H](CC)CC(F)(F)F)c1cccc([N+](=O)[O-])c1	546165329	DZTACNIHEOJEJJ-JSGCOSHPSA-N	318.339	4.757	5	20	DJBD	
C[C@@H](Nc1ccc(-c2ccccn2)cc1)c1ccccc1[N+](=O)[O-]	572537249	GUBLQGSLLIIFIF-CQSZACIVSA-N	319.364	4.830	5	20	DJBD	
O=[N+]([O-])c1c(Cl)cc(Cl)cc1CSc1ccncc1	809960220	WQBHSKJKGLSDSJ-UHFFFAOYSA-N	315.181	4.589	5	20	DJBD	
O=[N+]([O-])c1cc(F)c(N[C@H]2CCSc3ccccc32)c(F)c1	301813799	ZEISVAOKDITAGO-ZDUSSCGKSA-N	322.336	4.522	5	20	DJBD	
CC(C)OCc1ccc(N[C@H](C)c2ccccc2[N+](=O)[O-])cc1	610341416	LPMNGBJNSPCLMA-CQSZACIVSA-N	314.385	4.693	5	20	DJBD	
O=[N+]([O-])c1ccc(/C=C\Sc2ncc(-c3ccccc3)o2)o1	1345173375	JWBYRLBVFMWVTK-HJWRWDBZSA-N	314.322	4.606	5	20	DJBD	
Cc1cc([C@H](C)NCc2ccc([N+](=O)[O-])cc2Cl)c(C)s1	49963660	CGUOPVIQOKEWSS-JTQLQIEISA-N	324.833	4.777	5	20	DJBD	
CCC[C@@H](NCc1ccc(C)s1)c1cccc([N+](=O)[O-])c1	50225213	GRDXPTPFVYZURU-MRXNPFEDSA-N	304.415	4.596	5	20	DJBD	
C[C@@H](N[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccccc1	433149355	ISLOWJWATIUGKT-FZKQIMNGSA-N	310.397	4.668	5	20	DJBD	
Cc1ccccc1[C@H](Nc1ncc([N+](=O)[O-])cc1Cl)C1CC1	522936112	FNFXVOPSYATHKQ-OAHLLOKOSA-N	317.776	4.515	5	20	DJBD	
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1C2CCCC1CCC2	610281155	ZAJNUCMRXJLEFQ-UHFFFAOYSA-N	314.307	4.525	5	20	DJBD	
CCC(=O)c1ccc(N[C@H](C)c2ccc(C)s2)c([N+](=O)[O-])c1	795072127	GXGZWYGIPNRSPM-LLVKDONJSA-N	318.398	4.731	5	20	DJBD	
CC(C)c1ccccc1NC(=O)c1cc(Cl)ccc1[N+](=O)[O-]	5913238	XPJAHNZFMRFUII-UHFFFAOYSA-N	318.760	4.624	5	20	DJBD	
O=[N+]([O-])c1ccccc1COc1ccccc1-c1ccccc1	14738201	PMKRUQCHMIPQTO-UHFFFAOYSA-N	305.333	4.841	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2ccc(F)c(Cl)c2)c2ccncc12	22797994	FAYXQUGGOOBUEE-UHFFFAOYSA-N	318.691	4.728	5	20	DJBD	
O=[N+]([O-])c1cc(F)ccc1N[C@@H]1CCSc2c(F)cccc21	57680852	HXFURIBDGJSJSS-GFCCVEGCSA-N	322.336	4.522	5	20	DJBD	
CC[C@@H](N[C@@H](CC(F)(F)F)C(C)C)c1cccc([N+](=O)[O-])c1	437071804	AOUNGXRXMKPFCJ-KGLIPLIRSA-N	318.339	4.613	5	20	DJBD	
COc1ccc(N[C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1Cl	776797535	TUZPFDRVWWIMJO-LLVKDONJSA-N	320.776	4.738	5	20	DJBD	
O=[N+]([O-])c1ccsc1Sc1ncc(-c2ccc(F)cc2)o1	302001266	RYLRHRHAAHDUGS-UHFFFAOYSA-N	322.342	4.602	5	20	DJBD	
Cc1cc(C)cc([C@@H](C)Nc2ccc([N+](=O)[O-])c3cnccc23)c1	501298803	PAVJBGOFHHLPFS-CQSZACIVSA-N	321.380	4.933	5	20	DJBD	
CC[C@H](N[C@H]1CCc2c(C)cccc21)c1cccc([N+](=O)[O-])c1	539081397	YAHQPBAJNKNBRO-OALUTQOASA-N	310.397	4.631	5	20	DJBD	
Cc1ccc([C@H](C)NC2(c3ccccc3C)CC2)cc1[N+](=O)[O-]	592391867	PUUCZWVDAWEKRY-HNNXBMFYSA-N	310.397	4.552	5	20	DJBD	
Cc1c(CNc2cccc(SC(F)F)c2)cccc1[N+](=O)[O-]	864010934	OTUKCMKWKHEQBD-UHFFFAOYSA-N	324.352	4.830	5	20	DJBD	
C[C@@H](N[C@H](C)c1ccccc1Cl)c1cccc([N+](=O)[O-])c1	20015689	SBSVRGNNKJYZMS-VXGBXAGGSA-N	304.777	4.660	5	20	DJBD	
CCN(CC1CCC1)C(=O)c1cc2ccccc2c2cccnc12	478313241	RSIDONKMGJZCGP-UHFFFAOYSA-N	318.420	4.650	5	20	DJBD	
CC[C@@H](N[C@@H](C)CCCC(F)(F)F)c1cccc([N+](=O)[O-])c1	480179883	MAPFGYRCWROJLD-SMDDNHRTSA-N	318.339	4.757	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1C	538020609	HCTZGVYVTBKXPO-HZPDHXFCSA-N	312.413	4.932	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H]2CCCc3sccc32)cc1[N+](=O)[O-]	102196734	NZIUHXNDNJKDLD-DOMZBBRYSA-N	316.426	4.693	5	20	DJBD	
Cc1ccc(NCc2ccc([N+](=O)[O-])cc2)cc1C(F)(F)F	314604537	DJENALWCGLDBRZ-UHFFFAOYSA-N	310.275	4.534	5	20	DJBD	
Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)CCCC1CCCC1	463227885	HLDJPVAHOFSUME-UHFFFAOYSA-N	304.390	4.511	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C[C@H](C)CC(C)(C)C	610664573	HQDDBAVDOFRLAK-NSHDSACASA-N	306.406	4.613	5	20	DJBD	
Oc1nc([C@H]2CCCC(F)(F)C2)nc2cc3ccccc3cc12	286945921	AHVQGVPQZGAPAU-ZDUSSCGKSA-N	314.335	4.782	5	20	DJBD	
CCC(=O)c1ccc(N[C@H](CC)c2cccs2)c([N+](=O)[O-])c1	480069389	FVXDODCYSDLXCA-GFCCVEGCSA-N	318.398	4.812	5	20	DJBD	
O=[N+]([O-])c1cccc(SCc2cc(-c3cccs3)on2)c1	509653800	VPFMVBAEUCHETB-UHFFFAOYSA-N	318.379	4.604	5	20	DJBD	
CCC(CC)c1noc([C@@H](C)Sc2ccc([N+](=O)[O-])cc2)n1	547089015	GVQYFIANIUODDY-SNVBAGLBSA-N	321.402	4.735	5	20	DJBD	
CC(C)Oc1ccccc1[C@@H](C)Nc1ccccc1[N+](=O)[O-]	603862372	NMBSZPJCRAQNHW-CYBMUJFWSA-N	300.358	4.555	5	20	DJBD	
COc1cccc(CSCc2cc(Cl)ccc2[N+](=O)[O-])c1	746388665	FNKFXWBIRQYNLK-UHFFFAOYSA-N	323.801	4.690	5	20	DJBD	
Cc1cccc(C(C)C)c1NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1	33311088	YYOXNUVQMKMJHI-XFXZXTDPSA-N	324.380	4.679	5	20	DJBD	
O[C@H]1CCC[C@H](CNCc2c3ccccc3cc3ccccc23)C1	238015080	DJGNRTVGEZJIMX-LPHOPBHVSA-N	319.448	4.634	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)cc1CN[C@H](c1cccs1)C1CC1	754121383	CLGIPUMKHGSIIT-HNNXBMFYSA-N	322.817	4.551	5	20	DJBD	
C[C@@H](c1cc2ccccc2o1)N(C)Cc1ccccc1[N+](=O)[O-]	139615066	WSUDZRFWAWZIOI-ZDUSSCGKSA-N	310.353	4.534	5	20	DJBD	
CC[C@@H](NCc1cccc(C(F)F)c1)c1cccc([N+](=O)[O-])c1	275785220	WODHSBVCSMIYIG-MRXNPFEDSA-N	320.339	4.773	5	20	DJBD	
CCCCc1nc(CNc2cc([N+](=O)[O-])c(C)cc2C)cs1	462209430	KPKWYDPNNWWQAQ-UHFFFAOYSA-N	319.430	4.623	5	20	DJBD	
Cc1nc(SCc2ccc(Cl)c([N+](=O)[O-])c2)sc1C	768399319	NUPYYOINNSIECK-UHFFFAOYSA-N	314.819	4.614	5	20	DJBD	
O=[N+]([O-])c1ccc(F)cc1CSc1ccc2ccccc2n1	915790409	CJEBULKREAZYCZ-UHFFFAOYSA-N	314.341	4.574	5	20	DJBD	
Cc1cc([C@@H](C)N[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c(C)o1	119396263	FQXLKZUXGNZTCS-QWHCGFSZSA-N	302.374	4.525	5	20	DJBD	
C[C@H](N[C@@H](C)c1cccc(C2CC2)c1)c1ccc([N+](=O)[O-])cc1	451118643	YBPKHZBNQVEDTH-KBPBESRZSA-N	310.397	4.884	5	20	DJBD	
C[C@H](N[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccsc1	619754111	CRFMOKBOACXGSC-MEDUHNTESA-N	316.426	4.730	5	20	DJBD	
O=[N+]([O-])c1cccc2ccc(/C=C/c3scnc3C3CC3)nc12	447352715	BDXGMOKBLNRGCM-CMDGGOBGSA-N	323.377	4.647	5	20	DJBD	
Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cc2cccc(C)c2o1	488842683	XOFMKTKVIAPZBI-UHFFFAOYSA-N	324.336	4.519	5	20	DJBD	
CC(C)[C@@H](C)SCc1coc(-c2ccc([N+](=O)[O-])cc2)n1	534057719	QRISIQGHHNBTSX-LLVKDONJSA-N	306.387	4.528	5	20	DJBD	
Cc1c(CN[C@H]2CC[C@H](C)c3ccccc32)cccc1[N+](=O)[O-]	323044583	DEWYKUSOVHKDIZ-UGSOOPFHSA-N	310.397	4.631	5	20	DJBD	
C[C@@H](SCCOc1ccccc1F)c1ccccc1[N+](=O)[O-]	437277263	PXXGFLBRPATBLA-GFCCVEGCSA-N	321.373	4.607	5	20	DJBD	
CCN1CCC(NCc2c3ccccc3cc3ccccc23)CC1	236831002	WYECURMTINTILB-UHFFFAOYSA-N	318.464	4.567	5	20	DJBD	
O=[N+]([O-])c1ccccc1Oc1ncnc2sc3ccccc3c12	440633108	DAKYSHVXCCEUKB-UHFFFAOYSA-N	323.333	4.545	5	20	DJBD	
Cc1nc(N[C@H](C)c2csc3ccccc23)ccc1[N+](=O)[O-]	760461339	PILJZGUSDJKBPO-SNVBAGLBSA-N	313.382	4.686	5	20	DJBD	
Cc1ccc2sc(-c3ccc(Cl)c([N+](=O)[O-])c3)nc2c1	916854744	NKNAOPVMRDDQEJ-UHFFFAOYSA-N	304.758	4.833	5	20	DJBD	
Cc1nc(CS[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cs1	486050209	GVQBEFMTBKXADE-JTQLQIEISA-N	308.428	4.663	5	20	DJBD	
Cc1c(CN[C@H](c2ccccc2)C(C)(C)C)cccc1[N+](=O)[O-]	507003590	WSUORGFCFNXKLQ-GOSISDBHSA-N	312.413	4.780	5	20	DJBD	
COc1ccc(N[C@H](C)c2cccc([N+](=O)[O-])c2C)cc1Cl	776797729	XAZJVDVPJNAUAV-LLVKDONJSA-N	320.776	4.738	5	20	DJBD	
CC(C)CC1(c2nnc(-c3cccc([N+](=O)[O-])c3)o2)CCCC1	1326094372	FXXDVEVKMAUIDH-UHFFFAOYSA-N	315.373	4.503	5	20	DJBD	
O=C(c1ccc2ccccc2c1)c1cc2cc([N+](=O)[O-])ccc2o1	201427361	NPPBXJOSKMXWKE-UHFFFAOYSA-N	317.300	4.725	5	20	DJBD	
CC(=C/c1cccc([N+](=O)[O-])c1)/C=C/c1nc2ccccc2o1	469111575	WLQMTZQBJIPBTG-LTCRFSFDSA-N	306.321	4.853	5	20	DJBD	
CC(C)CCSCc1coc(-c2ccc([N+](=O)[O-])cc2)n1	534058975	IDSOXLLPRAVMIW-UHFFFAOYSA-N	306.387	4.529	5	20	DJBD	
Cc1cnc(SCc2cccc3ccccc23)c([N+](=O)[O-])c1	610284184	DQECSKNEGPNSBR-UHFFFAOYSA-N	310.378	4.744	5	20	DJBD	
COc1ccc2cc(N[C@@H](C)c3ccc([N+](=O)[O-])cc3)ccc2c1	795319417	YSTNRPUZYJKQAX-ZDUSSCGKSA-N	322.364	4.930	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)SCc1ncccc1C	1337382919	WUNLRUZXWBZKSH-ZDUSSCGKSA-N	302.399	4.601	5	20	DJBD	
CSc1cccc(NCc2cc(Cl)ccc2[N+](=O)[O-])c1	84439894	QVEFXEZSWHHBFM-UHFFFAOYSA-N	308.790	4.582	5	20	DJBD	
CCC[C@H](N[C@H]1CCCc2occc21)c1cccc([N+](=O)[O-])c1	120788355	DCOKRVOFEUHVIG-IRXDYDNUSA-N	314.385	4.696	5	20	DJBD	
c1ccc2c(CNCCc3cscn3)c3ccccc3cc2c1	236747383	YTZMAHPQULFLPF-UHFFFAOYSA-N	318.445	4.782	5	20	DJBD	
O=C(c1ccccc1[N+](=O)[O-])N(c1ccccc1)C1CCCCC1	498087166	BFNJVIMESKLHJU-UHFFFAOYSA-N	324.380	4.574	5	20	DJBD	
COc1ccccc1SCc1cc([N+](=O)[O-])ccc1Cl	41030439	VCVCSJIFVUUORX-UHFFFAOYSA-N	309.774	4.549	5	20	DJBD	
Cc1c([C@@H](C)N[C@@H]2CCCc3sccc32)cccc1[N+](=O)[O-]	134966755	VNGPUUBHLOPDJQ-IUODEOHRSA-N	316.426	4.693	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1CNc1cc(F)ccc1Cl	231818841	CLWQBMBRRSLPPR-UHFFFAOYSA-N	315.131	4.653	5	20	DJBD	
Cc1ccc(NCc2cc([N+](=O)[O-])ccc2OC(C)C)cc1C	462221006	VKFVWQOZBWCFGM-UHFFFAOYSA-N	314.385	4.611	5	20	DJBD	
O=C(Nc1cccc(-c2ccccc2)c1)c1ccccc1[N+](=O)[O-]	554033232	HXDQCXOVHHOKPJ-UHFFFAOYSA-N	318.332	4.514	5	20	DJBD	
C[C@H](SCCCC1CCOCC1)c1ccccc1[N+](=O)[O-]	578721488	MVQNNAZDVRPVHT-ZDUSSCGKSA-N	309.431	4.596	5	20	DJBD	
O=[N+]([O-])c1c(NCc2cc3ccccc3o2)ccc2ncccc12	603859712	WQYORHLVKYTQCF-UHFFFAOYSA-N	319.320	4.501	5	20	DJBD	
COc1ccccc1CSc1ccc([N+](=O)[O-])cc1Cl	609894643	ULPZQNDAEGBNQY-UHFFFAOYSA-N	309.774	4.549	5	20	DJBD	
COC1CCN(Cc2c3ccccc3cc3ccccc23)CC1	768215898	OLNQOBNHSPDNLM-UHFFFAOYSA-N	305.421	4.604	5	20	DJBD	
Cc1c([C@@H](C)NCc2cc3ccccc3o2)cccc1[N+](=O)[O-]	178486648	AVEMNILFCLZGOT-CYBMUJFWSA-N	310.353	4.500	5	20	DJBD	
Cc1ccc([C@H](C)NCc2ccc(Cl)cc2F)cc1[N+](=O)[O-]	187581960	WRLFFBOPIJQGJI-NSHDSACASA-N	322.767	4.547	5	20	DJBD	
CCC(CC)n1ccc(CSCc2ccccc2[N+](=O)[O-])n1	433658501	GLBZAPLGTVBOTF-UHFFFAOYSA-N	319.430	4.586	5	20	DJBD	
C[C@@H](SCc1ccc(F)c(F)c1)c1ccccc1[N+](=O)[O-]	437263361	AOADESRNOUWDPW-SNVBAGLBSA-N	309.337	4.867	5	20	DJBD	
Cc1c([C@@H](C)NCc2cccc(C(F)F)c2)cccc1[N+](=O)[O-]	1255461000	MISSTXWAMLGISA-GFCCVEGCSA-N	320.339	4.692	5	20	DJBD	
C[C@H](Nc1ccc([N+](=O)[O-])cc1)c1ccc(-c2ccncc2)cc1	301418577	CXIVEHFOTMQXPA-AWEZNQCLSA-N	319.364	4.830	5	20	DJBD	
CC(C)[C@H]1C[C@H](NCc2ccc([N+](=O)[O-])cc2)c2ccccc21	447581817	WJIURVFDRULGGO-MOPGFXCFSA-N	310.397	4.569	5	20	DJBD	
CCN(CC(C)(C)C)C(=O)c1cc2ccccc2c2cccnc12	485446022	MXQODMSHFHWJLE-UHFFFAOYSA-N	320.436	4.896	5	20	DJBD	
CCSc1ccc([C@@H](C)NCc2ccccc2[N+](=O)[O-])cc1	89512511	FSYXBDVFCAMFJF-CYBMUJFWSA-N	316.426	4.558	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H](C)c2cccc(F)c2F)cc1[N+](=O)[O-]	90963241	DJLBASLGHYRJFE-NWDGAFQWSA-N	320.339	4.593	5	20	DJBD	
C[C@H](N[C@@H]1c2ccccc2CC[C@@H]1C)c1cccc([N+](=O)[O-])c1	541846874	DXUSZBBZJDREQW-NJSLBKSFSA-N	310.397	4.569	5	20	DJBD	
CSc1ccc([C@@H](C)Nc2ncc(Cl)cc2[N+](=O)[O-])cc1	542163030	UBZMECFBWMPXQN-SECBINFHSA-N	323.805	4.538	5	20	DJBD	
CC(C)(C)OCc1cccc(CNc2ccc([N+](=O)[O-])s2)c1	608788468	KXXZMISRLADZAT-UHFFFAOYSA-N	320.414	4.584	5	20	DJBD	
Cn1ccc(CNCc2c3ccccc3cc3ccccc23)c1	748098578	IOUSTKNQLZHOFK-UHFFFAOYSA-N	300.405	4.621	5	20	DJBD	
C[C@@H](Nc1ccc([N+](=O)[O-])cc1)c1ccc(Br)cc1	23745281	GCAFJLHTWFPGLU-SNVBAGLBSA-N	321.174	4.530	5	20	DJBD	
Cc1nc(N[C@@H](C)c2oc3ccccc3c2C)ccc1[N+](=O)[O-]	301670536	YSQQKVYRDANHRY-LBPRGKRZSA-N	311.341	4.526	5	20	DJBD	
CCC[C@H](Nc1cccc(OC)c1)c1cccc([N+](=O)[O-])c1	314010595	GGLUNVYLAOQJNU-KRWDZBQOSA-N	300.358	4.557	5	20	DJBD	
CSc1ccc(Oc2ccc3ncccc3c2[N+](=O)[O-])cc1	485873893	VRXWCIVNAKSXFM-UHFFFAOYSA-N	312.350	4.657	5	20	DJBD	
CC(C)c1cnc(SCc2ccccc2[N+](=O)[O-])n1C(C)C	610033988	HKAYYNVWLBFOSF-UHFFFAOYSA-N	319.430	4.788	5	20	DJBD	
CC[C@@H](NCc1c(F)cccc1[N+](=O)[O-])c1cccc(Cl)c1	611378467	RHPUDJBCVNGSGU-OAHLLOKOSA-N	322.767	4.628	5	20	DJBD	
C[C@@H](SCc1ccc(Cl)cn1)c1ccccc1[N+](=O)[O-]	1337350085	CDQFVQOKEWVKCF-SNVBAGLBSA-N	308.790	4.638	5	20	DJBD	
CSc1ccc(N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1	20552948	MOXJNPSKPWQLSO-GFCCVEGCSA-N	302.399	4.798	5	20	DJBD	
Cc1c(OCc2csc(C3CCCC3)n2)cccc1[N+](=O)[O-]	64039424	WFSYYQGYTVQQFJ-UHFFFAOYSA-N	318.398	4.596	5	20	DJBD	
O=[N+]([O-])c1cccc(Cl)c1CN[C@H](c1cccs1)C1CC1	494801761	VQWXZYRBGLKZDS-HNNXBMFYSA-N	322.817	4.551	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1CN1CCC[C@@H]1c1ccsc1	609705195	DROQVBNMCLZKOZ-CQSZACIVSA-N	322.817	4.647	5	20	DJBD	
Cc1cc(COC(=O)c2c3ccccc3cc3ccccc23)on1	25400799	GVGPHPKDTWEAAG-UHFFFAOYSA-N	317.344	4.646	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2nc3ccccc3s2)cc1Cl	49320644	XPZPZNMQQWPVNB-UHFFFAOYSA-N	306.730	4.650	5	20	DJBD	
CCC[C@H](NCc1ccc(Cl)s1)c1cccc([N+](=O)[O-])c1	71307603	CSEYKKPQLWTVNI-AWEZNQCLSA-N	324.833	4.941	5	20	DJBD	
C[C@@H](N[C@H](C)c1ccccc1[N+](=O)[O-])c1cc2ccccc2o1	122080067	UTLLVNHIFWUXEC-CHWSQXEVSA-N	310.353	4.753	5	20	DJBD	
CCSc1ccc([C@H](C)Nc2cc(C)c([N+](=O)[O-])cn2)cc1	301451783	UNVCZLQHNBXIEI-LBPRGKRZSA-N	317.414	4.583	5	20	DJBD	
O=[N+]([O-])c1cc(-c2nc3cc(Cl)ccc3n2C2CC2)cs1	513856398	VKXSNLWKIIQFIA-UHFFFAOYSA-N	319.773	4.661	5	20	DJBD	
C[C@@H](SCCOc1ccccc1[N+](=O)[O-])c1cccs1	737406659	RPEQAIUKZNMHJN-LLVKDONJSA-N	309.412	4.530	5	20	DJBD	
O=[N+]([O-])c1cc(CN2CCC[C@@H]2c2ccsc2)ccc1Cl	768541492	HWCIGESQTGTQQE-CQSZACIVSA-N	322.817	4.647	5	20	DJBD	
C[C@@H](Nc1ccc([N+](=O)[O-])cc1F)c1ccc(Cl)c(F)c1	213767401	MEDRQVVCEMXHKI-MRVPVSSYSA-N	312.703	4.700	5	20	DJBD	
CC(C)Oc1ccc([C@H](C)Nc2ccc([N+](=O)[O-])cc2F)cc1	390703542	FNDAYFUFHJYWIC-LBPRGKRZSA-N	318.348	4.694	5	20	DJBD	
O=[N+]([O-])c1cc(C(F)F)ccc1NCc1cc2ccccc2o1	589108073	LFUZIHSKKSKMFN-UHFFFAOYSA-N	318.279	4.891	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)c(CN2CCC[C@@H]2c2ccccc2)c1	735492645	QGVARKGEAFQGPG-QGZVFWFLSA-N	316.788	4.585	5	20	DJBD	
CSc1ccc(C)c(NCc2ccc(Cl)c([N+](=O)[O-])c2)c1	775762974	VHIYWIQLAVFCNE-UHFFFAOYSA-N	322.817	4.891	5	20	DJBD	
CSc1cccc(N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1	21027758	LPOHLKDLGXRVTL-GFCCVEGCSA-N	302.399	4.798	5	20	DJBD	
CC[C@H](Nc1ccc([N+](=O)[O-])cc1Cl)c1nc(C)cs1	301198657	OMZRJVZDNVSTEG-NSHDSACASA-N	311.794	4.576	5	20	DJBD	
Cc1cc(N[C@@H](C)c2cccc3ccccc23)ncc1[N+](=O)[O-]	301428245	MTWCKZSOGOYRDD-ZDUSSCGKSA-N	307.353	4.625	5	20	DJBD	
CCSc1ccc([C@@H](C)Nc2ccc([N+](=O)[O-])c(C)n2)cc1	301650408	PQKBUEZYESVDDP-LLVKDONJSA-N	317.414	4.583	5	20	DJBD	
C[C@H](Nc1ccccc1[N+](=O)[O-])c1ccccc1C(F)(F)F	315952334	YPGFYEWYHSVXEV-JTQLQIEISA-N	310.275	4.787	5	20	DJBD	
Cc1cc(C)c([C@H](C)NCc2cccc([N+](=O)[O-])c2C)cc1C	323063304	MLDOJYBGHHIKDS-INIZCTEOSA-N	312.413	4.679	5	20	DJBD	
Cc1cc(N[C@@H](C)CCCC(F)(F)F)c(F)cc1[N+](=O)[O-]	461939913	YXWKRWSBQLERFZ-VIFPVBQESA-N	308.275	4.575	5	20	DJBD	
COc1ccccc1[C@H](C)Sc1ncc(Cl)cc1[N+](=O)[O-]	434954837	KTWNJXDDGIJJJE-VIFPVBQESA-N	324.789	4.505	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC1(c2ccccc2C)CC1	592391916	VAXAEAWFNCUJOX-OAHLLOKOSA-N	310.397	4.552	5	20	DJBD	
CC(C)Oc1ccccc1NCc1ccc([N+](=O)[O-])c(Cl)c1	761513695	COKGPQFPBYEXCB-UHFFFAOYSA-N	320.776	4.648	5	20	DJBD	
Cc1ccc2cc([C@H](C)NCc3ccc([N+](=O)[O-])cc3)oc2c1	426057335	ICLHWPICMHVFGY-ZDUSSCGKSA-N	310.353	4.500	5	20	DJBD	
O=[N+]([O-])c1cc(C(F)F)ccc1N1CCC[C@@H]1c1cccs1	809343352	JCECDGKKIWLWBK-GFCCVEGCSA-N	324.352	4.935	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](C)c1cccc(F)c1F	179557799	QJTJEEMYRHRFEB-NWDGAFQWSA-N	320.339	4.593	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)c1cccc(F)c1F	179557834	QJTJEEMYRHRFEB-NEPJUHHUSA-N	320.339	4.593	5	20	DJBD	
CCC[C@@H](NCc1ccccc1Cl)c1cccc([N+](=O)[O-])c1	314339355	JWRRCJYPDLKDNC-QGZVFWFLSA-N	318.804	4.879	5	20	DJBD	
C[C@@H](N[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccccc1	433149353	ISLOWJWATIUGKT-ACJLOTCBSA-N	310.397	4.668	5	20	DJBD	
CCc1ccc([C@H](C)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1	536911380	VDOXPSDTLXNVSO-OLZOCXBDSA-N	318.442	4.939	5	20	DJBD	
C[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1cccc(C2CC2)c1	550620375	ZWQWLNIWSXNHNG-KBPBESRZSA-N	310.397	4.884	5	20	DJBD	
CC(C)Oc1cccc([C@H](C)Nc2ccc([N+](=O)[O-])cc2F)c1	603860636	QUPFFIWZGJJAOJ-LBPRGKRZSA-N	318.348	4.694	5	20	DJBD	
C[C@H](Nc1ccc(OCC2CC2)cc1)c1cccc([N+](=O)[O-])c1	746047476	NHZGULHCBJFMQT-ZDUSSCGKSA-N	312.369	4.557	5	20	DJBD	
CCC(=O)c1ccc(Oc2ccc3ncccc3c2[N+](=O)[O-])cc1	112072452	XXFSEFARUKXOGH-UHFFFAOYSA-N	322.320	4.528	5	20	DJBD	
Cc1c(CN[C@H](C)c2ccc(Cl)c(F)c2)cccc1[N+](=O)[O-]	318472309	FOLYQZYMCWESMC-LLVKDONJSA-N	322.767	4.547	5	20	DJBD	
CC(C)Sc1ccc([C@@H](C)Nc2ncc([N+](=O)[O-])s2)cc1	443512085	RWORWNMRJRASDQ-SNVBAGLBSA-N	323.443	4.725	5	20	DJBD	
C[C@@H](N[C@H](C)c1cccc(C2CC2)c1)c1ccc([N+](=O)[O-])cc1	451118664	YBPKHZBNQVEDTH-ZIAGYGMSSA-N	310.397	4.884	5	20	DJBD	
CCC(C)(C)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1	556502742	HULSOTIHSOUDNW-UHFFFAOYSA-N	304.415	4.602	5	20	DJBD	
CC(C)Oc1ccccc1[C@H](C)Nc1ccc([N+](=O)[O-])cc1	603862453	VVVNGISKNINZQJ-ZDUSSCGKSA-N	300.358	4.555	5	20	DJBD	
Cc1ccc2c(c1)[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1C)CC2	611335765	ZTLRZHIIQCRECG-RDTXWAMCSA-N	310.397	4.550	5	20	DJBD	
CC[C@@H](OC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1	733387864	GSSAPKFYGLUSMZ-OAHLLOKOSA-N	319.744	4.556	5	20	DJBD	
O=[N+]([O-])c1cc(CN[C@@H](c2cccs2)C2CC2)ccc1Cl	812358081	HBMNZGLZWDLVPK-OAHLLOKOSA-N	322.817	4.551	5	20	DJBD	
c1ccc2c(CNC3CCSCC3)c3ccccc3cc2c1	729683908	ATDUSLKZYVDLEK-UHFFFAOYSA-N	307.462	4.978	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(N[C@H]2CCSc3ccc(F)cc32)c1	1336405221	CKFRDZZENJNQHH-ZDUSSCGKSA-N	318.373	4.691	5	20	DJBD	
CC[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1C)c1ccc(F)cc1	1337727623	DQWWGASMPBGGQW-GUYCJALGSA-N	316.376	4.844	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H](c2cccs2)C2CC2)cc1[N+](=O)[O-]	480233071	PIPJQZGRWMHXHX-SJKOYZFVSA-N	316.426	4.767	5	20	DJBD	
CCCCS[C@@H](C)c1nc(-c2ccc([N+](=O)[O-])cc2C)no1	544784714	GWHRBPFCMXSIRR-NSHDSACASA-N	321.402	4.548	5	20	DJBD	
O=c1oc2cc(OCC3CCCCC3)ccc2c2ccc(O)cc12	1875251689	JCZDGLNVWOPWAN-UHFFFAOYSA-N	324.376	4.611	5	20	DJBD	
CC(C)COc1cccc(N[C@H](C)c2ccccc2[N+](=O)[O-])c1	322053004	BDWUUWXKIUFCMO-CQSZACIVSA-N	314.385	4.803	5	20	DJBD	
Cc1ccc2c(c1)[C@H](N[C@@H]1CCCc3ccc([N+](=O)[O-])cc31)CC2	618571737	UBYBWMCOQQQALF-WOJBJXKFSA-N	322.408	4.558	5	20	DJBD	
CC(C)Oc1ccc([C@H](C)Nc2ccc(F)cc2[N+](=O)[O-])cc1	319787254	ZCQCKKQSLOPNQA-LBPRGKRZSA-N	318.348	4.694	5	20	DJBD	
Cc1cc(/C=C\c2ccc3c([N+](=O)[O-])cccc3n2)cc(C)c1O	436807016	JSKNFSLFGMTDGO-SREVYHEPSA-N	320.348	4.636	5	20	DJBD	
COc1ccccc1S[C@H](C)c1cc([N+](=O)[O-])ccc1C	484494114	XZYDJWGUIZJXNX-GFCCVEGCSA-N	303.383	4.765	5	20	DJBD	
O=[N+]([O-])c1ccccc1/C=C/C=C\c1ccc2ccccc2n1	508599172	PQSUUGCLVCCXTK-YLUFXQNESA-N	302.333	4.870	5	20	DJBD	
CC[C@@H](N[C@H]1CCc2cc(C)ccc21)c1cccc([N+](=O)[O-])c1	540139253	PJKVHUSZYPALJZ-MOPGFXCFSA-N	310.397	4.631	5	20	DJBD	
COc1ccc(N[C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1Cl	776797730	XAZJVDVPJNAUAV-NSHDSACASA-N	320.776	4.738	5	20	DJBD	
Cc1cc([C@@H](C)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)c(C)s1	37122833	GFAKHLXANKXWNH-NWDGAFQWSA-N	304.415	4.685	5	20	DJBD	
CC(C)Oc1cc(F)ccc1N[C@H](C)c1ccc([N+](=O)[O-])cc1	484948507	TUIQVWMQZOKHAD-GFCCVEGCSA-N	318.348	4.694	5	20	DJBD	
CCOCc1cccc(N[C@H](C)c2cc([N+](=O)[O-])ccc2C)c1	539651463	MDQIVYNALRHDTD-CQSZACIVSA-N	314.385	4.613	5	20	DJBD	
C[C@H](c1ccc(F)cc1)N(C)Cc1ccc(Cl)cc1[N+](=O)[O-]	609704862	XEODMKGUTCWFND-LLVKDONJSA-N	322.767	4.580	5	20	DJBD	
CCCCN(CC)C(=O)c1cc2ccccc2c2cccnc12	642518178	GZTTWWZZJBZTRM-UHFFFAOYSA-N	306.409	4.650	5	20	DJBD	
CCSc1ccc([C@H](C)NCc2ccccc2[N+](=O)[O-])cc1	89512512	FSYXBDVFCAMFJF-ZDUSSCGKSA-N	316.426	4.558	5	20	DJBD	
Cc1cccc(NC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c1C	137320846	OSUKOICPAOCHFQ-UHFFFAOYSA-N	319.748	4.509	5	20	DJBD	
Cc1cc([C@@H](C)Nc2ccc3cc([N+](=O)[O-])ccc3n2)c(C)o1	301128480	RXZCGAIEXGRVJO-LLVKDONJSA-N	311.341	4.526	5	20	DJBD	
Cc1ccc([C@@H](C)NCc2cc(F)cc(Cl)c2)cc1[N+](=O)[O-]	485694058	LTLHDNBXLDTIAG-LLVKDONJSA-N	322.767	4.547	5	20	DJBD	
C[C@H](SCc1cccc([N+](=O)[O-])c1)c1c(F)cccc1F	604046781	DFLZECFTKRYMRY-JTQLQIEISA-N	309.337	4.867	5	20	DJBD	
CCC[C@H](NCc1cc(Cl)ccc1[N+](=O)[O-])c1ccccc1	774811403	OFTKRGNGVFBSPB-INIZCTEOSA-N	318.804	4.879	5	20	DJBD	
CC[C@H](NCc1cc([N+](=O)[O-])ccc1Cl)c1ccccc1F	779128132	NPYQKJJEYIAKGL-INIZCTEOSA-N	322.767	4.628	5	20	DJBD	
CSc1ccc(Cl)c(NCc2cccc([N+](=O)[O-])c2C)c1	864033653	AAYDEQMOYGCUEK-UHFFFAOYSA-N	322.817	4.891	5	20	DJBD	
O=[N+]([O-])c1ccc(-c2nnc(-c3ccc4ccccc4c3)o2)s1	1255982648	DEJRBQPZDNPZKN-UHFFFAOYSA-N	323.333	4.527	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H](c2cccs2)C2CC2)cc1[N+](=O)[O-]	480233064	PIPJQZGRWMHXHX-PXAZEXFGSA-N	316.426	4.767	5	20	DJBD	
O=[N+]([O-])c1ccsc1Oc1cccc(Oc2ccccn2)c1	611411362	LPNYOPMKZSGBMW-UHFFFAOYSA-N	314.322	4.636	5	20	DJBD	
C[C@H](O)[C@H]1CCCN(Cc2c3ccccc3cc3ccccc23)C1	780893301	VZZCGCPKNUELRX-LPHOPBHVSA-N	319.448	4.586	5	20	DJBD	
CC[C@H](NCc1ccc([C@H]2C[C@@H]2C)o1)c1cccc([N+](=O)[O-])c1	175050813	GFHXVOJHUWZQIO-ZLIFDBKOSA-N	314.385	4.552	5	20	DJBD	
CCCN(CC1CC1)C(=O)c1cc2ccccc2c2cccnc12	193326459	YSYZKXATXVVCOT-UHFFFAOYSA-N	318.420	4.650	5	20	DJBD	
O=[N+]([O-])c1ccc2oc(/C(Cl)=C\c3ccc(F)cc3)nc2c1	255436011	OYMIHVBYXLTCFK-KPKJPENVSA-N	318.691	4.612	5	20	DJBD	
CCC(CC)NCc1ccc(-c2ccccc2[N+](=O)[O-])s1	517525494	QGBOYQVJAAZUOH-UHFFFAOYSA-N	304.415	4.602	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H](C)c2cc3ccccc3[nH]2)cc1[N+](=O)[O-]	775630344	HOSUNGZTQNLLJG-KBPBESRZSA-N	323.396	4.796	5	20	DJBD	
C[C@@H](NC(=O)c1c2ccccc2cc2ccccc12)C(F)(F)F	809300498	OPNFGYRPFXOLLR-LLVKDONJSA-N	317.310	4.674	5	20	DJBD	
O=[N+]([O-])c1ccc(F)cc1CNc1cccc(C2CCC2)c1	812447279	PGAFZQACBMMDGX-UHFFFAOYSA-N	300.333	4.614	5	20	DJBD	
CCCCc1nc(CSc2ccc([N+](=O)[O-])cc2)cs1	498102603	DSDPRLCSIUJNOJ-UHFFFAOYSA-N	308.428	4.686	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1cccc2ccccc12	538299215	ULWZPYOUZJHLML-OAHLLOKOSA-N	320.392	4.907	5	20	DJBD	
Cc1ccc([C@@H](C)Nc2nc3ccc([N+](=O)[O-])cc3s2)s1	731208690	FFGPMGMNNXLPBR-SECBINFHSA-N	319.411	4.748	5	20	DJBD	
C[C@@H](Nc1ccc([N+](=O)[O-])s1)c1ccccc1C(F)(F)F	742414003	SEXYSVQMTPQTJB-MRVPVSSYSA-N	316.304	4.848	5	20	DJBD	
O=[N+]([O-])c1ccccc1CN[C@H](c1ccccc1)C1CCCC1	507928613	DOSYKGBDTOZRNY-LJQANCHMSA-N	310.397	4.616	5	20	DJBD	
CC(C)Oc1cccc([C@@H](C)Nc2ccc(F)cc2[N+](=O)[O-])c1	515550395	JCWASTRMPAKRMN-GFCCVEGCSA-N	318.348	4.694	5	20	DJBD	
O=[N+]([O-])c1ccc(N2CCC[C@H]2c2ccccc2)c(Cl)c1	836601047	BWHFSJLJFIRYAB-HNNXBMFYSA-N	302.761	4.590	5	20	DJBD	
CC(C)c1cccc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1	109740104	AKBFPGOOKVOHSU-UHFFFAOYSA-N	318.760	4.624	5	20	DJBD	
C[C@H](c1ccccc1[N+](=O)[O-])N(C)Cc1cc2ccccc2o1	472292793	MANRCKFHTPFJQZ-CYBMUJFWSA-N	310.353	4.534	5	20	DJBD	
CSc1cccc(N[C@H](C)c2cccc([N+](=O)[O-])c2)c1C	537478001	RBODDRZWZNYBFO-GFCCVEGCSA-N	302.399	4.798	5	20	DJBD	
C[C@H](NCc1ccc([N+](=O)[O-])cc1)c1ccccc1C(C)(C)C	537992245	WUPZMBWGCJPWPF-AWEZNQCLSA-N	312.413	4.743	5	20	DJBD	
CCOc1cccc(N[C@H](CC)c2cccc([N+](=O)[O-])c2)c1	315584024	NGLKOSGARPQVQB-QGZVFWFLSA-N	300.358	4.557	5	20	DJBD	
Cc1cc(C)c([C@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1C	321075737	QMTAISFRMFNCQB-HOTGVXAUSA-N	312.413	4.932	5	20	DJBD	
Cc1cc(N[C@@H](C)c2ccccc2OC(C)C)ccc1[N+](=O)[O-]	603861971	JZPMLSZJJDDWJM-AWEZNQCLSA-N	314.385	4.864	5	20	DJBD	
CC(C)Oc1ccccc1N[C@H](C)c1ccccc1[N+](=O)[O-]	315884423	ORVJBMIJHNCGLZ-CYBMUJFWSA-N	300.358	4.555	5	20	DJBD	
CCSc1ccc([C@H](C)Nc2ncc(C)cc2[N+](=O)[O-])cc1	463053746	KFAWDHXSOCHVPS-LBPRGKRZSA-N	317.414	4.583	5	20	DJBD	
Cc1cccc2c1[C@H](C)C[C@@H]2N[C@H](C)c1cccc([N+](=O)[O-])c1	504900159	SAQYCBRCIPNFSF-LBTNJELSSA-N	310.397	4.802	5	20	DJBD	
O=[N+]([O-])c1cccc(CSC2=Nc3ccccc3CS2)c1	22021950	GFKPNJVJAPQMSG-UHFFFAOYSA-N	316.407	4.763	5	20	DJBD	
Cc1c([C@@H](C)NCc2ccc([N+](=O)[O-])cc2)oc2ccccc12	77221001	PEXDJRVDBQBAID-CYBMUJFWSA-N	310.353	4.500	5	20	DJBD	
CC[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1	79723741	XMDOEPDYJWKGCB-PXAZEXFGSA-N	302.349	4.536	5	20	DJBD	
C[C@H](SCc1cccc([N+](=O)[O-])c1)c1cc(F)ccc1F	195539645	FHLRABLQBOAJHK-JTQLQIEISA-N	309.337	4.867	5	20	DJBD	
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1sccc1C	872027315	KTBWGFISHURDEH-LLVKDONJSA-N	322.455	4.537	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)SCc1ncccc1C	1337382909	WUNLRUZXWBZKSH-CYBMUJFWSA-N	302.399	4.601	5	20	DJBD	
Cc1cc([C@@H](C)NCc2cc([N+](=O)[O-])ccc2Cl)c(C)s1	37122921	VEGINEOCVASBHC-SNVBAGLBSA-N	324.833	4.777	5	20	DJBD	
CCCCCN(C(=O)c1ccc(C)c([N+](=O)[O-])c1)[C@H](C)CCC	60084076	XWUXQPAUVFWEQW-OAHLLOKOSA-N	320.433	4.724	5	20	DJBD	
Cc1c([C@@H](C)N[C@@H](C)c2cccc(F)c2F)cccc1[N+](=O)[O-]	90963320	YPBKXSFCTRJLQH-NEPJUHHUSA-N	320.339	4.593	5	20	DJBD	
Cc1c(CNc2ccc(C(F)(F)F)cc2)cccc1[N+](=O)[O-]	314428075	GNBQLUCGWDKXFF-UHFFFAOYSA-N	310.275	4.534	5	20	DJBD	
Cc1ccc(NCc2cc([N+](=O)[O-])ccc2OC(C)C)c(C)c1	462203473	PQGBTSWOOQMHDA-UHFFFAOYSA-N	314.385	4.611	5	20	DJBD	
C[C@@H](N[C@H]1CC(C)(C)c2ccccc21)c1ccc([N+](=O)[O-])cc1	536846325	QGAKLZXUVSRRHU-ACJLOTCBSA-N	310.397	4.668	5	20	DJBD	
O=[N+]([O-])c1ccc2nc(Oc3ccc4cccnc4c3)sc2c1	795196150	RAOIGVJSPJUSOH-UHFFFAOYSA-N	323.333	4.545	5	20	DJBD	
CC[C@H](N[C@@H](C)c1cccc(F)c1F)c1cccc([N+](=O)[O-])c1	179560056	SJSBXILCTQLOJJ-ZBEGNZNMSA-N	320.339	4.675	5	20	DJBD	
Cc1ccc([C@@H](NCc2ccccc2[N+](=O)[O-])C2CCC2)cc1	427551968	ZWYBDVMSAOYHGQ-IBGZPJMESA-N	310.397	4.534	5	20	DJBD	
O=[N+]([O-])c1cccc(SCc2csc(-c3ccoc3)n2)c1	509090326	PSXWKKPLTVQCCY-UHFFFAOYSA-N	318.379	4.604	5	20	DJBD	
CC(C)(NCc1ccc2ccccc2c1)c1ccc([N+](=O)[O-])cc1	545872612	KQENVWJRZYZQCJ-UHFFFAOYSA-N	320.392	4.773	5	20	DJBD	
c1ccc2c(c1)cc(-c1nnc(C3CCC3)o1)c1ncccc12	1327892406	KMYYZHAILYFPBI-UHFFFAOYSA-N	301.349	4.706	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H](C)c2cccc(F)c2F)cc1[N+](=O)[O-]	90963240	DJLBASLGHYRJFE-VXGBXAGGSA-N	320.339	4.593	5	20	DJBD	
CSc1ccc(NCc2cc(Cl)ccc2[N+](=O)[O-])cc1	93632413	PUVDPYIWSAWXCK-UHFFFAOYSA-N	308.790	4.582	5	20	DJBD	
Cc1ccc(C)c(NC(=O)Nc2cccc([N+](=O)[O-])c2Cl)c1	809912856	MJWSFNJUZJFWIZ-UHFFFAOYSA-N	319.748	4.509	5	20	DJBD	
Cc1c(NCc2ccc([N+](=O)[O-])cc2)cccc1C(F)(F)F	864019083	NAIMKCUCZQUVCY-UHFFFAOYSA-N	310.275	4.534	5	20	DJBD	
Cc1cc([C@@H](C)N[C@H](C)c2cc([N+](=O)[O-])ccc2C)c(C)o1	119396138	FQXLKZUXGNZTCS-CHWSQXEVSA-N	302.374	4.525	5	20	DJBD	
Cc1c([C@H](C)N[C@H](c2ccccc2)C(C)C)cccc1[N+](=O)[O-]	480162298	KZXMTLQPEYUURN-KXBFYZLASA-N	312.413	4.951	5	20	DJBD	
CC(C)[C@@H](NCc1c(Cl)cccc1[N+](=O)[O-])c1ccccc1	494196363	WCXVXBKSLFNGEZ-QGZVFWFLSA-N	318.804	4.735	5	20	DJBD	
O=[N+]([O-])c1ccc(-c2nc3cc(Cl)ccc3n2C2CC2)cc1	513854772	VBBWEGHPDDYSPO-UHFFFAOYSA-N	313.744	4.600	5	20	DJBD	
CC(C)[C@@H](c1ccccc1)N(C)Cc1cc(F)ccc1[N+](=O)[O-]	732983975	NCOIWKOQYOFARE-SFHVURJKSA-N	316.376	4.563	5	20	DJBD	
C/C(=C/c1cccc([N+](=O)[O-])c1)CN[C@H]1C[C@H](c2ccccc2)C1	435780578	WQGMPECMNMEBBD-UGOAVVKXSA-N	322.408	4.534	5	20	DJBD	
CC(C)Oc1cccc([C@@H](C)Nc2ccc([N+](=O)[O-])cc2)c1	515550193	DVMSPKXRFCOJOT-CYBMUJFWSA-N	300.358	4.555	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@H](C)CCC(C)(C)C	544401793	PSPXCKDYJWTPFM-GFCCVEGCSA-N	306.406	4.613	5	20	DJBD	
CC(C)c1cccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1	14597689	UYOAZRKTHQKMSN-UHFFFAOYSA-N	318.760	4.624	5	20	DJBD	
O=[N+]([O-])c1ccc(N[C@H]2CCCc3ccccc32)c2cccnc12	324369679	SYFULKMCKQDBGS-INIZCTEOSA-N	319.364	4.633	5	20	DJBD	
CC(C)[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1	390683025	VBIZNRKHOGCWBU-SCLBCKFNSA-N	316.376	4.782	5	20	DJBD	
O=[N+]([O-])c1cccc(Cl)c1CN[C@@H](c1cccs1)C1CC1	494801763	VQWXZYRBGLKZDS-OAHLLOKOSA-N	322.817	4.551	5	20	DJBD	
CC(=O)c1ccc(N[C@H](c2ccccc2)C(C)C)c([N+](=O)[O-])c1	514485139	KCPJQQZJVCNAIP-SFHVURJKSA-N	312.369	4.607	5	20	DJBD	
O=[N+]([O-])c1ccc(CN2CCC[C@@H]2c2ccsc2)cc1Cl	783525898	BSJIWAIWCOXHOK-CQSZACIVSA-N	322.817	4.647	5	20	DJBD	
Cc1c([C@@H](C)NC2(c3ccccc3)CCC2)cccc1[N+](=O)[O-]	180347278	IIKOYDOJCFWLPP-OAHLLOKOSA-N	310.397	4.633	5	20	DJBD	
Cc1csc([C@H](Nc2ccc([N+](=O)[O-])cc2Cl)C2CC2)n1	301483332	ZOMIQIGZFJHNIT-CYBMUJFWSA-N	323.805	4.576	5	20	DJBD	
CCC(=O)c1ccc(Oc2cnc3ccccc3c2)c([N+](=O)[O-])c1	480331127	RWCZVSCQHIHCCN-UHFFFAOYSA-N	322.320	4.528	5	20	DJBD	
CSc1ccc(N[C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1	538498501	GRBMCAQDCQTORV-LBPRGKRZSA-N	302.399	4.798	5	20	DJBD	
CCC(=O)c1ccc(N2CCC[C@@H]2c2ccccc2)c([N+](=O)[O-])c1	795064640	FYFFSCPHBCSFNN-MRXNPFEDSA-N	324.380	4.529	5	20	DJBD	
O=[N+]([O-])c1ccc(CNc2ccc(SC(F)F)cc2)cc1	35018523	FHITVFZRCJOBEB-UHFFFAOYSA-N	310.325	4.522	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H](C)c2ccc(F)cc2F)cc1[N+](=O)[O-]	78970825	VHPPAMYMPXZVLE-VXGBXAGGSA-N	320.339	4.593	5	20	DJBD	
Cc1c(CN[C@@H]2CC[C@H](C)c3ccccc32)cccc1[N+](=O)[O-]	323044581	DEWYKUSOVHKDIZ-SCLBCKFNSA-N	310.397	4.631	5	20	DJBD	
CCC[C@@H](NCc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1	539244459	WRWWWDZSNYYMID-MRXNPFEDSA-N	318.804	4.879	5	20	DJBD	
CC(C)(C)SCCSc1ccc([N+](=O)[O-])c2cccnc12	784685338	NKILLXKYAMIPDH-UHFFFAOYSA-N	322.455	4.767	5	20	DJBD	
O=[N+]([O-])c1ccc(N[C@H](c2ccccc2)C2CC2)c2ccncc12	140360786	DGZYOWXEHISAKZ-LJQANCHMSA-N	319.364	4.706	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H](C)c2cccc(Cl)c2)cc1[N+](=O)[O-]	219863701	QQJBKTFDFCWNPS-CHWSQXEVSA-N	318.804	4.968	5	20	DJBD	
C[C@@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(C2CC2)cc1	417357815	SDNANARXZJGGLZ-ZIAGYGMSSA-N	310.397	4.884	5	20	DJBD	
C[C@H](SCCCOc1ccccc1)c1ccccc1[N+](=O)[O-]	437259251	QEMDDDADEDGCMB-AWEZNQCLSA-N	317.410	4.858	5	20	DJBD	
CCC[C@@H](NCc1ccc(C)c(F)c1)c1cccc([N+](=O)[O-])c1	480412002	MWPBEOFBFDAJIE-GOSISDBHSA-N	316.376	4.673	5	20	DJBD	
C[C@H](c1cccs1)N(C)Cc1c(Cl)cccc1[N+](=O)[O-]	494176521	PWNXROSAYXWDMZ-SNVBAGLBSA-N	310.806	4.503	5	20	DJBD	
CC(C)c1ccc(CN(C)[C@@H](C)c2ccco2)cc1[N+](=O)[O-]	507207143	BKKAEJCXPXQEBK-ZDUSSCGKSA-N	302.374	4.504	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H]2CCc3c(C)cccc32)cc1[N+](=O)[O-]	540179321	QTVNWMVRIBHHTJ-RDTXWAMCSA-N	310.397	4.550	5	20	DJBD	
C[C@H]1C[C@@H](NCc2c3ccccc3cc3ccccc23)CCN1C	742374736	DXTCSOSZQZOAJM-LPHOPBHVSA-N	318.464	4.565	5	20	DJBD	
C[C@H](Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1ccccc1	215859002	AGKOYVOSQATAIS-JTQLQIEISA-N	310.275	4.787	5	20	DJBD	
O=[N+]([O-])c1ccc(Nc2cccc(COCc3ccco3)c2)cc1	301116492	XSTRDADCYJQODC-UHFFFAOYSA-N	324.336	4.648	5	20	DJBD	
O=[N+]([O-])c1ccc2c(c1)[C@@H](N[C@@H]1CCCc3ccccc31)CCC2	447517808	UMFONYNIDNPXON-UXHICEINSA-N	322.408	4.639	5	20	DJBD	
CCC(CC)c1cc(CNc2ccc(Cl)cc2[N+](=O)[O-])on1	462901646	ILGQVDKSLGRUSY-UHFFFAOYSA-N	323.780	4.752	5	20	DJBD	
Cc1ccc2c(c1)[C@@H](N[C@@H]1CCCc3ccc([N+](=O)[O-])cc31)CC2	618571735	UBYBWMCOQQQALF-UXHICEINSA-N	322.408	4.558	5	20	DJBD	
O=[N+]([O-])c1ccc(SCc2cnc3ccccc3c2)c(F)c1	619585580	CYCVEBCXHFVVHL-UHFFFAOYSA-N	314.341	4.574	5	20	DJBD	
Cc1cc(N[C@H](C)c2csc3ccccc23)ncc1[N+](=O)[O-]	746388623	HFPSMYNSTMTXOF-LLVKDONJSA-N	313.382	4.686	5	20	DJBD	
CC[C@@H](NCc1c(Cl)cccc1[N+](=O)[O-])c1cccs1	107904562	DRQWGFCAUYENNG-GFCCVEGCSA-N	310.806	4.551	5	20	DJBD	
O=[N+]([O-])c1cnc(N[C@H](c2ccccc2F)C2CCCC2)s1	409723476	SQPFHYLXPSYRHV-AWEZNQCLSA-N	321.377	4.534	5	20	DJBD	
O=[N+]([O-])c1cnc(N[C@@H](c2ccccc2F)C2CCCC2)s1	409723477	SQPFHYLXPSYRHV-CQSZACIVSA-N	321.377	4.534	5	20	DJBD	
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccccc1C(C)C	421422204	VBXFAULEQASDGZ-UHFFFAOYSA-N	312.369	4.587	5	20	DJBD	
O=[N+]([O-])c1ccccc1-c1ccc(-c2nc3cnccc3s2)o1	513868056	POEQKMQLFBQGHY-UHFFFAOYSA-N	323.333	4.527	5	20	DJBD	
CCC[C@H](NCc1cc2ccccc2o1)c1cccc([N+](=O)[O-])c1	539089778	HYQXMZJDURPTEN-SFHVURJKSA-N	324.380	4.972	5	20	DJBD	
CC(C)(C)Oc1ccc(CNc2cccc(F)c2[N+](=O)[O-])cc1	920485568	JDKIRFCCMXFZHQ-UHFFFAOYSA-N	318.348	4.523	5	20	DJBD	
CC(C)OCc1ccc(N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1	180169327	SSMDASZINQKPGQ-AWEZNQCLSA-N	314.385	4.693	5	20	DJBD	
C[C@@H](NC1(c2cccc(Cl)c2)CC1)c1ccc([N+](=O)[O-])cc1	182258851	VBUUXEOCGCDLKX-GFCCVEGCSA-N	316.788	4.588	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H](C)c2ccc(F)c(F)c2)cc1[N+](=O)[O-]	192724755	DSRLSZXEYVXZMZ-NWDGAFQWSA-N	320.339	4.593	5	20	DJBD	
Cc1cccc(C)c1[C@@H](C)N[C@@H](C)c1cccc([N+](=O)[O-])c1C	544898938	YLOKIVCECNERBS-JKSUJKDBSA-N	312.413	4.932	5	20	DJBD	
COc1ccc(CSc2cc(C)ccc2C)cc1[N+](=O)[O-]	603722291	DISLCRKBHBNHHB-UHFFFAOYSA-N	303.383	4.513	5	20	DJBD	
C[C@H](CC(=O)OCc1nc2ccccc2c2ccccc12)C1CC1	920724719	ANXYRYKTJJGLRF-CQSZACIVSA-N	319.404	4.867	5	20	DJBD	
CCc1ccc([C@@H](C)NCc2c(Cl)cccc2[N+](=O)[O-])cc1	319978829	XGLCTHSNYCDYFG-GFCCVEGCSA-N	318.804	4.661	5	20	DJBD	
O=[N+]([O-])c1ccc(NCCCCCOC2CCCCC2)cc1	609514680	VQRZQKVNYAOLTF-UHFFFAOYSA-N	306.406	4.526	5	20	DJBD	
CC(C)n1ncc2cc(N[C@H](C)c3ccc([N+](=O)[O-])cc3)ccc21	611482978	OWWFKPRLIVVPDT-CYBMUJFWSA-N	324.384	4.699	5	20	DJBD	
C[C@H](NC(=O)c1c2ccccc2cc2ccccc12)c1ccc[nH]1	760735664	DIERCGZENZGYCZ-AWEZNQCLSA-N	314.388	4.812	5	20	DJBD	
Cc1ccc2cccc(N[C@@H](C)c3ccc([N+](=O)[O-])cc3)c2n1	320517018	FWZSMNMQRFAIKY-ZDUSSCGKSA-N	307.353	4.625	5	20	DJBD	
O=[N+]([O-])c1cccc(NCc2csc(C3CCCCC3)n2)c1	444419513	OGWLRTOWZKMQQM-UHFFFAOYSA-N	317.414	4.711	5	20	DJBD	
Cc1cnc(N[C@@H](C)c2oc3ccccc3c2C)c([N+](=O)[O-])c1	463047069	CCPSMDDZHHZRGN-LBPRGKRZSA-N	311.341	4.526	5	20	DJBD	
Cc1cc(NC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)ccc1C1CC1	562301307	LHPAIKJCOHFJOP-ZDUSSCGKSA-N	324.380	4.523	5	20	DJBD	
Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)C=C1CCC(C)CC1	736158253	KMPDKCNOICSVPG-UHFFFAOYSA-N	322.792	4.632	5	20	DJBD	
CCCC(=Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)CCC	1118068775	PRBXEKIHJFSFNN-UHFFFAOYSA-N	301.346	4.628	5	20	DJBD	
CC(C)(C)[C@@H](NCc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1	42800659	NWHCWVDWWGHFHM-KRWDZBQOSA-N	316.376	4.611	5	20	DJBD	
Cc1ccc(OCc2ccc(C(F)(F)F)cc2)c([N+](=O)[O-])c1	71810321	LFGVYTLKMJRRQP-UHFFFAOYSA-N	311.259	4.501	5	20	DJBD	
CCCOc1cc(C)ccc1NCc1cccc([N+](=O)[O-])c1C	462239783	SXCNDUHBSZAGMF-UHFFFAOYSA-N	314.385	4.613	5	20	DJBD	
Cc1c(CN(C)[C@H](C)c2ccccc2Cl)cccc1[N+](=O)[O-]	603856620	MRRPKHGFOQRBPR-CYBMUJFWSA-N	318.804	4.750	5	20	DJBD	
O=[N+]([O-])c1cc(C(F)F)ccc1N1CCCc2sccc2C1	853295390	IWHXKXAUDUSUOC-UHFFFAOYSA-N	324.352	4.547	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2ccc(F)cc2Cl)c2ccncc12	22797964	HKODCVSCVYDRJT-UHFFFAOYSA-N	318.691	4.728	5	20	DJBD	
O=C(CSc1ccc2ccccc2c1)c1ccc([N+](=O)[O-])cc1	32692655	KYQYCONRWHGZNL-UHFFFAOYSA-N	323.373	4.723	5	20	DJBD	
CC(C)C[C@@H](NCc1c(F)cccc1[N+](=O)[O-])c1ccccc1	611376567	NJKUFLHTRVZRQN-QGZVFWFLSA-N	316.376	4.611	5	20	DJBD	
C[C@H](N[C@H]1CC(C)(C)Cc2occc21)c1cccc([N+](=O)[O-])c1	155792806	FSDKQQBHXHJECM-LRDDRELGSA-N	314.385	4.552	5	20	DJBD	
C[C@@H](NCc1ccc(C(C)(F)F)cc1)c1cccc([N+](=O)[O-])c1	293624907	GAFUDWFPOYTZFQ-GFCCVEGCSA-N	320.339	4.557	5	20	DJBD	
Cc1ccc2c(c1)[C@H](N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)CC2	540221221	VAQFWAFWVRKFIP-RDTXWAMCSA-N	310.397	4.550	5	20	DJBD	
O=[N+]([O-])c1ccc(CN2CCC[C@@H]2c2ccccc2Cl)cc1	603857534	XANBQXVZHZJOCO-QGZVFWFLSA-N	316.788	4.585	5	20	DJBD	
Cc1cc(C)c([C@@H](C)NCc2cccc([N+](=O)[O-])c2C)cc1C	323063305	MLDOJYBGHHIKDS-MRXNPFEDSA-N	312.413	4.679	5	20	DJBD	
CCC[C@H](CC)S[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C	477060286	CQIZXWOQXUKBNA-STQMWFEESA-N	324.446	4.542	5	20	DJBD	
CC[C@@H](N[C@H](c1cccs1)C1CC1)c1cccc([N+](=O)[O-])c1	480238164	ASJVMWZJCMGWLD-WBVHZDCISA-N	316.426	4.848	5	20	DJBD	
C[C@@H]1OCC[C@H]1SCc1nc2ccccc2c2ccccc12	549929803	SCOYNHZCXUONCX-ORAYPTAESA-N	309.434	4.799	5	20	DJBD	
CC(F)(F)c1ccccc1N[C@@H]1CCc2c1cccc2[N+](=O)[O-]	594506446	RPCYQRCRCBEZHD-CQSZACIVSA-N	318.323	4.806	5	20	DJBD	
CC[C@H](CC(F)(F)F)Nc1ccc(C(F)F)cc1[N+](=O)[O-]	596192173	MEARDLSWUPPYNE-MRVPVSSYSA-N	312.238	4.675	5	20	DJBD	
C[C@@H](Nc1ccc([N+](=O)[O-])s1)c1c(F)cccc1Cl	610588608	TXEBWCHECOZQIG-SSDOTTSWSA-N	300.742	4.622	5	20	DJBD	
COc1ccccc1[C@@H](C)SCc1cccc([N+](=O)[O-])c1	463206898	QQUAPAKPCRZSDE-GFCCVEGCSA-N	303.383	4.598	5	20	DJBD	
C[C@@H](CC1CC1)NCc1ccc(-c2ccccc2[N+](=O)[O-])s1	497320632	WZCXYPBUWGVSEO-LBPRGKRZSA-N	316.426	4.602	5	20	DJBD	
CCSc1ccc(Cl)cc1NCc1ccc([N+](=O)[O-])cc1	609221101	RTVXQOVAXIQJBY-UHFFFAOYSA-N	322.817	4.972	5	20	DJBD	
CC(C)CCOc1ccc(NCc2ccc([N+](=O)[O-])cc2)cc1	744450366	ZMDVBPAIAUYNID-UHFFFAOYSA-N	314.385	4.632	5	20	DJBD	
CC(C)(C)c1ccc(-c2nnc(-c3ccccc3)o2)cc1[N+](=O)[O-]	1322079674	DGTARKUFQCEXHC-UHFFFAOYSA-N	323.352	4.609	5	20	DJBD	
CC[C@@H](N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1cccs1	49529263	UJFHJSOWYVDRCK-TZMCWYRMSA-N	304.415	4.767	5	20	DJBD	
C[C@@H](Nc1ccc2nc(C3CC3)oc2c1)c1ccc([N+](=O)[O-])cc1	182895963	LCUJUBHRYRZMEZ-LLVKDONJSA-N	323.352	4.787	5	20	DJBD	
CC[C@@H](Nc1ccc2ccn(C)c2c1)c1cccc([N+](=O)[O-])c1	443199794	FFFYWQGHGVCQQT-QGZVFWFLSA-N	309.369	4.650	5	20	DJBD	
Cc1cc([C@@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c(C)s1	37122800	IRDOZOTWNXUFER-NWDGAFQWSA-N	304.415	4.685	5	20	DJBD	
Cc1cc(C)cc([C@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2C)c1	482658335	PUAVSTCDXIFXLZ-JKSUJKDBSA-N	312.413	4.932	5	20	DJBD	
C[C@H](SCc1ccc([N+](=O)[O-])cc1)c1cc(F)ccc1F	609237594	GTPQGWJAKXOHPD-JTQLQIEISA-N	309.337	4.867	5	20	DJBD	
C[C@@H](c1ccco1)N(Cc1cc(Cl)ccc1[N+](=O)[O-])C1CC1	754873683	XOYVJDHHZPENNM-NSHDSACASA-N	320.776	4.567	5	20	DJBD	
O=[N+]([O-])c1ccc(/C=C/SC2=Nc3ccccc3CS2)o1	825293398	WBHDGTQOOILTTJ-BQYQJAHWSA-N	318.379	4.826	5	20	DJBD	
C[C@H](N[C@@H](C)c1ccccc1Cl)c1ccc([N+](=O)[O-])cc1	37177047	WSBPRKZWXZAGQP-RYUDHWBXSA-N	304.777	4.660	5	20	DJBD	
CCc1ccc([C@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)s1	41631842	FLZXDVPXPPRQEJ-RYUDHWBXSA-N	304.415	4.631	5	20	DJBD	
O=[N+]([O-])c1ccc(CNc2ccccc2OC2CCCC2)cc1	237985315	PRBOXGIAIYGRML-UHFFFAOYSA-N	312.369	4.528	5	20	DJBD	
O=[N+]([O-])c1ccc(CSc2ccnc3ccccc23)c(F)c1	476485734	BERWKXMOIMJKJC-UHFFFAOYSA-N	314.341	4.574	5	20	DJBD	
COc1ccccc1CSCc1ccc(Cl)cc1[N+](=O)[O-]	522549035	WVVUFXNEPARBMB-UHFFFAOYSA-N	323.801	4.690	5	20	DJBD	
O=[N+]([O-])c1ccccc1CSc1ccccc1Br	611124722	MUHXFERZXFHZOE-UHFFFAOYSA-N	324.199	4.650	5	20	DJBD	
CC(C)CCN(C)C(=O)c1cc2ccccc2c2cccnc12	49673357	KSBRMSJSRZTWGY-UHFFFAOYSA-N	306.409	4.506	5	20	DJBD	
CCC1(CC)CN(C(=O)c2cc3ccccc3c3cccnc23)C1	504196656	WHORXCCAKDMAAP-UHFFFAOYSA-N	318.420	4.650	5	20	DJBD	
CC(=O)c1cc(N[C@@H](C)c2ccccc2Cl)ccc1[N+](=O)[O-]	555240395	IISCKLAHDXCOLR-JTQLQIEISA-N	318.760	4.624	5	20	DJBD	
O=[N+]([O-])c1ccccc1N1CCC[C@H]1c1ccc(Cl)cc1	603848439	OOZIAXSKFCCPFD-AWEZNQCLSA-N	302.761	4.590	5	20	DJBD	
OCC[C@H]1CCC[C@H]1NCc1c2ccccc2cc2ccccc12	778216439	NSCJHDRJXIZQMB-OPAMFIHVSA-N	319.448	4.634	5	20	DJBD	
Cc1cc([C@H](C)NCc2cc([N+](=O)[O-])ccc2Cl)c(C)s1	37122922	VEGINEOCVASBHC-JTQLQIEISA-N	324.833	4.777	5	20	DJBD	
CCOCc1cccc(N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1	182943788	CYFVQXZAJQSHRX-AWEZNQCLSA-N	314.385	4.613	5	20	DJBD	
Cc1c([C@@H](C)N[C@H](C)c2ccccc2Cl)cccc1[N+](=O)[O-]	479766601	QEDHCRBSICNNRK-CHWSQXEVSA-N	318.804	4.968	5	20	DJBD	
Cc1ccc(/C=C(\c2ccncc2)c2ccc([N+](=O)[O-])cc2)cc1	502191228	FWSINPIBLDXZBX-ZHZULCJRSA-N	316.360	4.887	5	20	DJBD	
CCC[C@@H](Nc1ccc2c(c1)CCN2)c1cccc([N+](=O)[O-])c1	423221743	XWRPGTMAWBFFRM-GOSISDBHSA-N	311.385	4.516	5	20	DJBD	
Cc1ccccc1[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)C(C)C	467863677	MAIQEBKHUUHRIY-DNVCBOLYSA-N	312.413	4.951	5	20	DJBD	
Cc1ccc([C@H](C)N(C)Cc2c(F)cccc2[N+](=O)[O-])c(C)c1	505913401	SUTMLXFBEOXOEK-AWEZNQCLSA-N	316.376	4.544	5	20	DJBD	
CC(C)(C)[C@H]1COC(c2ccc3ccc4ccccc4c3n2)=N1	642814429	MFVLXXMHRWVLLT-QGZVFWFLSA-N	304.393	4.580	5	20	DJBD	
Cc1ccc([C@H](N[C@@H](C)c2cccc([N+](=O)[O-])c2)C2CC2)cc1	390962641	LIAOCCMNOGMDQS-LIRRHRJNSA-N	310.397	4.705	5	20	DJBD	
CCC[C@H](N[C@H](CC)c1cccc([N+](=O)[O-])c1)c1ccccn1	610810436	JPWNRCBREKZEGB-AEFFLSMTSA-N	313.401	4.572	5	20	DJBD	
CC[C@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1cc(F)ccc1F	90078072	CREIXQKSWLEQID-GTNSWQLSSA-N	320.339	4.675	5	20	DJBD	
CC[C@H](N[C@@H]1CCCc2ccccc21)c1cccc([N+](=O)[O-])c1	195548121	LQSYDPJUAOTBRC-RBUKOAKNSA-N	310.397	4.713	5	20	DJBD	
O=[N+]([O-])c1ccccc1/C=C\CN1CCC[C@H]1c1ccsc1	507167400	LCXVLIHBVUTLQH-UYZDIKGJSA-N	314.410	4.507	5	20	DJBD	
Cc1cc(C)cc(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1	600852002	YMDWKOHVPSTQLE-UHFFFAOYSA-N	324.302	4.843	5	20	DJBD	
C/C=C\c1ccc(OCc2cccc([N+](=O)[O-])c2C)c(OC)c1	603675451	RQEXDBPRVAFAEJ-XQRVVYSFSA-N	313.353	4.524	5	20	DJBD	
OCCCCNCc1c2ccccc2c(Cl)c2ccccc12	785532611	UUSKZFPGPRJYSO-UHFFFAOYSA-N	313.828	4.509	5	20	DJBD	
Cc1cc(C)c2cc(CN[C@@H](C)c3ccccc3[N+](=O)[O-])[nH]c2c1	479416882	BKXWCKHFJCDQAY-AWEZNQCLSA-N	323.396	4.544	5	20	DJBD	
C[C@H](SCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cccs1	789921565	LSCVZXUZFRYYMW-VIFPVBQESA-N	324.383	4.559	5	20	DJBD	
C[C@@H](N[C@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1Cl	20526158	WYMAVFOHSVNVMD-VXGBXAGGSA-N	304.777	4.660	5	20	DJBD	
CC(C)Oc1ccc([C@@H](C)Nc2ccc(F)cc2[N+](=O)[O-])cc1	319787253	ZCQCKKQSLOPNQA-GFCCVEGCSA-N	318.348	4.694	5	20	DJBD	
Cc1ccc2c(c1)CC[C@@H]2N[C@@H](C)c1cccc([N+](=O)[O-])c1C	536825195	FNAMVLXVVSUIPP-KSSFIOAISA-N	310.397	4.550	5	20	DJBD	
C[C@@H](N[C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(Cl)c(F)c1	539296194	YRMPRQPIAAVSBQ-GHMZBOCLSA-N	322.767	4.799	5	20	DJBD	
O=[N+]([O-])c1ccc2nc(Oc3ccc(Cl)cc3F)sc2c1	731205604	BEXBWZLBVUGSMJ-UHFFFAOYSA-N	324.720	4.789	5	20	DJBD	
C[C@@H](Nc1ccc([N+](=O)[O-])cc1F)c1ccc(F)cc1Cl	43474159	SHSYWYYBEHNBGL-MRVPVSSYSA-N	312.703	4.700	5	20	DJBD	
Cc1cc([C@H](C)Nc2ccc([N+](=O)[O-])c3cnccc23)c(C)o1	69287318	CVJQYGRUPNQAHZ-NSHDSACASA-N	311.341	4.526	5	20	DJBD	
CC[C@H](NCc1c(Cl)cccc1[N+](=O)[O-])c1cccs1	107904558	DRQWGFCAUYENNG-LBPRGKRZSA-N	310.806	4.551	5	20	DJBD	
C[C@H](Sc1ccc([N+](=O)[O-])cc1)c1nc2ccccc2o1	183454507	PVZQCZUDMBPLHE-JTQLQIEISA-N	300.339	4.589	5	20	DJBD	
Cc1ccccc1CSc1ccc2ncccc2c1[N+](=O)[O-]	480421999	SKFCTDKLCGHPDS-UHFFFAOYSA-N	310.378	4.744	5	20	DJBD	
CC[C@H](N[C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(F)cc1F	540339600	PISBYKZQECHDER-BZNIZROVSA-N	320.339	4.675	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)cc1CN1CCC[C@H]1c1ccsc1	746657364	GUKZSEPGTPVCBW-AWEZNQCLSA-N	322.817	4.647	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)Nc1cccc2ccncc12	538628228	PISOTHNHWGBAJN-CYBMUJFWSA-N	307.353	4.625	5	20	DJBD	
C[C@@H](N[C@H](C)c1ccccc1[N+](=O)[O-])c1cccc(C2CC2)c1	551103590	LYWYVEOVJALHTL-ZIAGYGMSSA-N	310.397	4.884	5	20	DJBD	
C[C@H](N[C@H]1CC(C)(C)c2ccccc21)c1ccc([N+](=O)[O-])cc1	536846351	QGAKLZXUVSRRHU-UGSOOPFHSA-N	310.397	4.668	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2C)s1	765303290	FMGHXPZMQFGPSE-OLZOCXBDSA-N	304.415	4.685	5	20	DJBD	
O=[N+]([O-])c1ccc(Sc2ccc(Cl)cc2)c2ccncc12	15175026	NOEOIYGIEIEWAU-UHFFFAOYSA-N	316.769	4.948	5	20	DJBD	
Cc1ccsc1CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	35232413	QLTZHPWCORNSIL-UHFFFAOYSA-N	316.304	4.596	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H](C)c2cccc(C)c2C)cc1[N+](=O)[O-]	531711630	KIOIOLHVMCBYJM-HZPDHXFCSA-N	312.413	4.932	5	20	DJBD	
C[C@H](SCc1csc(C2CC2)n1)c1ccccc1[N+](=O)[O-]	535396285	IWRKOGQKLSGEOQ-JTQLQIEISA-N	320.439	4.923	5	20	DJBD	
C[C@@H](SCc1nc(C2CC2)cs1)c1ccccc1[N+](=O)[O-]	541291086	NGRPPDXPAKZEMC-SNVBAGLBSA-N	320.439	4.923	5	20	DJBD	
C[C@@H](c1ccccc1[N+](=O)[O-])N1CC(C)(C)[C@H]1c1cccs1	561964944	WRHKQZPRXGGKMY-BLLLJJGKSA-N	316.426	4.800	5	20	DJBD	
C[C@H](Nc1ccc2ccccc2c1)c1ccc(N)c([N+](=O)[O-])c1	788693062	UNWKPJNCGXSIEB-LBPRGKRZSA-N	307.353	4.503	5	20	DJBD	
O=[N+]([O-])c1ccc2sc(/C=C/c3cc(F)ccc3F)nc2c1	59269521	CTJVWUVTKFSSQE-LZCJLJQNSA-N	318.304	4.653	5	20	DJBD	
O=[N+]([O-])c1cc2ccccc2nc1Oc1ccc(Cl)cc1F	473516245	AQNTXGCCZVRNFI-UHFFFAOYSA-N	318.691	4.728	5	20	DJBD	
CC[C@@H](Sc1ccc([N+](=O)[O-])cn1)c1ccc(F)cc1F	532587756	WYMFAVMBVAOAAV-CYBMUJFWSA-N	310.325	4.511	5	20	DJBD	
CC(C)c1ccc(CNCc2coc3ccccc23)cc1[N+](=O)[O-]	559303493	XKCVCKPVRLWRMO-UHFFFAOYSA-N	324.380	4.754	5	20	DJBD	
CCC1(O)CCN(Cc2c3ccccc3cc3ccccc23)CC1	769484591	KUAAQNWWAWOPGV-UHFFFAOYSA-N	319.448	4.730	5	20	DJBD	
CC(C)Oc1ccc([C@@H](C)Nc2ccc([N+](=O)[O-])cc2)cc1	315256742	WPPOAWKMLNFQDN-CYBMUJFWSA-N	300.358	4.555	5	20	DJBD	
Cc1cnc(Oc2ccc(Cc3ccccc3)cc2)c([N+](=O)[O-])c1	463055551	TWWWXUPDWKYUAR-UHFFFAOYSA-N	320.348	4.681	5	20	DJBD	
COc1ccc([N+](=O)[O-])cc1CSc1cccc(Cl)c1	523865973	QXDCWFATCHLMLZ-UHFFFAOYSA-N	309.774	4.549	5	20	DJBD	
CC(C)Oc1cccc([C@@H](C)Nc2ccc([N+](=O)[O-])cc2F)c1	603860635	QUPFFIWZGJJAOJ-GFCCVEGCSA-N	318.348	4.694	5	20	DJBD	
O=[N+]([O-])c1ccc(F)cc1CNc1cc(Cl)cc(Cl)c1	35308042	HQOOXWLPBCXQHJ-UHFFFAOYSA-N	315.131	4.653	5	20	DJBD	
O=C(c1cc2ccccc2c2cccnc12)N1Cc2ccccc2C1	357692744	XEMBBLJHCXDOOI-UHFFFAOYSA-N	324.383	4.544	5	20	DJBD	
Cc1ccc2c(c1)[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1C)CC2	611335764	ZTLRZHIIQCRECG-KSSFIOAISA-N	310.397	4.550	5	20	DJBD	
Cc1ccccc1C(C)(C)NCc1ccc([N+](=O)[O-])c(Cl)c1	816644069	AWMXRBKSYVEHJU-UHFFFAOYSA-N	318.804	4.582	5	20	DJBD	
C[C@@H](Nc1ccccc1[N+](=O)[O-])c1ccc(Br)cc1	25844599	FWAJJLUHYPGNSV-SNVBAGLBSA-N	321.174	4.530	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1CNc1ccc(F)cc1Cl	50443344	DVDBZKMPCWHAOE-UHFFFAOYSA-N	315.131	4.653	5	20	DJBD	
C[C@H](Sc1ccc([N+](=O)[O-])cn1)c1ccc(F)c(Cl)c1	448097463	OGIWFPXCSTXGOA-QMMMGPOBSA-N	312.753	4.636	5	20	DJBD	
C[C@@H](c1cccs1)N(C)Cc1ccc([N+](=O)[O-])cc1Cl	541064123	DMLFDGLXZIHLLT-JTQLQIEISA-N	310.806	4.503	5	20	DJBD	
CC[C@H](N[C@@H]1CCc2ccc(C)cc21)c1cccc([N+](=O)[O-])c1	610831225	UTCYMGOCXCHZCI-RBUKOAKNSA-N	310.397	4.631	5	20	DJBD	
Cc1cccc(/C=C(/Cl)c2nc3cc([N+](=O)[O-])ccc3o2)c1	751517838	OJLUUDRZMGUQHG-MDWZMJQESA-N	314.728	4.781	5	20	DJBD	
Cc1ccc2c(c1)CC[C@H]2N[C@@H]1CCCc2ccc([N+](=O)[O-])cc21	447530386	MNMJXHOHBIASAQ-WOJBJXKFSA-N	322.408	4.558	5	20	DJBD	
CC[C@@H](Nc1ccc([N+](=O)[O-])c(OC)c1)c1ccc(Cl)cc1	462927782	HNRFGSBUUGLXLI-CQSZACIVSA-N	320.776	4.820	5	20	DJBD	
Cc1cc(Oc2ccc(F)c3c2C(=O)C[C@H]3C)ccc1[N+](=O)[O-]	515540278	VRFBYPVZDRNIOL-SNVBAGLBSA-N	315.300	4.525	5	20	DJBD	
CCC[C@@H](Nc1ncc([N+](=O)[O-])cc1Cl)c1ccccc1	524580605	ZZCLHXGMVSLVQO-CQSZACIVSA-N	305.765	4.597	5	20	DJBD	
Cc1ccc2c(c1)CC[C@@H]2N[C@H](C)c1cccc([N+](=O)[O-])c1C	536825194	FNAMVLXVVSUIPP-KDOFPFPSSA-N	310.397	4.550	5	20	DJBD	
CC(=O)c1cc(NCc2ccc(C3CCC3)cc2)ccc1[N+](=O)[O-]	553582610	BNLFJYVWWLDHLG-UHFFFAOYSA-N	324.380	4.677	5	20	DJBD	
C[C@@H](CCO)NCc1c2ccccc2c(Cl)c2ccccc12	738436789	ZBXOVRBNKOZJNC-ZDUSSCGKSA-N	313.828	4.507	5	20	DJBD	
O=[N+]([O-])c1cc(F)ccc1Oc1cccc(C(F)(F)F)c1	60846369	VXTMMODAUJDUQM-UHFFFAOYSA-N	301.195	4.545	5	20	DJBD	
O=[N+]([O-])c1ccc(-c2nc(-c3ccc(F)c(F)c3)cs2)cc1	71971774	DUDNKWMJXXOIPR-UHFFFAOYSA-N	318.304	4.664	5	20	DJBD	
COCc1cc([N+](=O)[O-])ccc1NCc1cccc2ccccc12	301434349	IPVUHMWJUVDFCQ-UHFFFAOYSA-N	322.364	4.507	5	20	DJBD	
CSc1cccc(NCc2cccc([N+](=O)[O-])c2C)c1C	539238279	FDXNDSIGTOXAJS-UHFFFAOYSA-N	302.399	4.546	5	20	DJBD	
Cc1c(CN(C)[C@H](C)c2cc3ccccc3o2)cccc1[N+](=O)[O-]	558724786	GTRHFHAWIGIBIW-CQSZACIVSA-N	324.380	4.842	5	20	DJBD	
Cc1cc(N[C@H](C)c2cccc(OC(C)C)c2)ccc1[N+](=O)[O-]	603860376	GSQIIOXZXQOECI-CQSZACIVSA-N	314.385	4.864	5	20	DJBD	
CSc1ccc([C@@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1	192756318	DJIBSZJAHXBMOK-CHWSQXEVSA-N	316.426	4.729	5	20	DJBD	
CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CCCC(C)(C)C	504300055	SLXBYTJEZZFOKX-UHFFFAOYSA-N	320.433	4.548	5	20	DJBD	
Cc1cc2cc([C@@H](C)NCc3ccccc3[N+](=O)[O-])oc2cc1C	540192330	DULJIPPBXNWXNI-CQSZACIVSA-N	324.380	4.809	5	20	DJBD	
CCCCCN(CCCCC)C(=O)c1ccc([N+](=O)[O-])cc1F	603965157	ZWTKYYPOQFQSKJ-UHFFFAOYSA-N	324.396	4.557	5	20	DJBD	
CCSc1cccc(NCc2ccc(Cl)cc2[N+](=O)[O-])c1	864011510	HBFPZRPOBQTBBE-UHFFFAOYSA-N	322.817	4.972	5	20	DJBD	
CC(=O)c1ccc(N[C@@H](C)c2cc3ccccc3o2)c([N+](=O)[O-])c1	7365755	UXXTXDGQGMHOGY-NSHDSACASA-N	324.336	4.717	5	20	DJBD	
Cc1cccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1C	139784371	PYCCLLCRZGCNKH-UHFFFAOYSA-N	319.748	4.509	5	20	DJBD	
CSCc1cccc(N[C@H](C)c2cccc([N+](=O)[O-])c2)c1	537530076	KDYVUVUJYDFROR-GFCCVEGCSA-N	302.399	4.631	5	20	DJBD	
CC(C)c1ccc(CNC2(c3ccccc3)CCC2)cc1[N+](=O)[O-]	604532688	RGGSBZDGNSFYQY-UHFFFAOYSA-N	324.424	4.887	5	20	DJBD	
Cc1cc(F)ccc1[C@H](C)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1	815595014	FVFHYWQAMFCNLB-KGLIPLIRSA-N	316.376	4.763	5	20	DJBD	
Cc1ccc([C@H](C)NCc2cc(F)ccc2Cl)cc1[N+](=O)[O-]	189346723	SZEWJDIBJAACEY-NSHDSACASA-N	322.767	4.547	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H](c2ccccc2)C2CC2)cc1[N+](=O)[O-]	192796402	ZJRDIPLTXMBNQA-AUUYWEPGSA-N	310.397	4.705	5	20	DJBD	
Cc1ccc(CNC(C)(C)c2cccc(Cl)c2)cc1[N+](=O)[O-]	237730400	KTMKSFWZRAWJFX-UHFFFAOYSA-N	318.804	4.582	5	20	DJBD	
CC(C)[C@@H]1C[C@H](NCc2ccc([N+](=O)[O-])cc2)c2ccccc21	447581818	WJIURVFDRULGGO-OALUTQOASA-N	310.397	4.569	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1Oc1nc2ccccc2s1	25370569	DWVSYWOLCHNXNM-UHFFFAOYSA-N	306.730	4.650	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1ccc(F)c(Cl)c1	531961781	ITUZSURAXGYIBE-LLVKDONJSA-N	322.767	4.547	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)cc1Oc1ccc2cccnc2c1	804680121	NHUMJWARHUXFTQ-UHFFFAOYSA-N	300.701	4.589	5	20	DJBD	
O=[N+]([O-])c1ccccc1OCc1csc(C2CCCCC2)n1	60801710	LCTROXFQQOBCNT-UHFFFAOYSA-N	318.398	4.678	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H]2CCCc3sccc32)cc1[N+](=O)[O-]	102196737	NZIUHXNDNJKDLD-WFASDCNBSA-N	316.426	4.693	5	20	DJBD	
CC[C@@H](C)[C@@H](C)NC(=O)c1cc2ccccc2c2cccnc12	195646054	RQSRBLPHBPFJAK-ZIAGYGMSSA-N	306.409	4.552	5	20	DJBD	
CCN(CCC1CC1)C(=O)c1cc2ccccc2c2cccnc12	546866060	ARGCRZNULYCMFF-UHFFFAOYSA-N	318.420	4.650	5	20	DJBD	
COc1ccc(NCc2cccc([N+](=O)[O-])c2C)c2ccccc12	864032032	AMDJTQGQBAYXDZ-UHFFFAOYSA-N	322.364	4.677	5	20	DJBD	
C[C@H](c1ccco1)N(Cc1ccc(Cl)cc1[N+](=O)[O-])C1CC1	440901475	MQNATKDMEYRUFT-LLVKDONJSA-N	320.776	4.567	5	20	DJBD	
Cc1cc2occ(C(=O)Nc3cccc([N+](=O)[O-])c3C)c2cc1C	472231027	IDURQLRPZDOOQV-UHFFFAOYSA-N	324.336	4.519	5	20	DJBD	
C[C@H]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)[C@H]1C	525548789	HPVDMCDMVYEPCE-GJZGRUSLSA-N	318.420	4.649	5	20	DJBD	
Cc1ccccc1[C@@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)C1CC1	531717387	QUYKPWHFMZHZOX-KUHUBIRLSA-N	310.397	4.705	5	20	DJBD	
O=C(OCc1nc2ccccc2c2ccccc12)[C@H]1CC12CCC2	759985188	YLWOPGMCSOGUID-QGZVFWFLSA-N	317.388	4.621	5	20	DJBD	
Cc1ccccc1[C@H](NCc1ccc([N+](=O)[O-])c(F)c1)C(C)C	790079263	AGVBBDIVGLPCPF-GOSISDBHSA-N	316.376	4.529	5	20	DJBD	
C[C@@H](Sc1ncnc2sc([N+](=O)[O-])cc12)c1cccs1	804476984	QTZDLHSMCGIAJQ-SSDOTTSWSA-N	323.424	4.514	5	20	DJBD	
C[C@@H](c1ccco1)N(Cc1c(Cl)cccc1[N+](=O)[O-])C1CC1	492060102	INMFJDNCVHSCKL-NSHDSACASA-N	320.776	4.567	5	20	DJBD	
O=[N+]([O-])c1ccsc1Oc1ccc(Oc2ccccc2)nc1	617481764	MADQMZVAUOGNOT-UHFFFAOYSA-N	314.322	4.636	5	20	DJBD	
C[C@H](N[C@H](C)c1cc2ccccc2o1)c1cccc([N+](=O)[O-])c1	152772892	MCRDJNBKYCRYFC-QWHCGFSZSA-N	310.353	4.753	5	20	DJBD	
CCOc1ccccc1N[C@@H](CC)c1cccc([N+](=O)[O-])c1	195548076	FSVSUNBSUJDWFW-HNNXBMFYSA-N	300.358	4.557	5	20	DJBD	
COc1cc(Cl)c(C)cc1N[C@H](C)c1ccccc1[N+](=O)[O-]	314414006	WMEZKCHWSCKCRY-LLVKDONJSA-N	320.776	4.738	5	20	DJBD	
Cc1cc(C)c2cc(CN[C@H](C)c3cccc([N+](=O)[O-])c3)[nH]c2c1	479547135	BDLXUVWBXRNMOM-CQSZACIVSA-N	323.396	4.544	5	20	DJBD	
COc1ccc(CS[C@H](C)c2ccc(F)cc2)cc1[N+](=O)[O-]	521020418	KSXGFYXBEGHEKM-LLVKDONJSA-N	321.373	4.737	5	20	DJBD	
Cc1c(NCc2csc([N+](=O)[O-])c2)cccc1C(F)(F)F	760464608	HGHQPLGPROASHL-UHFFFAOYSA-N	316.304	4.596	5	20	DJBD	
Cc1cc([C@@H](C)NCc2ccc(Cl)c([N+](=O)[O-])c2)c(C)s1	73649975	STNROOOGDQTQPY-SNVBAGLBSA-N	324.833	4.777	5	20	DJBD	
COc1ccc(SCc2ccc(Cl)cc2[N+](=O)[O-])cc1	501147749	KEJNOZVBGVDUCE-UHFFFAOYSA-N	309.774	4.549	5	20	DJBD	
Cc1cc(NCc2ccc(-c3ccncc3)cc2)ccc1[N+](=O)[O-]	514182059	HLZQGOUDULEDFV-UHFFFAOYSA-N	319.364	4.577	5	20	DJBD	
Cc1c(CNc2cccc(CC(F)(F)F)c2)cccc1[N+](=O)[O-]	172938185	IATKVHPZDGSJPQ-UHFFFAOYSA-N	324.302	4.620	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1	447530090	LYIGDHJNZRFGKU-KUHUBIRLSA-N	310.397	4.631	5	20	DJBD	
Cc1c([C@H](C)N[C@@H](c2ccccc2)C(C)C)cccc1[N+](=O)[O-]	480162297	KZXMTLQPEYUURN-HNAYVOBHSA-N	312.413	4.951	5	20	DJBD	
C[C@@H]1OCC[C@@H]1SCc1nc2ccccc2c2ccccc12	549929802	SCOYNHZCXUONCX-DJJJIMSYSA-N	309.434	4.799	5	20	DJBD	
Cc1c(CNc2ccccc2CC(F)(F)F)cccc1[N+](=O)[O-]	172929382	CLVKQGAEHRJEAQ-UHFFFAOYSA-N	324.302	4.620	5	20	DJBD	
C[C@@H](NCc1cc(F)ccc1[N+](=O)[O-])c1cccc2ccccc12	181655638	JBOQQASTIVJNLP-CYBMUJFWSA-N	324.355	4.738	5	20	DJBD	
Cc1ccc2[nH]c(CN[C@@H](C)c3cccc([N+](=O)[O-])c3)cc2c1C	472053609	IITABLFKVULRDI-AWEZNQCLSA-N	323.396	4.544	5	20	DJBD	
Cc1ncccc1NC(=O)c1c2ccccc2cc2ccccc12	746528739	FLEURTHUEWCLAL-UHFFFAOYSA-N	312.372	4.949	5	20	DJBD	
CCSc1cccc(NCc2cccc([N+](=O)[O-])c2C)c1	864011614	LZJCJECYPNKBRD-UHFFFAOYSA-N	302.399	4.627	5	20	DJBD	
C[C@H](NCc1cccc2ccccc12)c1ccc([N+](=O)[O-])cc1	195260167	RZRMVPSQBNMOTO-AWEZNQCLSA-N	306.365	4.599	5	20	DJBD	
C[C@H](NC/C=C/c1ccccc1[N+](=O)[O-])c1cc2ccccc2o1	237516486	BQLZDDFOPRYHKB-MRZGDXHCSA-N	322.364	4.705	5	20	DJBD	
CN(C(=O)c1ccc(C2CCCC2)cc1)c1ccc([N+](=O)[O-])cc1	463286021	JZLPPIOKADUVJE-UHFFFAOYSA-N	324.380	4.529	5	20	DJBD	
O=[N+]([O-])c1c(Sc2ccc(F)cc2F)ccc2ncccc12	480379606	VTSHZNGBXFEBFD-UHFFFAOYSA-N	318.304	4.572	5	20	DJBD	
C[C@H](Nc1ccc(F)c(C2CC2)c1)c1ccccc1[N+](=O)[O-]	507468660	HOWCEAHVJOOZCB-NSHDSACASA-N	300.333	4.784	5	20	DJBD	
Cc1ncccc1COc1ccc(-c2ccccc2)cc1[N+](=O)[O-]	589263654	TVWHJBLKWABZDM-UHFFFAOYSA-N	320.348	4.544	5	20	DJBD	
O=C(OCc1cscn1)c1c2ccccc2cc2ccccc12	747919029	BJXNWJAAGCLRQK-UHFFFAOYSA-N	319.385	4.807	5	20	DJBD	
O=[N+]([O-])c1ccccc1/C=C/C=C/c1ccc2ccccc2n1	303132990	PQSUUGCLVCCXTK-GNCHRIMZSA-N	302.333	4.870	5	20	DJBD	
COc1ccccc1S[C@@H](C)c1cc([N+](=O)[O-])ccc1C	484494119	XZYDJWGUIZJXNX-LBPRGKRZSA-N	303.383	4.765	5	20	DJBD	
CSc1ccc(C)c(NCc2cccc([N+](=O)[O-])c2C)c1	537319487	UNJICPVTRKOPOK-UHFFFAOYSA-N	302.399	4.546	5	20	DJBD	
COc1ccc(CSCc2cc(C)sc2C)cc1[N+](=O)[O-]	609237351	WVRSELDZPILCMD-UHFFFAOYSA-N	323.439	4.715	5	20	DJBD	
O=[N+]([O-])c1ccc2oc(/C(Cl)=C/c3cccs3)nc2c1	177617871	XFOPKVVKFJQTIJ-YFHOEESVSA-N	306.730	4.534	5	20	DJBD	
Cc1cnc([C@@H](Nc2ccc([N+](=O)[O-])cc2Cl)C2CC2)s1	301370084	SBSCEUXMZMSEQC-ZDUSSCGKSA-N	323.805	4.576	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1NCc1ccccc1C(F)(F)F	302893562	DTDNPNRVHHCCQW-UHFFFAOYSA-N	310.275	4.534	5	20	DJBD	
Cc1ccccc1[C@@H](NCc1ccc(C)c([N+](=O)[O-])c1)C(C)C	482159383	OTULITJGCDVRLZ-IBGZPJMESA-N	312.413	4.699	5	20	DJBD	
C[C@@H](CSCc1c(Cl)cccc1[N+](=O)[O-])C(F)(F)F	490913920	TUFYKNJWSKMPCA-ZETCQYMHSA-N	313.728	4.680	5	20	DJBD	
O=[N+]([O-])c1ccc(CN2CCC[C@@H]2c2ccsc2)c(Cl)c1	541069413	BGGKSBIQQZECQF-OAHLLOKOSA-N	322.817	4.647	5	20	DJBD	
O=[N+]([O-])c1ccc(SCc2cc(-c3cccs3)on2)cc1	609900716	IIDPXHKKKMHXMM-UHFFFAOYSA-N	318.379	4.604	5	20	DJBD	
CC[C@H](NCc1ccc([N+](=O)[O-])cc1)c1cccc2ccccc12	615085677	FREPJXJDFUGACI-FQEVSTJZSA-N	320.392	4.989	5	20	DJBD	
C[C@H](N[C@H](C)c1ccccc1Cl)c1cccc([N+](=O)[O-])c1	20015692	SBSVRGNNKJYZMS-NWDGAFQWSA-N	304.777	4.660	5	20	DJBD	
COc1cccc(CSc2ccc([N+](=O)[O-])cc2Cl)c1	64550194	WTVNQCNRLCTIHM-UHFFFAOYSA-N	309.774	4.549	5	20	DJBD	
Cc1ccc2cc([C@@H](C)NCc3cccc([N+](=O)[O-])c3C)oc2c1	426061721	VIEUPCKVMMCRSE-CQSZACIVSA-N	324.380	4.809	5	20	DJBD	
Cc1ccc2c(c1)CC[C@@H]2N[C@@H](C)c1cc([N+](=O)[O-])ccc1C	539042164	VWDQSIKVVRPIQH-LIRRHRJNSA-N	310.397	4.550	5	20	DJBD	
Cc1cccc2c1CC[C@H]2NCc1ccc(C(C)C)c([N+](=O)[O-])c1	609223761	VXGBRUNIZUTAMN-LJQANCHMSA-N	324.424	4.804	5	20	DJBD	
CC[C@](C)(NCc1cc([N+](=O)[O-])ccc1Cl)c1ccccc1	730817786	VMYJWXACBQHNNN-KRWDZBQOSA-N	318.804	4.663	5	20	DJBD	
Cc1ccc(CN[C@H]2CCC(C)(C)c3ccccc32)cc1[N+](=O)[O-]	609223641	VYQHSQWQHSKFPK-SFHVURJKSA-N	324.424	4.806	5	20	DJBD	
Cc1c(CSCc2csc(C(C)C)n2)cccc1[N+](=O)[O-]	609236554	DDZNYVVEXZSOPI-UHFFFAOYSA-N	322.455	4.917	5	20	DJBD	
CCCCCC[C@@H](C)C(=O)Nc1c(F)ccc([N+](=O)[O-])c1C	800147392	NECIELFEKHKHRF-LLVKDONJSA-N	310.369	4.587	5	20	DJBD	
C[C@@H](SCc1cccc([N+](=O)[O-])c1)c1cc(F)ccc1F	195539644	FHLRABLQBOAJHK-SNVBAGLBSA-N	309.337	4.867	5	20	DJBD	
CCC[C@H](NCc1ccccc1Cl)c1cccc([N+](=O)[O-])c1	314337899	JWRRCJYPDLKDNC-KRWDZBQOSA-N	318.804	4.879	5	20	DJBD	
O=[N+]([O-])c1cccnc1SCc1cc(Cl)ccc1Cl	525630903	JZFYBLAJIRXAAR-UHFFFAOYSA-N	315.181	4.589	5	20	DJBD	
Cc1ccc(C[C@@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2C)s1	531713031	YHVBFPYCLCOKTP-RISCZKNCSA-N	318.442	4.555	5	20	DJBD	
O=[N+]([O-])c1ccc(CN2CCC[C@@H]2c2cccs2)c(Cl)c1	542923405	FFEIMFHBWJTFLR-CQSZACIVSA-N	322.817	4.647	5	20	DJBD	
CC[C@@H](C)n1ncc(N[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1C	564773008	GIVGTUKROUMDFH-OLZOCXBDSA-N	316.405	4.552	5	20	DJBD	
CCc1ccc(CNc2ccc(C(F)F)cc2[N+](=O)[O-])s1	314189924	SFRWEEKAANDJOL-UHFFFAOYSA-N	312.341	4.768	5	20	DJBD	
CCOc1cc(N[C@H](C)CCCC(F)(F)F)ccc1[N+](=O)[O-]	493637493	YDTRRYVHLIILKX-SNVBAGLBSA-N	320.311	4.527	5	20	DJBD	
Cc1cccc(OCc2csc(C3CCCC3)n2)c1[N+](=O)[O-]	535121451	YEOOIPUMVWYJJR-UHFFFAOYSA-N	318.398	4.596	5	20	DJBD	
Cc1ccc([C@@H](NCc2ccc([N+](=O)[O-])cc2)C2CCCC2)o1	537191576	OIOWKLRBHILKAR-SFHVURJKSA-N	314.385	4.517	5	20	DJBD	
C[C@@H](NCc1ccc2sccc2c1)c1cccc([N+](=O)[O-])c1	581517887	CBHMUXVSWIBHKA-GFCCVEGCSA-N	312.394	4.660	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)cnc1Oc1ccc(Cl)c(Cl)c1	301755640	XQTTZZRIPQZBOW-UHFFFAOYSA-N	319.531	4.742	5	20	DJBD	
CCCOc1cccc(N[C@H](C)c2ccc([N+](=O)[O-])cc2)c1	315426236	KERSLFOLVWNFHS-CYBMUJFWSA-N	300.358	4.557	5	20	DJBD	
CC(C)Oc1ccccc1[C@@H](C)Nc1ccc([N+](=O)[O-])cc1F	603861951	IGHCLMARNCBLOC-GFCCVEGCSA-N	318.348	4.694	5	20	DJBD	
C[C@@H]1CSCCN1C(=O)c1c2ccccc2cc2ccccc12	746524389	PBSMYWQPVOBCMF-CQSZACIVSA-N	321.445	4.571	5	20	DJBD	
CCC[C@@H](NCc1c(C)cccc1F)c1cccc([N+](=O)[O-])c1	766214648	YOVBTMIPTMKEEG-GOSISDBHSA-N	316.376	4.673	5	20	DJBD	
OCC[C@@H]1CCC[C@@H]1NCc1c2ccccc2cc2ccccc12	778216433	NSCJHDRJXIZQMB-AOMKIAJQSA-N	319.448	4.634	5	20	DJBD	
O=Cc1ccc(Oc2c(Cl)cc([N+](=O)[O-])cc2Cl)cc1	50440515	QBLWJAVQCYWKGO-UHFFFAOYSA-N	312.108	4.506	5	20	DJBD	
O=[N+]([O-])c1ccc2oc(/C(Cl)=C\c3cccs3)nc2c1	255524205	XFOPKVVKFJQTIJ-JXMROGBWSA-N	306.730	4.534	5	20	DJBD	
Cc1ccnc(N[C@H](C)c2oc3ccccc3c2C)c1[N+](=O)[O-]	301294500	OSMAJIVVDGSCJH-GFCCVEGCSA-N	311.341	4.526	5	20	DJBD	
Cc1ccc([C@H](C)Nc2cccc(OC(F)F)c2)cc1[N+](=O)[O-]	320165990	YHMLFSCUMFTVQN-NSHDSACASA-N	322.311	4.678	5	20	DJBD	
Cc1cc(Cl)ccc1CNC(C)(C)c1ccc([N+](=O)[O-])cc1	463739998	RFSZTAYHZBWVJX-UHFFFAOYSA-N	318.804	4.582	5	20	DJBD	
CC(C)c1ccccc1OC(=O)c1ccc(Cl)c([N+](=O)[O-])c1	504919	GCBNLHGYHFFTDI-UHFFFAOYSA-N	319.744	4.591	5	20	DJBD	
Cc1ccc(Cl)cc1NCc1ccc(Cl)cc1[N+](=O)[O-]	50442974	IOHBKRZBFMAJPU-UHFFFAOYSA-N	311.168	4.822	5	20	DJBD	
Oc1cc(Cl)cc(-c2nc(O)c3cc4ccccc4cc3n2)c1	487496884	AMLYXGUYTSADAA-UHFFFAOYSA-N	322.751	4.515	5	20	DJBD	
Cc1c([C@H](C)Nc2ccc3scnc3c2)cccc1[N+](=O)[O-]	488484602	UZSMCUTUKSCNBP-NSHDSACASA-N	313.382	4.686	5	20	DJBD	
Clc1c2ccccc2c(CNCc2cocn2)c2ccccc12	730819227	RIVCYNNPAPCIFC-UHFFFAOYSA-N	322.795	4.924	5	20	DJBD	
CCc1cc(CNCc2c3ccccc3cc3ccccc23)on1	741258913	RBOWVXKDGPOHFK-UHFFFAOYSA-N	316.404	4.833	5	20	DJBD	
CSc1ccccc1[C@@H](C)Nc1ccc([N+](=O)[O-])cc1F	864016969	FETXQUBVVLHOQE-SNVBAGLBSA-N	306.362	4.629	5	20	DJBD	
Cc1ccsc1[C@@H](C)NCCc1ccc(Cl)cc1[N+](=O)[O-]	495415425	PWRQFMJDMJSRFX-LLVKDONJSA-N	324.833	4.511	5	20	DJBD	
CC(C)[C@@H](NCc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1	315538637	WAKGSSQTRAXOQV-QGZVFWFLSA-N	318.804	4.735	5	20	DJBD	
Cc1cc(N[C@@H](C)c2ccc(OC(F)F)cc2)ccc1[N+](=O)[O-]	321628558	VIJCBNBTZWIRHY-NSHDSACASA-N	322.311	4.678	5	20	DJBD	
CCCc1nc(CS[C@@H](C)c2ccccc2[N+](=O)[O-])cs1	437268960	QFLFUYBRTJTWIG-NSHDSACASA-N	322.455	4.998	5	20	DJBD	
C[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1cccc(C2CC2)c1	550620377	ZWQWLNIWSXNHNG-UONOGXRCSA-N	310.397	4.884	5	20	DJBD	
CCCC[C@H](CC)C(=O)Nc1cc([N+](=O)[O-])c(Cl)cc1C	741934913	QNWCMCAIGNVJPV-NSHDSACASA-N	312.797	4.712	5	20	DJBD	
Cc1cscc1NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1	439604058	PAZVVQIWUGLTRA-UHFFFAOYSA-N	318.398	4.515	5	20	DJBD	
CC(C)Oc1cc(F)ccc1N[C@H](C)c1ccccc1[N+](=O)[O-]	484967016	BIVNPYPMGDUTGZ-GFCCVEGCSA-N	318.348	4.694	5	20	DJBD	
CC(=O)c1cc(N[C@H]2CC(C)(C)c3ccccc32)ccc1[N+](=O)[O-]	569914257	CFDMMXCHRMAODR-KRWDZBQOSA-N	324.380	4.632	5	20	DJBD	
C[C@H](CC1CCCCC1)c1nnc(-c2cccc([N+](=O)[O-])c2)o1	1117204148	WDMRQJNAHJSZSP-GFCCVEGCSA-N	315.373	4.719	5	20	DJBD	
O=[N+]([O-])c1ccc(CSc2cccc(Br)c2)cc1	78460843	PQTIHXXGGPNHFM-UHFFFAOYSA-N	324.199	4.650	5	20	DJBD	
CC[C@@H](N[C@H]1CCCc2ccccc21)c1cccc([N+](=O)[O-])c1	195548122	LQSYDPJUAOTBRC-MOPGFXCFSA-N	310.397	4.713	5	20	DJBD	
C[C@@H](Nc1ncc([N+](=O)[O-])s1)c1ccc(Cl)cc1Cl	226769239	JBHXMMDNMSSZLF-ZCFIWIBFSA-N	318.185	4.531	5	20	DJBD	
Cc1nc(N[C@H](C)c2cccc3ccccc23)ccc1[N+](=O)[O-]	301625018	GUQRPJLXQIKGED-GFCCVEGCSA-N	307.353	4.625	5	20	DJBD	
CC[C@@H](C)n1ncc(N[C@@H](C)c2cccc([N+](=O)[O-])c2C)c1C	477929364	RIMOHAFVURLCSA-YPMHNXCESA-N	316.405	4.552	5	20	DJBD	
C[C@H](SCCOc1ccccc1[N+](=O)[O-])c1cccc(F)c1	517178034	OYUNOQBUAMSISY-LBPRGKRZSA-N	321.373	4.607	5	20	DJBD	
CSC1(CNC(=O)c2c3ccccc3cc3ccccc23)CC1	791011996	GNMNOONOIQDLIK-UHFFFAOYSA-N	321.445	4.618	5	20	DJBD	
Cc1oc(C(C)C)cc1C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	808012825	JOWOQGQAMPRBSV-UHFFFAOYSA-N	322.748	4.525	5	20	DJBD	
Cc1ccc(NCc2cccc([N+](=O)[O-])c2)cc1C(F)(F)F	387050767	PYVVJIOJJZBHLM-UHFFFAOYSA-N	310.275	4.534	5	20	DJBD	
O=[N+]([O-])c1ccc(CSc2cccc3cccnc23)c(F)c1	476484498	NZULIYPJCPMPTA-UHFFFAOYSA-N	314.341	4.574	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H](C)CCCC(F)(F)F)cc1[N+](=O)[O-]	480215583	RVSGTMBGEDJFPY-VXGBXAGGSA-N	318.339	4.675	5	20	DJBD	
CC[C@H](N[C@H](C)c1ccccc1[N+](=O)[O-])c1cc(F)ccc1F	537094406	CRYHSDFGVIXOCS-BZNIZROVSA-N	320.339	4.675	5	20	DJBD	
C[C@@H](NCc1cccc([N+](=O)[O-])c1)c1csc2ccccc12	731451830	HKZQZAABMCFZEQ-GFCCVEGCSA-N	312.394	4.660	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1	49159201	UVNXDXDXINMCTR-CHWSQXEVSA-N	304.415	4.685	5	20	DJBD	
C[C@@H](N[C@H](c1ccccc1)C1CCC1)c1ccccc1[N+](=O)[O-]	72608738	DXUOQEWIRHCKKS-AUUYWEPGSA-N	310.397	4.787	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1Oc1nc(C(F)(F)F)cs1	301738672	SOOZAHCWOIUQMC-UHFFFAOYSA-N	324.667	4.516	5	20	DJBD	
CC(C)Oc1ccc([N+](=O)[O-])cc1CNc1ccccc1Cl	462215606	QWLNCTVNTBBBNO-UHFFFAOYSA-N	320.776	4.648	5	20	DJBD	
Cc1cc(C)c(CN[C@H](C)c2cccc([N+](=O)[O-])c2C)c(C)c1	532498734	CKSLPMPHVAXKSS-MRXNPFEDSA-N	312.413	4.679	5	20	DJBD	
Cc1cccc2c1CC[C@@H]2Nc1ccc([N+](=O)[O-])c2cccnc12	609192844	KWXNTEGTSSDKGY-INIZCTEOSA-N	319.364	4.551	5	20	DJBD	
Cc1ccc(C2=CCN([C@H](C)c3ccccc3[N+](=O)[O-])CC2)cc1	743836367	UYDLILPJACIEDS-MRXNPFEDSA-N	322.408	4.754	5	20	DJBD	
Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C[C@H](C)C1CCCCC1	800148127	XXCFZJAKLBLTPA-NSHDSACASA-N	322.380	4.587	5	20	DJBD	
C[C@H](Nc1ncc([N+](=O)[O-])cc1Cl)c1cc2ccccc2o1	301270265	JNMFCZOBLQSWNL-VIFPVBQESA-N	317.732	4.563	5	20	DJBD	
C/C(=C/c1cccc([N+](=O)[O-])c1)CNCc1ccc(Cl)s1	468641660	LZDPTHSEZVXUAQ-XFFZJAGNSA-N	322.817	4.503	5	20	DJBD	
Cc1ccccc1[C@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)C(C)C	531711646	LBONXRCWBDHRQT-HNAYVOBHSA-N	312.413	4.951	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2ccc(Oc3ccccc3)cc2)cn1	550328584	XNNGCULQXGYURJ-UHFFFAOYSA-N	308.293	4.574	5	20	DJBD	
CCCCCC[C@@H](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	728163382	OGAONRVMTPDTHU-CQSZACIVSA-N	306.406	4.554	5	20	DJBD	
Cc1cnc(COC(=O)c2c3ccccc3cc3ccccc23)o1	744490686	SGEOBWLBSJWEOZ-UHFFFAOYSA-N	317.344	4.646	5	20	DJBD	
O=[N+]([O-])c1ccccc1CNc1ccccc1OC1CCCC1	237941761	HTDFILGUURZJCE-UHFFFAOYSA-N	312.369	4.528	5	20	DJBD	
C[C@@H](Nc1ccc([N+](=O)[O-])cc1)c1ccc(-c2ccncc2)cc1	301418578	CXIVEHFOTMQXPA-CQSZACIVSA-N	319.364	4.830	5	20	DJBD	
Cc1ccccc1C(C)(C)NCc1ccc(Cl)cc1[N+](=O)[O-]	549867925	ICXNATRLGPVAFP-UHFFFAOYSA-N	318.804	4.582	5	20	DJBD	
O=[N+]([O-])c1cccc(CN2CCC[C@H]2c2ccc(Cl)cc2)c1	603497570	AVVAGHXHFSPVQZ-KRWDZBQOSA-N	316.788	4.585	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)cc1/C=C/c1nc2ccccc2o1	739426076	IJTWOTOPVKJYRG-VMPITWQZSA-N	300.701	4.560	5	20	DJBD	
CSc1cccc(C)c1NCc1ccc(Cl)cc1[N+](=O)[O-]	864025526	XKMTWLTZWMBQEG-UHFFFAOYSA-N	322.817	4.891	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)Sc1ncc(C(C)C)n1C	484692677	COSYFFABUXENLV-LBPRGKRZSA-N	319.430	4.613	5	20	DJBD	
CC(=O)c1cc(N[C@@H](c2ccccc2)C(C)C)ccc1[N+](=O)[O-]	518801638	WQJKPKJAGXSCOY-GOSISDBHSA-N	312.369	4.607	5	20	DJBD	
O=[N+]([O-])c1cnc(Nc2ccc(NC3CCCCC3)cc2)s1	619695510	YXIHBFRASZFFQH-UHFFFAOYSA-N	318.402	4.540	5	20	DJBD	
O=[N+]([O-])c1ccc(CN[C@H](c2cccs2)C2CC2)cc1Cl	783597349	BRRKZVJEHRZGNK-HNNXBMFYSA-N	322.817	4.551	5	20	DJBD	
C[C@@H](NCc1ccc([N+](=O)[O-])c(F)c1)c1cccc2ccccc12	801526664	VEJTZKZLLBGHEX-CYBMUJFWSA-N	324.355	4.738	5	20	DJBD	
CC(C)[C@H]1C[C@@H](NCc2ccc([N+](=O)[O-])cc2)c2ccccc21	447581820	WJIURVFDRULGGO-RTBURBONSA-N	310.397	4.569	5	20	DJBD	
O=[N+]([O-])c1ccc(SCc2coc(-c3cccs3)n2)cc1	27194849	GZYITIQZNCQWEY-UHFFFAOYSA-N	318.379	4.604	5	20	DJBD	
Cc1cc(C)c([C@@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1C	321075739	QMTAISFRMFNCQB-HZPDHXFCSA-N	312.413	4.932	5	20	DJBD	
O=[N+]([O-])c1ccc(N[C@@H]2CCCc3ccccc32)c2cccnc12	324369680	SYFULKMCKQDBGS-MRXNPFEDSA-N	319.364	4.633	5	20	DJBD	
C[C@@H](Nc1ccccc1C(C)(F)F)c1ccc([N+](=O)[O-])cc1	453290435	LYRMOMIVQNXFMG-LLVKDONJSA-N	306.312	4.880	5	20	DJBD	
Cc1ccnc(Oc2ccc3c(c2)[nH]c2ccccc23)c1[N+](=O)[O-]	734481860	ZMDDSFZPVWUHLV-UHFFFAOYSA-N	319.320	4.725	5	20	DJBD	
Cc1cnc(N[C@H](C)c2csc3ccccc23)c([N+](=O)[O-])c1	742429625	GWDWVUXAPFERJX-LLVKDONJSA-N	313.382	4.686	5	20	DJBD	
CN(Cc1ccco1)C(=O)c1c2ccccc2cc2ccccc12	746510198	WFKSREVHXGHIJD-UHFFFAOYSA-N	315.372	4.858	5	20	DJBD	
C[C@H](Nc1ccc(OCC2CC2)cc1)c1ccc([N+](=O)[O-])cc1	749840671	ODALHHWHXLPSNB-ZDUSSCGKSA-N	312.369	4.557	5	20	DJBD	
CC(C)Sc1ccccc1NCc1cc(F)ccc1[N+](=O)[O-]	760460834	IGPOEKBEAFQMLE-UHFFFAOYSA-N	320.389	4.847	5	20	DJBD	
CC[C@H](NCc1ccc(Cl)cc1[N+](=O)[O-])c1ccc(F)cc1	1325229391	ZMFHKTIIIQVYMA-HNNXBMFYSA-N	322.767	4.628	5	20	DJBD	
O=[N+]([O-])c1ccc(NCc2cc3ccccc3o2)c(Cl)c1	36970939	ATXMNJMUGUPCTK-UHFFFAOYSA-N	302.717	4.607	5	20	DJBD	
Cc1ccc(N[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1-c1ncco1	180007666	UKLYGWRNEBCIHI-CYBMUJFWSA-N	323.352	4.731	5	20	DJBD	
O=[N+]([O-])c1cc(F)ccc1Oc1ccc(-c2ccccc2)nc1	301936545	QJKNWBTVVUMNBM-UHFFFAOYSA-N	310.284	4.588	5	20	DJBD	
Cc1ccc(NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)cc1	477326263	VYYLTCRGYWBLJC-UHFFFAOYSA-N	308.337	4.775	5	20	DJBD	
Cc1cc2cc(CN[C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)ccc2[nH]1	556914295	FZXATFNUQRLOQW-AWEZNQCLSA-N	323.396	4.544	5	20	DJBD	
C[C@H](c1ccccc1)c1ccc(Oc2cccnc2[N+](=O)[O-])cc1	609143813	WJKMROPEKARNCH-CQSZACIVSA-N	320.348	4.934	5	20	DJBD	
CC(C)COc1cccc(N[C@@H](C)c2ccccc2[N+](=O)[O-])c1	322053000	BDWUUWXKIUFCMO-AWEZNQCLSA-N	314.385	4.803	5	20	DJBD	
Cc1nc(SC2CCC(C(F)(F)F)CC2)ccc1[N+](=O)[O-]	450867039	GVVVWZHGAUTCGT-UHFFFAOYSA-N	320.336	4.511	5	20	DJBD	
Cc1ccnc(SC2CCC(C(F)(F)F)CC2)c1[N+](=O)[O-]	450870340	LHGMTBKVRMJCKY-UHFFFAOYSA-N	320.336	4.511	5	20	DJBD	
Cc1cnc(S[C@H](C)c2ccc(Cl)cc2)c([N+](=O)[O-])c1	463054162	KWUBPPOEUDEPFQ-SNVBAGLBSA-N	308.790	4.805	5	20	DJBD	
C[C@@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccccc1Cl	517959832	HHUBNMWLYNSTQA-BZNIZROVSA-N	316.788	4.586	5	20	DJBD	
Cc1ccc2c(c1)[C@H](Nc1ccc3ncccc3c1[N+](=O)[O-])CC2	609288457	XMWJCZRTZYOFOT-QGZVFWFLSA-N	319.364	4.551	5	20	DJBD	
CC(=O)c1ccc(Oc2cc(Cl)ccc2[N+](=O)[O-])c(C)c1	804430454	PYYHIBCJANCXGJ-UHFFFAOYSA-N	305.717	4.552	5	20	DJBD	
C[C@H](NCc1ccccc1[N+](=O)[O-])c1ccc(C(C)(C)C)cc1	319751289	YZCFGXFRDXCRIN-AWEZNQCLSA-N	312.413	4.743	5	20	DJBD	
CCCOc1cc(C)ccc1N[C@@H](C)c1ccccc1[N+](=O)[O-]	321119031	CITOSJYNXGIQSC-AWEZNQCLSA-N	314.385	4.865	5	20	DJBD	
CC[C@@H](CN[C@H](C)c1cccc([N+](=O)[O-])c1C)CC(F)(F)F	414255571	FRMAZHIPBSRLAM-VXGBXAGGSA-N	318.339	4.532	5	20	DJBD	
Cc1c([C@@H](C)NCCc2ccc(Cl)s2)cccc1[N+](=O)[O-]	539093213	JVJIPAAMBYNZJB-LLVKDONJSA-N	324.833	4.511	5	20	DJBD	
CSc1ccc(CN[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1	563786325	MIVSHYQVWZVNNP-LLVKDONJSA-N	322.455	4.537	5	20	DJBD	
CC1(C)C[C@H](Nc2ccc([N+](=O)[O-])s2)c2ccc(F)cc2O1	610809000	RVGUSXWIRZTQDY-NSHDSACASA-N	322.361	4.510	5	20	DJBD	
C[C@@H](N[C@H](C)c1c(F)cccc1Cl)c1ccc([N+](=O)[O-])cc1	178661500	YINMQJMUDZREHJ-GHMZBOCLSA-N	322.767	4.799	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H](c2ccccc2)C2CC2)cc1[N+](=O)[O-]	192796387	ZJRDIPLTXMBNQA-LIRRHRJNSA-N	310.397	4.705	5	20	DJBD	
C[C@H](N[C@@H]1CCCCc2ccccc21)c1cccc([N+](=O)[O-])c1	321648333	QIMRGDXMAVYFSG-IFXJQAMLSA-N	310.397	4.713	5	20	DJBD	
CC[C@H](Nc1cnn([C@@H](C)CC)c1C)c1cccc([N+](=O)[O-])c1	477923076	NHZSZMGUIHZOLK-LRDDRELGSA-N	316.405	4.634	5	20	DJBD	
Cc1ccc(/C=C(\c2ccncc2)c2ccc([N+](=O)[O-])cc2)s1	502185852	XFFQHXOVTSMVNN-PDGQHHTCSA-N	322.389	4.949	5	20	DJBD	
C[C@H](N[C@@H]1c2ccccc2CC[C@@H]1C)c1ccc([N+](=O)[O-])cc1	560910578	UQMDSBAOHZHZCH-NJSLBKSFSA-N	310.397	4.569	5	20	DJBD	
CC(=O)c1cc(NCc2ccc3ccccc3c2)ccc1[N+](=O)[O-]	587519673	AHBXKVWGUWKTKQ-UHFFFAOYSA-N	320.348	4.563	5	20	DJBD	
O=[N+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3F)cs2)cc1	603951784	CPIOSGMWNCKCHS-UHFFFAOYSA-N	318.304	4.664	5	20	DJBD	
CSc1ccc(OCc2ccc(Cl)cc2[N+](=O)[O-])cc1	734834186	GUKJZDXGUNJYJN-UHFFFAOYSA-N	309.774	4.549	5	20	DJBD	
CC(C)(C)Cc1nnc(-c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)o1	1322509558	GOEOFQXEGRUKHT-UHFFFAOYSA-N	317.389	4.531	5	20	DJBD	
C[C@@H](Nc1ccc2oc(C3CC3)nc2c1)c1ccc([N+](=O)[O-])cc1	192744186	FZFVOKKXEIBHLH-LLVKDONJSA-N	323.352	4.787	5	20	DJBD	
COc1ccccc1[C@H](C)Sc1ncc([N+](=O)[O-])cc1Cl	463077107	FJIUBYRHHCOGBZ-VIFPVBQESA-N	324.789	4.505	5	20	DJBD	
Cc1ccc([C@@H](C)NCc2c(Cl)cccc2[N+](=O)[O-])c(C)c1	494804283	CCSIOTUMVYDEFE-CYBMUJFWSA-N	318.804	4.716	5	20	DJBD	
CC(C)c1ccc(CNc2cccc3cc[nH]c23)cc1[N+](=O)[O-]	547821943	VVKSCLOUZFHSHI-UHFFFAOYSA-N	309.369	4.812	5	20	DJBD	
O=[N+]([O-])c1cc(/C=C/c2nc(-c3ccccc3)cs2)ccc1O	28911957	MKSNVNLZAWLBAP-VQHVLOKHSA-N	324.361	4.594	5	20	DJBD	
C[C@H](NCc1ccc2ccccc2c1)c1cccc([N+](=O)[O-])c1	79723800	CCJXJQCDJWOYGZ-AWEZNQCLSA-N	306.365	4.599	5	20	DJBD	
C[C@H](N[C@@H](C)c1nccc2ccccc12)c1cccc([N+](=O)[O-])c1	562082642	SNJDSUWZWXJHPC-KBPBESRZSA-N	321.380	4.555	5	20	DJBD	
COc1ccc(CSc2ccc(C)cc2C)cc1[N+](=O)[O-]	603722466	OGHCMDPJEWQTJL-UHFFFAOYSA-N	303.383	4.513	5	20	DJBD	
O=[N+]([O-])c1ccccc1CN1CCC[C@H]1c1ccccc1Cl	603857417	RPLBSIWOAZPOJA-KRWDZBQOSA-N	316.788	4.585	5	20	DJBD	
CC(C)c1cccc(CNCc2cc(Cl)ccc2[N+](=O)[O-])c1	775342033	RSSPCBUQEZLUDG-UHFFFAOYSA-N	318.804	4.661	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1CNc1cc(Cl)ccc1F	50443388	OGZUZVILQCOXBK-UHFFFAOYSA-N	315.131	4.653	5	20	DJBD	
Cc1c([C@H](C)N[C@@H](C)CCCC(F)(F)F)cccc1[N+](=O)[O-]	426060208	QXLYPGVRXULUFS-JQWIXIFHSA-N	318.339	4.675	5	20	DJBD	
CCCCCOc1ccc(Oc2ncc(C)cc2[N+](=O)[O-])cc1	463052729	GCFIGQOCIJDQTK-UHFFFAOYSA-N	316.357	4.660	5	20	DJBD	
Cc1noc([C@@H](C)NCc2c3ccccc3cc3ccccc23)n1	792177918	XLLXEQJXCYZYDV-CYBMUJFWSA-N	317.392	4.535	5	20	DJBD	
O=[N+]([O-])c1cccc2ccc(/C=C/c3ccc(F)cc3F)nc12	57457460	XAFFPUPHTUNYOE-VMPITWQZSA-N	312.275	4.592	5	20	DJBD	
O=[N+]([O-])c1ccccc1CSc1cccc(Br)c1	303235782	ZIAUTTUMLMVWJY-UHFFFAOYSA-N	324.199	4.650	5	20	DJBD	
C[C@H](N[C@H](C)c1ccc(Cl)c(F)c1)c1ccccc1[N+](=O)[O-]	539296195	YRMPRQPIAAVSBQ-MNOVXSKESA-N	322.767	4.799	5	20	DJBD	
CC[C@H](NCc1ccc([N+](=O)[O-])c(Cl)c1)c1ccc(C)cc1	761520168	MGGHYBHHQOKHJT-INIZCTEOSA-N	318.804	4.798	5	20	DJBD	
CC(C)c1ccsc1C(=O)Nc1cccc([N+](=O)[O-])c1Cl	813246826	SCMRFRGZMBWVCG-UHFFFAOYSA-N	324.789	4.685	5	20	DJBD	
Cc1ccnc(CS[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1	1255680831	AMPYUELTTQFYFS-ZDUSSCGKSA-N	302.399	4.601	5	20	DJBD	
Cc1cc([C@H](C)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)c(C)s1	37122834	GFAKHLXANKXWNH-RYUDHWBXSA-N	304.415	4.685	5	20	DJBD	
O=C(Nc1ccncc1F)c1c2ccccc2cc2ccccc12	181822690	YSGILVPEUIQAMO-UHFFFAOYSA-N	316.335	4.779	5	20	DJBD	
CC[C@@H](C)[C@H](C)NC(=O)c1cc2ccccc2c2cccnc12	195646056	RQSRBLPHBPFJAK-KGLIPLIRSA-N	306.409	4.552	5	20	DJBD	
CC[C@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1cccc(F)c1	453247671	OFJDNZJYZMAFEQ-SJCJKPOMSA-N	302.349	4.536	5	20	DJBD	
Cc1ccccc1[C@H](Nc1ccc([N+](=O)[O-])cc1F)C1CC1	488241528	KRUQWDJBWIITNQ-QGZVFWFLSA-N	300.333	4.606	5	20	DJBD	
Cc1ccccc1[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)C1CC1	531717386	QUYKPWHFMZHZOX-IFXJQAMLSA-N	310.397	4.705	5	20	DJBD	
Cc1cc([C@H](C)N[C@H]2CCc3c2cccc3[N+](=O)[O-])c(C)s1	565842083	BYYLDMHMATYWPP-ZBEGNZNMSA-N	316.426	4.611	5	20	DJBD	
O=[N+]([O-])c1ccccc1CNCc1ccccc1-c1ccccc1	917395610	UYNYMOVHEGRLJV-UHFFFAOYSA-N	318.376	4.552	5	20	DJBD	
CC(C)CCc1nc(CSc2ccc([N+](=O)[O-])cc2)cs1	65013356	WGIJDYRABPWBLF-UHFFFAOYSA-N	322.455	4.932	5	20	DJBD	
O=[N+]([O-])c1cccc(-c2csc(CCc3ccccc3)n2)c1	303025756	SEMZLDRGWLNHIA-UHFFFAOYSA-N	310.378	4.504	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H](C)c2ccc(Cl)cc2)cc1[N+](=O)[O-]	314053463	PJMPZZKPFHUGMQ-CHWSQXEVSA-N	318.804	4.968	5	20	DJBD	
Cc1ccc2c(c1)[C@@H](N[C@@H](C)c1cc([N+](=O)[O-])ccc1C)CC2	611335712	PUOYJTKKQSIQMK-LIRRHRJNSA-N	310.397	4.550	5	20	DJBD	
Cc1cnc(N[C@@H](C)c2csc3ccccc23)c([N+](=O)[O-])c1	742429627	GWDWVUXAPFERJX-NSHDSACASA-N	313.382	4.686	5	20	DJBD	
Cc1nc(Oc2ccc3c(c2)[nH]c2ccccc23)ccc1[N+](=O)[O-]	760445187	QQYSEFQUEQKKTH-UHFFFAOYSA-N	319.320	4.725	5	20	DJBD	
CC(=O)c1ccc(Sc2cc(C)ccc2C)c([N+](=O)[O-])c1	7983482	GRKMDXUEBLFLOD-UHFFFAOYSA-N	301.367	4.565	5	20	DJBD	
Cc1ccc([C@@H](C)NCc2coc3ccccc23)cc1[N+](=O)[O-]	121669668	CYLIOUZARRZBPN-CYBMUJFWSA-N	310.353	4.500	5	20	DJBD	
Cc1cc([C@@H](C)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)s1	195614585	KJRUKNSTIIGHQJ-CHWSQXEVSA-N	318.442	4.993	5	20	DJBD	
CC(C)C[C@H](NCc1c(F)cccc1[N+](=O)[O-])c1ccccc1	611376566	NJKUFLHTRVZRQN-KRWDZBQOSA-N	316.376	4.611	5	20	DJBD	
CSc1ccc(CSCc2cccc([N+](=O)[O-])c2)cc1	58689658	DBAZYMHAMRPKRX-UHFFFAOYSA-N	305.424	4.750	5	20	DJBD	
CCS[C@@H](C)c1noc(-c2ccc(C(C)C)c([N+](=O)[O-])c2)n1	566940817	XZGJYTKFQRLZGE-JTQLQIEISA-N	321.402	4.582	5	20	DJBD	
CC[C@H](Sc1ncccc1[N+](=O)[O-])c1ccc(F)cc1F	609962279	OZGYZIMEUSDVLT-ZDUSSCGKSA-N	310.325	4.511	5	20	DJBD	
C/C(=C\Cl)CSCc1coc(-c2ccc([N+](=O)[O-])cc2)n1	797812601	MOJPMIYZQKTOMK-UXBLZVDNSA-N	324.789	4.626	5	20	DJBD	
CC(=O)c1ccc(OCc2cccc3ccccc23)c([N+](=O)[O-])c1	260863582	CWZDIDDTSCEGQF-UHFFFAOYSA-N	321.332	4.530	5	20	DJBD	
CC[C@@H](N[C@@H]1CCc2cc(C)ccc21)c1cccc([N+](=O)[O-])c1	540139256	PJKVHUSZYPALJZ-RTBURBONSA-N	310.397	4.631	5	20	DJBD	
O=C(NCCc1ccco1)c1c2ccccc2cc2ccccc12	746508586	GTZZTFYHYYZINV-UHFFFAOYSA-N	315.372	4.559	5	20	DJBD	
Cc1ccc(CNc2ccc(C(F)F)cc2[N+](=O)[O-])cc1F	863999948	KEJKWNASRQIZSK-UHFFFAOYSA-N	310.275	4.592	5	20	DJBD	
O=[N+]([O-])c1ccc(F)cc1CNc1ccc(Cl)c(Cl)c1	35308052	KGNKPHRYHFFCGT-UHFFFAOYSA-N	315.131	4.653	5	20	DJBD	
CCC[C@H](NCc1ccc([N+](=O)[O-])c(Cl)c1)c1ccccc1	783583136	FXBNOIQBQKPSLB-INIZCTEOSA-N	318.804	4.879	5	20	DJBD	
Cc1cc([N+](=O)[O-])cnc1N[C@@H](C)c1oc2ccccc2c1C	301194382	NLUYNTHUUWIFSO-LBPRGKRZSA-N	311.341	4.526	5	20	DJBD	
CC[C@@H](NCc1ccc2occc2c1)c1cccc([N+](=O)[O-])c1	352758501	YYBLFYCPKLMQAE-QGZVFWFLSA-N	310.353	4.582	5	20	DJBD	
C[C@H](NC(=O)CCCC1CCCCC1)c1cccc([N+](=O)[O-])c1	515681865	LDAFBKOHPJVVBD-AWEZNQCLSA-N	318.417	4.523	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1cccc2ccccc12	538299212	ULWZPYOUZJHLML-HNNXBMFYSA-N	320.392	4.907	5	20	DJBD	
C/C=C/c1ccc(NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])cc1	565425766	FJGUCRVZGUJPQZ-QPJJXVBHSA-N	324.380	4.544	5	20	DJBD	
CC(=O)c1cc(NCc2cccc3ccccc23)ccc1[N+](=O)[O-]	584186815	XNZVMBHRKSGXNS-UHFFFAOYSA-N	320.348	4.563	5	20	DJBD	
C[C@@H](Sc1ccc([N+](=O)[O-])cc1F)c1ncc(C(C)(C)C)o1	185150780	WQRDMRCWQOHLHP-SECBINFHSA-N	324.377	4.873	5	20	DJBD	
Cc1ccc(NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)cc1	303133446	BRIRHAYQVAKAQG-UHFFFAOYSA-N	308.337	4.775	5	20	DJBD	
COc1ccccc1[C@H](C)Sc1ccc(F)cc1[N+](=O)[O-]	463077099	FFWPBQNLHCBOLG-JTQLQIEISA-N	307.346	4.596	5	20	DJBD	
O=[N+]([O-])c1cccc2nc(/C=C/C=C\c3ccccc3)ccc12	476965898	XSPBKCSNFJEPCB-DHPVUTNOSA-N	302.333	4.870	5	20	DJBD	
CCC(CC)(CC)SCC(=O)Nc1ccc([N+](=O)[O-])cc1C	762970950	MFXZNZDEEZGPMU-UHFFFAOYSA-N	324.446	4.544	5	20	DJBD	
CC(C)Oc1cccc([C@@H](C)Nc2cccc(F)c2[N+](=O)[O-])c1	919963975	ZHQNKQXUGKEGEJ-GFCCVEGCSA-N	318.348	4.694	5	20	DJBD	
COc1cc(/C=C(/C)c2ccc3ccccc3n2)ccc1[N+](=O)[O-]	1322676023	PTXIAEDULKNYHF-QBFSEMIESA-N	320.348	4.712	5	20	DJBD	
C[C@@H](N[C@H]1CCc2sc(Cl)cc21)c1cccc([N+](=O)[O-])c1	123378482	RTBBNFICGOYAPM-RNCFNFMXSA-N	322.817	4.648	5	20	DJBD	
COCc1cc([N+](=O)[O-])ccc1N[C@H](C)c1cccc(C)c1C	301478701	QLTVIPGEQTZGQK-CQSZACIVSA-N	314.385	4.531	5	20	DJBD	
CC(C)(C)OCc1cccc(CNc2sccc2[N+](=O)[O-])c1	301978628	FHSUQYJBLRWKIQ-UHFFFAOYSA-N	320.414	4.584	5	20	DJBD	
C[C@H](CCO)NCc1c2ccccc2c(Cl)c2ccccc12	738436787	ZBXOVRBNKOZJNC-CYBMUJFWSA-N	313.828	4.507	5	20	DJBD	
Cc1c(CN[C@@H](c2ccccc2)C(C)(C)C)cccc1[N+](=O)[O-]	64933024	WSUORGFCFNXKLQ-SFHVURJKSA-N	312.413	4.780	5	20	DJBD	
Cc1cc(Oc2ccc(F)c3c2C(=O)C[C@@H]3C)ccc1[N+](=O)[O-]	515540277	VRFBYPVZDRNIOL-JTQLQIEISA-N	315.300	4.525	5	20	DJBD	
Cc1cc(C)c(CN[C@@H](C)c2cccc([N+](=O)[O-])c2C)c(C)c1	532498730	CKSLPMPHVAXKSS-INIZCTEOSA-N	312.413	4.679	5	20	DJBD	
CCC[C@@H](NCc1ccc([N+](=O)[O-])c(Cl)c1)c1ccccc1	783583137	FXBNOIQBQKPSLB-MRXNPFEDSA-N	318.804	4.879	5	20	DJBD	
CCc1ccccc1NCc1cc([N+](=O)[O-])ccc1OC(C)C	462215005	YZWGBMUWXCKPMB-UHFFFAOYSA-N	314.385	4.557	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)SCc1ccn(C(C)C)n1	486107248	XJUOVHJDBFDCFI-ZDUSSCGKSA-N	319.430	4.675	5	20	DJBD	
CCC[C@@H](N[C@H](CC)CC(F)(F)F)c1cccc([N+](=O)[O-])c1	546165331	DZTACNIHEOJEJJ-TZMCWYRMSA-N	318.339	4.757	5	20	DJBD	
CC[C@H](OC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1	733387863	GSSAPKFYGLUSMZ-HNNXBMFYSA-N	319.744	4.556	5	20	DJBD	
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](C)c1ccsc1	872068966	KGQGUBLNFVCPKB-WDEREUQCSA-N	322.455	4.790	5	20	DJBD	
C[C@@H](N[C@H](C)c1csc(Cl)c1)c1cccc([N+](=O)[O-])c1	191213856	XFBQFSRALZAHSX-NXEZZACHSA-N	310.806	4.722	5	20	DJBD	
O=[N+]([O-])c1cnc(N[C@H](c2ccc(Cl)cc2)C2CCC2)s1	443524478	URJWIJQBLUZANE-ZDUSSCGKSA-N	323.805	4.658	5	20	DJBD	
Cc1cc(C)cc([C@@H](C)N[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1	492849870	DTCJHRQQDRXFFI-CVEARBPZSA-N	312.413	4.932	5	20	DJBD	
C[C@H]1[C@H](C)CCCN1C(=O)c1cc2ccccc2c2cccnc12	525548788	HPVDMCDMVYEPCE-CABCVRRESA-N	318.420	4.649	5	20	DJBD	
CCSc1cccc(F)c1NCc1cc(F)ccc1[N+](=O)[O-]	811788759	KPURVBKQXWOMKD-UHFFFAOYSA-N	324.352	4.597	5	20	DJBD	
CCOc1cccc(NCc2cccc(C(F)F)c2)c1[N+](=O)[O-]	1324271995	GGORMTYJWCYCMD-UHFFFAOYSA-N	322.311	4.543	5	20	DJBD	
O=[N+]([O-])c1cc(F)ccc1N[C@H]1CCSc2c(F)cccc21	57680851	HXFURIBDGJSJSS-LBPRGKRZSA-N	322.336	4.522	5	20	DJBD	
Cc1cc([C@@H](C)NCc2cc(Cl)ccc2[N+](=O)[O-])c(C)s1	93632823	SMTFYQNSXRTHKK-SNVBAGLBSA-N	324.833	4.777	5	20	DJBD	
Cc1cc([C@@H](C)Nc2ccc([N+](=O)[O-])c3cccnc23)c(C)o1	301088349	FFQOPNRJAAUSSX-LLVKDONJSA-N	311.341	4.526	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H](C)c2cccc(C)c2C)cc1[N+](=O)[O-]	531711627	KIOIOLHVMCBYJM-CVEARBPZSA-N	312.413	4.932	5	20	DJBD	
O=[N+]([O-])c1cc(CSc2ncccc2Cl)ccc1Cl	79422298	SFZHZZNBXHZILR-UHFFFAOYSA-N	315.181	4.589	5	20	DJBD	
C[C@H](N[C@@H](C)c1ccc(F)cc1Cl)c1ccc([N+](=O)[O-])cc1	178657435	RIGPGWDXFXCIIS-QWRGUYRKSA-N	322.767	4.799	5	20	DJBD	
CC(C)c1cccc(C(C)C)c1NC(=O)CCC(C)(C)[N+](=O)[O-]	294590904	QLVBWXRSZDGMPC-UHFFFAOYSA-N	320.433	4.707	5	20	DJBD	
Cc1cc(C)c2cc(CN[C@@H](C)c3cccc([N+](=O)[O-])c3)[nH]c2c1	479547134	BDLXUVWBXRNMOM-AWEZNQCLSA-N	323.396	4.544	5	20	DJBD	
O=[N+]([O-])c1c(Oc2ccc(Cl)cc2F)ccc2ncccc12	485892009	MHRCGBRZFQDRRC-UHFFFAOYSA-N	318.691	4.728	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)CCCC(F)(F)F	572191527	GLUBTNIIAZQHQW-NEPJUHHUSA-N	318.339	4.675	5	20	DJBD	
Cc1cc([C@@H](C)NCc2c(Cl)cccc2[N+](=O)[O-])c(C)s1	107904534	JBNIXUNSNLZQDC-SNVBAGLBSA-N	324.833	4.777	5	20	DJBD	
O=C(NC1CCSCC1)c1c2ccccc2cc2ccccc12	173362374	UITAPTFZONWXTC-UHFFFAOYSA-N	321.445	4.618	5	20	DJBD	
O=[N+]([O-])c1ccc(CNCc2ccc(-c3ccccc3)cc2)cc1	237983634	NXVLDFFDIYFGAO-UHFFFAOYSA-N	318.376	4.552	5	20	DJBD	
COCc1cc([N+](=O)[O-])ccc1NCc1ccc2ccccc2c1	301457433	XKPLRCZULOBMNX-UHFFFAOYSA-N	322.364	4.507	5	20	DJBD	
Cc1cccc2c1CC[C@H]2N[C@@H](C)c1cccc([N+](=O)[O-])c1C	540178955	JXBLUGCIXLKXEX-KBXCAEBGSA-N	310.397	4.550	5	20	DJBD	
C[C@@H](NC1(c2cccc(Cl)c2)CC1)c1cccc([N+](=O)[O-])c1	173439258	JOODFXCTJMBBMC-GFCCVEGCSA-N	316.788	4.588	5	20	DJBD	
COCc1cc([N+](=O)[O-])ccc1N[C@H](C)c1c(C)cccc1C	302243096	YVVHCQZKIAYPFY-CQSZACIVSA-N	314.385	4.531	5	20	DJBD	
Cc1ccc(C)c(SCc2nc3cc([N+](=O)[O-])ccc3o2)c1	434817976	XRUUIGZFXBMXGO-UHFFFAOYSA-N	314.366	4.645	5	20	DJBD	
Cc1cc(Nc2ccc(Cc3ccncc3)cc2)ccc1[N+](=O)[O-]	603837863	SCPJDJNITMDWKH-UHFFFAOYSA-N	319.364	4.633	5	20	DJBD	
O=[N+]([O-])c1ccccc1CN1CCC[C@H]1c1cccc(Cl)c1	603855155	DBTCECFXSNTNTI-INIZCTEOSA-N	316.788	4.585	5	20	DJBD	
O=[N+]([O-])c1ccc(SCc2cccc(C(F)F)c2)c(F)c1	619460439	GANJDEGTTZATHT-UHFFFAOYSA-N	313.300	4.964	5	20	DJBD	
Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)c1occc1C(C)C	790778997	NVHJLDBFKPPHMU-UHFFFAOYSA-N	322.748	4.525	5	20	DJBD	
C[C@@H](SCCCOc1ccccc1)c1ccccc1[N+](=O)[O-]	437259252	QEMDDDADEDGCMB-CQSZACIVSA-N	317.410	4.858	5	20	DJBD	
CCc1cc(CNCc2c3ccccc3cc3ccccc23)n[nH]1	738430561	GSKSSPGTSDCIOT-UHFFFAOYSA-N	315.420	4.568	5	20	DJBD	
C[C@H]1CSCCN1C(=O)c1c2ccccc2cc2ccccc12	746524387	PBSMYWQPVOBCMF-AWEZNQCLSA-N	321.445	4.571	5	20	DJBD	
CC(C)NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1	61002573	NNEZWVVSWPKIHP-UHFFFAOYSA-N	320.776	4.539	5	20	DJBD	
CCCC(CCC)SCC(=O)Nc1c(C)cccc1[N+](=O)[O-]	64047955	XYFJUGCWEMIBEZ-UHFFFAOYSA-N	324.446	4.544	5	20	DJBD	
CCOc1cc(CNc2cccc(C(F)F)c2)ccc1[N+](=O)[O-]	276960642	VNWGHXXBHMXYMZ-UHFFFAOYSA-N	322.311	4.543	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)Sc1nccn1C(C)C	484661711	DCBVQZOULHRDJN-LBPRGKRZSA-N	305.403	4.534	5	20	DJBD	
CC(C)c1cccc(CNCc2ccc([N+](=O)[O-])c(Cl)c2)c1	783680296	WFMCPXHVNAYBKH-UHFFFAOYSA-N	318.804	4.661	5	20	DJBD	
c1ccc2c(CNCc3nccs3)c3ccccc3cc2c1	75821261	WQXZOLUKJJDFFN-UHFFFAOYSA-N	304.418	4.739	5	20	DJBD	
Cc1c(CNc2ccccc2OCC(C)C)cccc1[N+](=O)[O-]	462223977	JMQLORVLGNWFJE-UHFFFAOYSA-N	314.385	4.550	5	20	DJBD	
COc1ccc([N+](=O)[O-])cc1CS[C@@H](C)c1ccccc1	520665002	PLUGCYRQQYVAJJ-LBPRGKRZSA-N	303.383	4.598	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1OCc1csc(C2CCCC2)n1	64037088	UCNMXIFKBAEKPB-UHFFFAOYSA-N	318.398	4.596	5	20	DJBD	
C[C@H](N[C@@H]1CCc2cc(Cl)ccc21)c1cccc([N+](=O)[O-])c1	173361354	LNDVCBZJMVVSFO-APPDUMDISA-N	316.788	4.586	5	20	DJBD	
CC[C@H](Nc1ccc([N+](=O)[O-])c(OC)c1)c1ccc(Cl)cc1	462927780	HNRFGSBUUGLXLI-AWEZNQCLSA-N	320.776	4.820	5	20	DJBD	
CC(C)c1ccc(CNC(C)(C)CC(F)(F)F)cc1[N+](=O)[O-]	614822442	MEFBGHLCIJYBNK-UHFFFAOYSA-N	318.339	4.539	5	20	DJBD	
O=Cc1cccc(Oc2cc(Cl)ccc2[N+](=O)[O-])c1Cl	814902990	LZDQAJNFQBWGPW-UHFFFAOYSA-N	312.108	4.506	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(OCc2csc(C3CCCC3)n2)c1	60211500	KUKIJPSDXYTFDB-UHFFFAOYSA-N	318.398	4.596	5	20	DJBD	
C[C@@H](Nc1cccc(F)c1[N+](=O)[O-])c1cc2ccccc2o1	301074045	GDXAMTYAFQSRQC-SNVBAGLBSA-N	300.289	4.653	5	20	DJBD	
O=[N+]([O-])c1cccc(Oc2ncnc3sc4ccccc4c23)c1	440633052	ABQKYITVUXUHQQ-UHFFFAOYSA-N	323.333	4.545	5	20	DJBD	
C[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(Cl)s1	37508483	CRKCOBHLYOIZLK-ZJUUUORDSA-N	310.806	4.722	5	20	DJBD	
CC[C@@H](N[C@H]1CCc2c(C)cccc21)c1cccc([N+](=O)[O-])c1	539081396	YAHQPBAJNKNBRO-MOPGFXCFSA-N	310.397	4.631	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1CCCc2sccc21	545235845	PYWXCECEIUBMRL-BLLLJJGKSA-N	316.426	4.693	5	20	DJBD	
COc1ccc(F)cc1[C@@H](C)Nc1ccc(Cl)cc1[N+](=O)[O-]	603866805	DBTLCNCFSFBPOM-SECBINFHSA-N	324.739	4.569	5	20	DJBD	
Cc1cccc([C@@H]2CCCN2Cc2cccc([N+](=O)[O-])c2C)c1	604013569	YKAMJRAWSSBEOW-IBGZPJMESA-N	310.397	4.549	5	20	DJBD	
C[C@@H](N[C@@H](c1ccccc1)C1CCC1)c1ccccc1[N+](=O)[O-]	72608734	DXUOQEWIRHCKKS-KUHUBIRLSA-N	310.397	4.787	5	20	DJBD	
O=[N+]([O-])c1ccc2sc(/C=C\c3cc(F)ccc3F)nc2c1	206948737	CTJVWUVTKFSSQE-BHQIHCQQSA-N	318.304	4.653	5	20	DJBD	
O=[N+]([O-])c1ccc(-c2ccc(CNc3ccccc3)s2)cc1	462677554	PVHJLAIRMHVPHF-UHFFFAOYSA-N	310.378	4.935	5	20	DJBD	
CC[C@@H](C)n1ncc(N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1C	477915165	IGYVJJDOCAJKOE-CHWSQXEVSA-N	316.405	4.552	5	20	DJBD	
CCCCC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1	609755116	FSEGTMOJFFAYKX-UHFFFAOYSA-N	314.341	4.516	5	20	DJBD	
Cc1ccc(/C=C(\Cl)c2nc3cc([N+](=O)[O-])ccc3o2)s1	177617909	ICSXHTUMHVVEGF-XFFZJAGNSA-N	320.757	4.843	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)c1	321698762	ZQXMBMWHRFSAAE-CVEARBPZSA-N	312.413	4.932	5	20	DJBD	
Cc1ccc2c(c1)CC[C@@H]2N[C@@H]1CCCc2ccc([N+](=O)[O-])cc21	447530382	MNMJXHOHBIASAQ-UXHICEINSA-N	322.408	4.558	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H](C)c2ccc3c(c2)CCC3)cc1[N+](=O)[O-]	540221441	GKSTUYZBZWREHF-LSDHHAIUSA-N	324.424	4.804	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1	49159205	UVNXDXDXINMCTR-QWHCGFSZSA-N	304.415	4.685	5	20	DJBD	
CC(C)[C@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1	319770429	XEOIGLRCYHPCOU-UGSOOPFHSA-N	316.376	4.782	5	20	DJBD	
O=[N+]([O-])c1cccc2c1ccn2Cc1ccc(C(F)F)cc1	460819928	UOEHARPILGWKPM-UHFFFAOYSA-N	302.280	4.535	5	20	DJBD	
C[C@@H](N[C@@H]1CC(C)(C)c2ccccc21)c1cccc([N+](=O)[O-])c1	540117290	BYNXWZZMRXESAJ-FZKQIMNGSA-N	310.397	4.668	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](C)c1c(C)cccc1C	546223829	KRMBQUNRFCEYSR-CVEARBPZSA-N	312.413	4.932	5	20	DJBD	
Cc1noc(CS[C@H](C)c2ccc(Cl)cc2)c1[N+](=O)[O-]	596018737	BHLOLYYKVSQRJM-SECBINFHSA-N	312.778	4.539	5	20	DJBD	
Cc1cc(N[C@@H](C)c2cccc(OC(C)C)c2)ccc1[N+](=O)[O-]	603860375	GSQIIOXZXQOECI-AWEZNQCLSA-N	314.385	4.864	5	20	DJBD	
COc1ccccc1[C@@H](C)SCc1cc(F)ccc1[N+](=O)[O-]	742454792	GPBIVTLTSSXIRH-LLVKDONJSA-N	321.373	4.737	5	20	DJBD	
O=[N+]([O-])c1ccc(-c2nc(C3CCCCCC3)no2)c(Cl)c1	904679829	VXVKPGOGFBHJDJ-UHFFFAOYSA-N	321.764	4.736	5	20	DJBD	
CC[C@H](N[C@@H](C)c1ccc(F)cc1F)c1cccc([N+](=O)[O-])c1	90068696	JCMHALXWYPBMSG-GTNSWQLSSA-N	320.339	4.675	5	20	DJBD	
Cc1cc(CNCc2c3ccccc3cc3ccccc23)on1	105455856	LHBHSPJHXRVKAL-UHFFFAOYSA-N	302.377	4.579	5	20	DJBD	
O[C@@H]1CCC[C@H](CNCc2c3ccccc3cc3ccccc23)C1	238101315	DJGNRTVGEZJIMX-QFBILLFUSA-N	319.448	4.634	5	20	DJBD	
C[C@@H](Nc1ccc([N+](=O)[O-])cc1F)c1cc2ccccc2o1	314797512	DEUXVMIHKJPKQF-SNVBAGLBSA-N	300.289	4.653	5	20	DJBD	
C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC(c2ccsc2)CC1	486009981	VWJZIZBDNQOUQF-ZDUSSCGKSA-N	316.426	4.597	5	20	DJBD	
Cc1ccc(C)c(Cc2nc(O)c3cc4ccccc4cc3n2)c1	545338155	VYJBLUUWMYQUNS-UHFFFAOYSA-N	314.388	4.696	5	20	DJBD	
C[C@H](NCc1ccc2sccc2c1)c1cccc([N+](=O)[O-])c1	581517888	CBHMUXVSWIBHKA-LBPRGKRZSA-N	312.394	4.660	5	20	DJBD	
O=C(OCc1cccnc1)c1c2ccccc2cc2ccccc12	733392853	DWNYOWWYVYPLPD-UHFFFAOYSA-N	313.356	4.745	5	20	DJBD	
CC[C@@H](c1ccccc1)N(CC)Cc1cc(F)ccc1[N+](=O)[O-]	746144999	QGWHQOYEKZTGAY-KRWDZBQOSA-N	316.376	4.707	5	20	DJBD	
Cc1c([N+](=O)[O-])ccc(F)c1NCc1cccc(C(F)F)c1	799971771	VYYXKODQQXGWPH-UHFFFAOYSA-N	310.275	4.592	5	20	DJBD	
c1cncc(CCNCc2c3ccccc3cc3ccccc23)c1	915229099	SRKLONZDBIIJLG-UHFFFAOYSA-N	312.416	4.720	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(N[C@@H]2CCSc3ccc(F)cc32)c1	1336405215	CKFRDZZENJNQHH-CYBMUJFWSA-N	318.373	4.691	5	20	DJBD	
Cc1ccc([C@@H](C)NCCc2ccc(Cl)s2)cc1[N+](=O)[O-]	222845578	PUTLTQMKRUAQAT-LLVKDONJSA-N	324.833	4.511	5	20	DJBD	
Cc1ccccc1[C@@H](Nc1ccc([N+](=O)[O-])cc1F)C1CC1	488241527	KRUQWDJBWIITNQ-KRWDZBQOSA-N	300.333	4.606	5	20	DJBD	
C[C@@H](SCCOc1ccccc1[N+](=O)[O-])c1ccc(F)cc1	520676489	OTILGSPGOWADHI-GFCCVEGCSA-N	321.373	4.607	5	20	DJBD	
Cc1ccccc1[C@@H](NCc1ccc([N+](=O)[O-])c(F)c1)C(C)C	790079264	AGVBBDIVGLPCPF-SFHVURJKSA-N	316.376	4.529	5	20	DJBD	
O=[N+]([O-])c1ccccc1CSc1nc2cc(Cl)ccc2o1	61419993	KOYMNIIDHCEDJK-UHFFFAOYSA-N	320.757	4.682	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H](C)c2c(F)cccc2F)cc1[N+](=O)[O-]	79723072	KGPAQHMSYXIRCE-NWDGAFQWSA-N	320.339	4.593	5	20	DJBD	
COCCCC[C@H](Nc1ccc([N+](=O)[O-])cc1)c1ccccc1	480574118	CSMZHPNEMIPMPO-SFHVURJKSA-N	314.385	4.565	5	20	DJBD	
CSc1cccc(N[C@@H](C)c2cccc([N+](=O)[O-])c2C)c1	540710047	UVUKGJQDXPXIIJ-LBPRGKRZSA-N	302.399	4.798	5	20	DJBD	
Cc1ccc([C@@H](C)Nc2nc3ccc([N+](=O)[O-])cc3s2)cc1	731206729	RAHWXTAINFHYDN-LLVKDONJSA-N	313.382	4.686	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)SCc1scnc1C	1117687490	MXYOPZRAESOKQB-NSHDSACASA-N	308.428	4.663	5	20	DJBD	
COc1ccc([C@H](Nc2ccc([N+](=O)[O-])cc2F)C(C)C)cc1	513108603	QGNDNWWJKJVRCN-QGZVFWFLSA-N	318.348	4.552	5	20	DJBD	
CC(C)c1nc(CSCc2ccccc2[N+](=O)[O-])cs1	517176107	ZQJCFMYPSBNOKB-UHFFFAOYSA-N	308.428	4.608	5	20	DJBD	
Cc1cccc2c1CC[C@@H]2N[C@@H]1CCCc2ccc([N+](=O)[O-])cc21	562603587	SUUDMYIZLIEGRU-UXHICEINSA-N	322.408	4.558	5	20	DJBD	
C[C@@H](SCc1nc2cc([N+](=O)[O-])ccc2o1)c1cccs1	751471368	VLLRJZQSMKIYEY-SECBINFHSA-N	320.395	4.792	5	20	DJBD	
C[C@@H](Nc1ccc2oc(C3CC3)nc2c1)c1cccc([N+](=O)[O-])c1	192744124	GQXHCNSXHMGXKD-LLVKDONJSA-N	323.352	4.787	5	20	DJBD	
O=[N+]([O-])c1cccc2c1ccn2Cc1ccccc1C(F)(F)F	323541612	ONTWRYFGDNSOAO-UHFFFAOYSA-N	320.270	4.617	5	20	DJBD	
CSc1ccc(N[C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1	540701364	ZPTSCUIEKACUOQ-GFCCVEGCSA-N	302.399	4.798	5	20	DJBD	
O=[N+]([O-])c1cccc(-c2nnc(CCCC3CCCCC3)o2)c1	1322660002	HMXFTTXZVMCTHM-UHFFFAOYSA-N	315.373	4.548	5	20	DJBD	
C[C@@H](N[C@@H]1CCc2c(Cl)cccc21)c1ccc([N+](=O)[O-])cc1	178649467	LKYHVBIAYCVJQX-PIGZYNQJSA-N	316.788	4.586	5	20	DJBD	
C[C@@H](NCc1ccccc1[N+](=O)[O-])c1ccccc1C(C)(C)C	539093401	PEHICGZHHWQMGI-CQSZACIVSA-N	312.413	4.743	5	20	DJBD	
CN(CC1CCC1)C(=O)c1c2ccccc2cc2ccccc12	1340813450	XKVUVEOEWTUSHG-UHFFFAOYSA-N	303.405	4.865	5	20	DJBD	
CCCC(CCC)SCC(=O)Nc1ccc([N+](=O)[O-])cc1C	64047951	WZHSBQRHQPHQOH-UHFFFAOYSA-N	324.446	4.544	5	20	DJBD	
CCCCCOc1ccc(Oc2nccc(C)c2[N+](=O)[O-])cc1	609668835	WMQXTIBBKCVKLQ-UHFFFAOYSA-N	316.357	4.660	5	20	DJBD	
CC(C)Oc1cccc(NCc2ccc(Cl)cc2[N+](=O)[O-])c1	864031121	WBLHVEVPGGCUJU-UHFFFAOYSA-N	320.776	4.648	5	20	DJBD	
CCC[C@H](NCc1sccc1C)c1cccc([N+](=O)[O-])c1	94875025	BZGKYQZSKLHGQF-HNNXBMFYSA-N	304.415	4.596	5	20	DJBD	
CC(=O)c1ccc(SCc2ccccc2Cl)c([N+](=O)[O-])c1	232475619	HOUPFEQAUGYXBA-UHFFFAOYSA-N	321.785	4.743	5	20	DJBD	
CC(C)Oc1cc(F)ccc1N[C@H](C)c1cccc([N+](=O)[O-])c1	495415585	ROGBODCYQKIKRF-GFCCVEGCSA-N	318.348	4.694	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1C	538020612	HCTZGVYVTBKXPO-JKSUJKDBSA-N	312.413	4.932	5	20	DJBD	
Cc1cc([C@@H](C)N[C@H]2CCc3c2cccc3[N+](=O)[O-])c(C)s1	565842081	BYYLDMHMATYWPP-BZNIZROVSA-N	316.426	4.611	5	20	DJBD	
O=[N+]([O-])c1ccc(/C=C/Sc2ncc(-c3ccccc3)o2)o1	1345173374	JWBYRLBVFMWVTK-CMDGGOBGSA-N	314.322	4.606	5	20	DJBD	
O=[N+]([O-])c1cccc(/C=C(/Cl)c2nc3ccccc3s2)c1	6890670	AIPNOFAOIAQQOF-FMIVXFBMSA-N	316.769	4.941	5	20	DJBD	
Cc1ccccc1-c1nnc(-c2c(C)cc(C)c([N+](=O)[O-])c2C)o1	1322230545	LWLHRFWLFFJDMT-UHFFFAOYSA-N	323.352	4.545	5	20	DJBD	
C[C@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)c1cc2ccccc2o1	191370151	XQRTYVLQXUJGNF-OLZOCXBDSA-N	310.353	4.753	5	20	DJBD	
Cc1ccc([C@H](C)Nc2cccc3ccncc23)cc1[N+](=O)[O-]	321773107	PXOHRBACYYOEGO-ZDUSSCGKSA-N	307.353	4.625	5	20	DJBD	
O=[N+]([O-])c1cccc(CNc2cccc(Oc3ccccc3)c2)c1	324403151	POUFRMGWWVPVKC-UHFFFAOYSA-N	320.348	4.999	5	20	DJBD	
CC(C)[C@H]1C[C@@H](NCc2csc([N+](=O)[O-])c2)c2ccccc21	447970807	GWGAXWGBHQNPOY-HZPDHXFCSA-N	316.426	4.631	5	20	DJBD	
C[C@@H](Sc1ccc2ccccc2n1)c1ccccc1[N+](=O)[O-]	463027826	IYEAYYUKYMXFLW-GFCCVEGCSA-N	310.378	4.996	5	20	DJBD	
CC1=C(C)CN(C(=O)c2cc3ccccc3c3cccnc23)CC1	482891117	CYMCQLAVDBXJGZ-UHFFFAOYSA-N	316.404	4.570	5	20	DJBD	
Cc1c([C@H](C)Nc2ccccc2OC(F)F)cccc1[N+](=O)[O-]	562034726	SFNSQEXZBQOHSN-NSHDSACASA-N	322.311	4.678	5	20	DJBD	
Cc1ccc2c(c1)[C@@H](NCc1ccc(C(C)C)c([N+](=O)[O-])c1)CC2	609288395	QYLFBSKNSSCCSB-IBGZPJMESA-N	324.424	4.804	5	20	DJBD	
CCCCOc1ccccc1NCc1cccc([N+](=O)[O-])c1C	462236381	VWHXYEVXUAITPS-UHFFFAOYSA-N	314.385	4.694	5	20	DJBD	
Cc1ccc2c(c1)CC[C@@H]2Nc1ccc([N+](=O)[O-])c2cccnc12	511714465	VJHFBQKJGJNAHH-INIZCTEOSA-N	319.364	4.551	5	20	DJBD	
O=[N+]([O-])c1ccc(CSCc2cccc3cccnc23)cc1	513816684	RWDKQFAVPQNNPF-UHFFFAOYSA-N	310.378	4.576	5	20	DJBD	
C[C@H](c1ccco1)N(Cc1ccc([N+](=O)[O-])c(Cl)c1)C1CC1	761505924	IQUFIKXJTQHVBK-LLVKDONJSA-N	320.776	4.567	5	20	DJBD	
CCCOc1ccc(NCc2cccc([N+](=O)[O-])c2C)cc1C	864032700	INKOTGWCXQYEGJ-UHFFFAOYSA-N	314.385	4.613	5	20	DJBD	
C[C@@H](c1ccccc1Cl)N(C)Cc1cc(F)ccc1[N+](=O)[O-]	917067681	TTZGSOSJCQWOAI-NSHDSACASA-N	322.767	4.580	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H](C)c2cc(C)c(C)o2)cc1[N+](=O)[O-]	502467979	ZSSGLBRALSPPTC-STQMWFEESA-N	302.374	4.525	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC1(c2ccccc2C)CC1	592391915	VAXAEAWFNCUJOX-HNNXBMFYSA-N	310.397	4.552	5	20	DJBD	
O=[N+]([O-])c1ccc(CN2CCC[C@H]2c2ccsc2)cc1Cl	783525894	BSJIWAIWCOXHOK-AWEZNQCLSA-N	322.817	4.647	5	20	DJBD	
O=C(c1ccc([N+](=O)[O-])cc1)c1cc2c(ccc3ccccc32)o1	15215847	PCOARMSEJCFXCJ-UHFFFAOYSA-N	317.300	4.725	5	20	DJBD	
CCSc1ccccc1[C@H](C)NCc1ccccc1[N+](=O)[O-]	89511938	UUJBNFSUDUGJHP-ZDUSSCGKSA-N	316.426	4.558	5	20	DJBD	
C[C@H](Nc1ccc2oc(C3CC3)nc2c1)c1ccc([N+](=O)[O-])cc1	192744176	FZFVOKKXEIBHLH-NSHDSACASA-N	323.352	4.787	5	20	DJBD	
O=[N+]([O-])c1cccc2ccc(/C=C/C=C\c3ccccc3)nc12	476935094	YWVQCPCGZKBAJK-WNEGIOFOSA-N	302.333	4.870	5	20	DJBD	
O=[N+]([O-])c1cccc2ccc(/C=C/c3c(F)cccc3F)nc12	6431912	LMKINNLXVJPGGS-MDZDMXLPSA-N	312.275	4.592	5	20	DJBD	
Cc1cc(C(=O)Nc2c(C)cccc2C(C)C)cc([N+](=O)[O-])c1	121834846	ULKVKPORYPYEQN-UHFFFAOYSA-N	312.369	4.587	5	20	DJBD	
O=[N+]([O-])c1cccnc1N[C@@H](c1ccc(Cl)cc1)C1CCC1	303154150	DANOYKBWPJBUGM-OAHLLOKOSA-N	317.776	4.597	5	20	DJBD	
Cc1cnc(Oc2ccc(Oc3ccccc3)cc2)c([N+](=O)[O-])c1	463058607	WQYZRGHXXFTPON-UHFFFAOYSA-N	322.320	4.883	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H]2CCc3c(C)cccc32)cc1[N+](=O)[O-]	540179317	QTVNWMVRIBHHTJ-KDOFPFPSSA-N	310.397	4.550	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H](C)c2c(C)cccc2C)cc1[N+](=O)[O-]	544897200	BKKYKTKXBLWCBV-HOTGVXAUSA-N	312.413	4.932	5	20	DJBD	
O=[N+]([O-])c1cc(C(F)F)ccc1N[C@H]1CCCC(F)(F)C1	596166624	WVXUWMODNNLHOK-VIFPVBQESA-N	306.259	4.522	5	20	DJBD	
Cc1cc([C@H](C)Nc2ccc3ncccc3c2[N+](=O)[O-])c(C)o1	320812999	LSADXCHREOYDPE-NSHDSACASA-N	311.341	4.526	5	20	DJBD	
CSc1ccccc1CN(C)[C@@H](C)c1ccccc1[N+](=O)[O-]	471026290	VXVPWSOMQUWRKM-ZDUSSCGKSA-N	316.426	4.510	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](c1ccccc1)C(C)C	485799932	KKIHFMNSRDBPSH-HNAYVOBHSA-N	312.413	4.951	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H]2C[C@@H](C)c3ccccc32)cc1[N+](=O)[O-]	552905518	HFTAUVAMFXROLV-QWQRMKEZSA-N	310.397	4.802	5	20	DJBD	
O=[N+]([O-])c1ccc(/C=C\c2nc3cc(Cl)ccc3o2)cc1	33474318	AKDKJEGPMWYAIE-BAQGIRSFSA-N	300.701	4.560	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H](C)CCCC(F)(F)F)cc1[N+](=O)[O-]	480215582	RVSGTMBGEDJFPY-RYUDHWBXSA-N	318.339	4.675	5	20	DJBD	
CC(=O)c1ccc(N[C@@H](C)c2cc(C)cc(C)c2)c([N+](=O)[O-])c1	501278460	BOAMAEIWJXUHGH-ZDUSSCGKSA-N	312.369	4.587	5	20	DJBD	
Cc1ccc(C)c2c(C)c(C(=O)Nc3ccc([N+](=O)[O-])cc3)oc12	512600708	ZXOICUXXDVPDIK-UHFFFAOYSA-N	324.336	4.519	5	20	DJBD	
CC[C@@H](NCc1cc([N+](=O)[O-])ccc1Cl)c1cccc(C)c1	796838645	KHYNXSDRAYEJBB-QGZVFWFLSA-N	318.804	4.798	5	20	DJBD	
O=[N+]([O-])c1cnc(Nc2ccc(Nc3ccccc3)cc2)s1	443404946	IGKRPDWNLLVVKA-UHFFFAOYSA-N	312.354	4.539	5	20	DJBD	
Cc1cccc(C(C)(C)NCc2ccc([N+](=O)[O-])c(Cl)c2)c1	761528055	XYIBPTXVMUVEIL-UHFFFAOYSA-N	318.804	4.582	5	20	DJBD	
Fc1ccc(CNCc2c3ccccc3cc3ccccc23)nc1	763518637	MPHWLPFQRKYWBR-UHFFFAOYSA-N	316.379	4.817	5	20	DJBD	
O=[N+]([O-])c1cccc(CNc2cccc(-c3cccs3)c2)c1	462239788	SYOGFFCKFYHAJB-UHFFFAOYSA-N	310.378	4.935	5	20	DJBD	
CC(=O)c1cc(N[C@@H](C)c2cc3ccccc3o2)ccc1[N+](=O)[O-]	557650428	KKWZQYINZRZVKH-NSHDSACASA-N	324.336	4.717	5	20	DJBD	
O=[N+]([O-])c1c(Cl)cccc1Oc1nc2ccccc2s1	814901327	JBCIMBVTURJVME-UHFFFAOYSA-N	306.730	4.650	5	20	DJBD	
O=[N+]([O-])c1ccc(N[C@H]2CCSc3ccccc32)c(Cl)c1	22805169	DCNNLQIPWOSJMU-ZDUSSCGKSA-N	320.801	4.897	5	20	DJBD	
C[C@@H](Nc1ncc(Cl)cc1[N+](=O)[O-])c1cc2ccccc2o1	301735973	HGLMMJBSGXEQHJ-SECBINFHSA-N	317.732	4.563	5	20	DJBD	
Cc1c(CNc2cccc(OCC(C)C)c2)cccc1[N+](=O)[O-]	462247413	POGJCOBUHFNJJW-UHFFFAOYSA-N	314.385	4.550	5	20	DJBD	
Cc1ccc([C@H]2CCCN2Cc2cccc([N+](=O)[O-])c2C)cc1	514245414	XJQNSZCYYINKSY-LJQANCHMSA-N	310.397	4.549	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H]2C[C@H](C)c3ccccc32)cc1[N+](=O)[O-]	552905519	HFTAUVAMFXROLV-SUNYJGFJSA-N	310.397	4.802	5	20	DJBD	
Cc1c(CN(C)[C@@H](C)c2cccc(Cl)c2)cccc1[N+](=O)[O-]	603856668	RKKONNTWPVSSLA-ZDUSSCGKSA-N	318.804	4.750	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H](C)c2c(F)cccc2F)cc1[N+](=O)[O-]	79723064	KGPAQHMSYXIRCE-NEPJUHHUSA-N	320.339	4.593	5	20	DJBD	
O=[N+]([O-])c1ccc(/C(=C/c2ccc(F)cc2)c2ccncc2)cc1	215736452	OXBNYOWUDGDYSS-UYRXBGFRSA-N	320.323	4.718	5	20	DJBD	
CC(C)(C)C[C@@H](NCc1ccccc1[N+](=O)[O-])c1ccccc1	390359820	CMYZYZMJUACQGG-QGZVFWFLSA-N	312.413	4.862	5	20	DJBD	
Cc1c([C@@H](C)N[C@@H](c2cccs2)C2CC2)cccc1[N+](=O)[O-]	480241487	PBMWJKICRMFFNW-SJKOYZFVSA-N	316.426	4.767	5	20	DJBD	
CC[C@@H](CC(F)(F)F)NCc1ccc(C(C)C)c([N+](=O)[O-])c1	546879113	TYCDTXLUTHWIEI-LBPRGKRZSA-N	318.339	4.539	5	20	DJBD	
O=C(OCc1nc2ccccc2c2ccccc12)C1(F)CCCC1	772790133	NQZBRRINDKRNBA-UHFFFAOYSA-N	323.367	4.714	5	20	DJBD	
O=[N+]([O-])c1ccc2sc(/C=C/c3ccc(F)cc3)nc2c1	7746141	VYYLUHCDKOIBCQ-FPYGCLRLSA-N	300.314	4.514	5	20	DJBD	
CC(C)(C)[C@@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1	42800667	STZFNOPVZGWAIK-KRWDZBQOSA-N	316.376	4.611	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1ccc(F)c(Cl)c1	531961782	ITUZSURAXGYIBE-NSHDSACASA-N	322.767	4.547	5	20	DJBD	
Cc1ccc(CNc2ccc(-c3ccccc3)cn2)cc1[N+](=O)[O-]	603934331	RYECRQIYKHWSPC-UHFFFAOYSA-N	319.364	4.577	5	20	DJBD	
Cc1ccc2oc(Oc3cc([N+](=O)[O-])c(Cl)cc3C)nc2c1	735669703	VJLLABKTUCTKBX-UHFFFAOYSA-N	318.716	4.799	5	20	DJBD	
CCCCC[C@@H](NC(=O)c1cc(C)ccc1[N+](=O)[O-])C(C)(C)C	741931376	FSILVQGTEABQKZ-MRXNPFEDSA-N	320.433	4.628	5	20	DJBD	
COc1ccc([N+](=O)[O-])cc1CNc1ccc(C(C)(C)C)cc1	319843932	PAUDCAVUKBINIV-UHFFFAOYSA-N	314.385	4.513	5	20	DJBD	
C[C@H](Sc1nc2ccccc2o1)c1ccccc1[N+](=O)[O-]	463029978	UTBFRNJOPSZOMU-JTQLQIEISA-N	300.339	4.589	5	20	DJBD	
Cc1ccc([C@@H](C)NCc2c(Cl)cccc2[N+](=O)[O-])cc1C	494814198	ZIBNZVNMJVLACD-CYBMUJFWSA-N	318.804	4.716	5	20	DJBD	
C[C@@H](N[C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(C2CC2)cc1	417356294	PASRIKHKZBNJRX-ZIAGYGMSSA-N	310.397	4.884	5	20	DJBD	
C[C@H](N[C@H](C)c1ccc(F)c(Cl)c1)c1ccc([N+](=O)[O-])cc1	178649667	DFEVCNITRGYSSW-WDEREUQCSA-N	322.767	4.799	5	20	DJBD	
CC[C@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1	451107877	UJLFFODGKZSTOI-SJCJKPOMSA-N	302.349	4.536	5	20	DJBD	
CCc1ccc([C@@H](C)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)s1	453251328	ZJEFYLNABGOKST-NWDGAFQWSA-N	304.415	4.631	5	20	DJBD	
CC(C)Oc1ccc(N[C@H](C)c2ccc([N+](=O)[O-])cc2)c(F)c1	777290848	KYORGNPUJUOQLC-GFCCVEGCSA-N	318.348	4.694	5	20	DJBD	
O=C(Nc1cccc(-c2cccs2)c1)c1ccc([N+](=O)[O-])cc1	505856214	UZRBOOQNYOYOOF-UHFFFAOYSA-N	324.361	4.576	5	20	DJBD	
Cc1cc(CN[C@H](C)c2cccc([N+](=O)[O-])c2C)ccc1Cl	544606932	NGRVAQDRPLMHFA-CYBMUJFWSA-N	318.804	4.716	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)CCCC1CCCC1	570857953	RHVBOEUIKYINGQ-UHFFFAOYSA-N	304.390	4.511	5	20	DJBD	
O=[N+]([O-])c1ccc(CNc2ccc(C3CC3)cc2)c(Cl)c1	611721437	BOOIERQOEHAXPE-UHFFFAOYSA-N	302.761	4.738	5	20	DJBD	
C[C@H](Nc1ccccc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1	249702892	ZHJGUDLIWODFRY-JTQLQIEISA-N	310.275	4.787	5	20	DJBD	
CCCOc1cccc(N[C@@H](C)c2ccccc2[N+](=O)[O-])c1	315866715	MYKABEOHTALVMD-ZDUSSCGKSA-N	300.358	4.557	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H]1CCCc2ccccc21	532442732	URIJFDGNIZUSGY-AUUYWEPGSA-N	310.397	4.631	5	20	DJBD	
COc1ccc([N+](=O)[O-])cc1CNc1c(C)cccc1C(C)C	863996912	DZSKXKSJOHMUAQ-UHFFFAOYSA-N	314.385	4.647	5	20	DJBD	
COc1ccc(CSc2sccc2[N+](=O)[O-])cc1Cl	302690507	CFJWBZUOAJFJLP-UHFFFAOYSA-N	315.803	4.611	5	20	DJBD	
CC(C)Oc1cccc([C@H](C)Nc2ccc([N+](=O)[O-])cc2)c1	515550197	DVMSPKXRFCOJOT-ZDUSSCGKSA-N	300.358	4.555	5	20	DJBD	
CCC[C@H](NCc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1	539244457	WRWWWDZSNYYMID-INIZCTEOSA-N	318.804	4.879	5	20	DJBD	
Cc1cccc([C@H](C)NCc2ccc([N+](=O)[O-])c(Cl)c2)c1C	783627447	VACYQVSKBWFODI-ZDUSSCGKSA-N	318.804	4.716	5	20	DJBD	
c1ccc2c(c1)nc(CSC1=NCCS1)c1ccccc12	915446649	PPXCFXOKPSUXSK-UHFFFAOYSA-N	310.447	4.724	5	20	DJBD	
CC[C@H](C)n1ncc(N[C@@H](C)c2cccc([N+](=O)[O-])c2C)c1C	477929361	RIMOHAFVURLCSA-AAEUAGOBSA-N	316.405	4.552	5	20	DJBD	
C[C@@H](N[C@@H](c1ccccc1)C1CCC1)c1ccc([N+](=O)[O-])cc1	482448961	GXYLFTAHJIBTRK-KUHUBIRLSA-N	310.397	4.787	5	20	DJBD	
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@@H]1c1ccccc1	498837509	LOYIBMXZUOODTK-CYBMUJFWSA-N	322.286	4.565	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)SCc1scnc1C	1117687489	MXYOPZRAESOKQB-LLVKDONJSA-N	308.428	4.663	5	20	DJBD	
C[C@@H](N[C@H]1CCc2c(Cl)cccc21)c1ccc([N+](=O)[O-])cc1	178649499	LKYHVBIAYCVJQX-DIFFPNOSSA-N	316.788	4.586	5	20	DJBD	
Cc1c(CN[C@@H](C)c2ccc(F)c(Cl)c2)cccc1[N+](=O)[O-]	180735280	ZTUPMCLMUKJJSH-NSHDSACASA-N	322.767	4.547	5	20	DJBD	
CC(C)(C)[C@@H](NCc1c(F)cccc1[N+](=O)[O-])c1ccccc1	505891259	IVWJZZVGMJIGJY-KRWDZBQOSA-N	316.376	4.611	5	20	DJBD	
Cc1ccc(CN[C@@H](c2ccccc2)C2CCCC2)cc1[N+](=O)[O-]	520216987	BDBIPIJDXHOGOV-FQEVSTJZSA-N	324.424	4.924	5	20	DJBD	
Cc1cc(C)cc([C@@H](C)NCc2ccc(Cl)cc2[N+](=O)[O-])c1	538205282	WJPQPRRYKAUTFL-CYBMUJFWSA-N	318.804	4.716	5	20	DJBD	
CC[C@@H](N[C@@H]1CCc2c(C)cccc21)c1cccc([N+](=O)[O-])c1	539081399	YAHQPBAJNKNBRO-RTBURBONSA-N	310.397	4.631	5	20	DJBD	
Cc1nc(Sc2c(Cl)cc([N+](=O)[O-])cc2Cl)oc1C	548117133	PYLXXFXUXWOCLX-UHFFFAOYSA-N	319.169	4.658	5	20	DJBD	
COc1ccccc1[C@@H](C)Sc1ncc(Cl)cc1[N+](=O)[O-]	434954835	KTWNJXDDGIJJJE-SECBINFHSA-N	324.789	4.505	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](C)c1cccc(C)c1C	492934509	CDKGAIJKKMOYBC-JKSUJKDBSA-N	312.413	4.932	5	20	DJBD	
C[C@@H]1CN(C(=O)c2cc3ccccc3c3cccnc23)CC[C@H]1C	501626197	IGBJTTYPWKEXCN-HUUCEWRRSA-N	318.420	4.506	5	20	DJBD	
C[C@@H](c1ccccc1F)N(C)Cc1ccc(Cl)cc1[N+](=O)[O-]	523841105	KXRXCPIVMQSTET-NSHDSACASA-N	322.767	4.580	5	20	DJBD	
C[C@@H](Nc1ccc([N+](=O)[O-])s1)c1cccc(C(F)(F)F)c1	604408813	SXCYZASNOBBRHC-MRVPVSSYSA-N	316.304	4.848	5	20	DJBD	
C[C@H](c1cccs1)N(C)Cc1ccc(Cl)cc1[N+](=O)[O-]	609705236	JHIPMJCTTVULIE-SNVBAGLBSA-N	310.806	4.503	5	20	DJBD	
Cc1cccc(OCc2cccc(C(F)(F)F)c2)c1[N+](=O)[O-]	915664583	PCGMFGJPULPKFK-UHFFFAOYSA-N	311.259	4.501	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1CNc1ccc(Cl)cc1F	50443719	TWSBJHMODKCCIQ-UHFFFAOYSA-N	315.131	4.653	5	20	DJBD	
Cc1ccc2c(c1)CC[C@H]2N[C@H](C)c1cccc([N+](=O)[O-])c1C	536825197	FNAMVLXVVSUIPP-RDTXWAMCSA-N	310.397	4.550	5	20	DJBD	
Cc1ccc2c(c1)[C@@H](N[C@H](C)c1cc([N+](=O)[O-])ccc1C)CC2	611335711	PUOYJTKKQSIQMK-KUHUBIRLSA-N	310.397	4.550	5	20	DJBD	
O=[N+]([O-])c1ccc(F)cc1CNc1ccc(C2CCC2)cc1	783276219	AVYKWYHXYGPDKL-UHFFFAOYSA-N	300.333	4.614	5	20	DJBD	
CCOc1cc(CNc2ccc(C)c(Cl)c2)ccc1[N+](=O)[O-]	863996639	RLBNIBBBUZUFKJ-UHFFFAOYSA-N	320.776	4.567	5	20	DJBD	
C[C@H](Nc1ccc([N+](=O)[O-])cc1F)c1ccc(F)cc1Cl	43474158	SHSYWYYBEHNBGL-QMMMGPOBSA-N	312.703	4.700	5	20	DJBD	
O=[N+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)cs2)cc1	71971760	MVRISWNFMDPSOO-UHFFFAOYSA-N	300.314	4.524	5	20	DJBD	
CC[C@@H](C)n1ncc(N[C@H](C)c2cccc([N+](=O)[O-])c2C)c1C	477929362	RIMOHAFVURLCSA-DGCLKSJQSA-N	316.405	4.552	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H](C)c2cc(C)c(C)o2)cc1[N+](=O)[O-]	502467978	ZSSGLBRALSPPTC-QWHCGFSZSA-N	302.374	4.525	5	20	DJBD	
CSc1ccccc1[C@H](C)Nc1cccc(F)c1[N+](=O)[O-]	799327211	OXJCGIMJDMUOIZ-JTQLQIEISA-N	306.362	4.629	5	20	DJBD	
C[C@@H]1C[C@H](c2ccccc2)CN1[C@H](C)c1ccccc1[N+](=O)[O-]	441399102	UOKCDYHUYZVBAH-INMHGKMJSA-N	310.397	4.534	5	20	DJBD	
O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@H](c1ccccc1)C1CC1)CCC2	447533164	ZJDBCXZGGXAZEQ-WOJBJXKFSA-N	322.408	4.713	5	20	DJBD	
Cc1cc([C@@H](C)NCc2ccc(Cl)cc2[N+](=O)[O-])ccc1F	451167602	VIGJXNQLDXTLNE-LLVKDONJSA-N	322.767	4.547	5	20	DJBD	
C[C@@H](CC(F)(F)F)Nc1ccc([N+](=O)[O-])c(OC(C)(C)C)c1	463745759	LUVHYMMOIYSHCA-VIFPVBQESA-N	320.311	4.525	5	20	DJBD	
CCC(CC)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1	520932333	APPLCNFQPSBFOF-UHFFFAOYSA-N	304.415	4.602	5	20	DJBD	
Cc1nnc(NCc2c3ccccc3c(Cl)c3ccccc23)o1	777504809	HKCWSGXXTNHRHM-UHFFFAOYSA-N	323.783	4.950	5	20	DJBD	
CC[C@@H](NCc1ccc([N+](=O)[O-])c(F)c1)c1ccc(Cl)cc1	801527523	MITPCLBVZXPBDK-OAHLLOKOSA-N	322.767	4.628	5	20	DJBD	
Cc1csc([C@@H](Nc2ccc(Cl)cc2[N+](=O)[O-])C2CC2)n1	301742876	FQNSTRGFROZOSL-ZDUSSCGKSA-N	323.805	4.576	5	20	DJBD	
COc1cccc(CS[C@@H](C)c2ccccc2[N+](=O)[O-])c1	463251712	YFRYERCNTPZXMN-LBPRGKRZSA-N	303.383	4.598	5	20	DJBD	
Cc1ccsc1[C@H](C)NCCc1ccc(Cl)cc1[N+](=O)[O-]	495415426	PWRQFMJDMJSRFX-NSHDSACASA-N	324.833	4.511	5	20	DJBD	
Cc1cc(N[C@H]2CCSc3c(F)cccc32)ccc1[N+](=O)[O-]	315124026	IYYXKAOGVDVQLZ-AWEZNQCLSA-N	318.373	4.691	5	20	DJBD	
CC(C)[C@@H]1C[C@@H](NCc2ccc([N+](=O)[O-])cc2)c2ccccc21	447581819	WJIURVFDRULGGO-RBUKOAKNSA-N	310.397	4.569	5	20	DJBD	
O=[N+]([O-])c1cc(C(F)F)ccc1N[C@@H]1CCc2cc(F)ccc21	590573954	KUDNAKZWJLURBT-CYBMUJFWSA-N	322.286	4.771	5	20	DJBD	
CC(=O)c1ccc(N[C@@H]2CCC[C@@H]2c2ccccc2)c([N+](=O)[O-])c1	609514011	POUVAIUQHARPEY-IAGOWNOFSA-N	324.380	4.546	5	20	DJBD	
O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H]2CC=CCC2)s1	609902335	UBGAEJITQRACID-ZDUSSCGKSA-N	314.410	4.522	5	20	DJBD	
CC[C@@H](NCc1cccc([N+](=O)[O-])c1C)c1cccc(Cl)c1	195673452	CHDBJUFYQXYTRZ-MRXNPFEDSA-N	318.804	4.798	5	20	DJBD	
CCC[C@@H](NCc1cc(F)ccc1F)c1cccc([N+](=O)[O-])c1	320418420	JCNSLCNAJXYDLX-QGZVFWFLSA-N	320.339	4.504	5	20	DJBD	
O=[N+]([O-])c1ccccc1CNCc1ccc(C2CCCC2)cc1	462790637	LXUWSTDYRJORJP-UHFFFAOYSA-N	310.397	4.542	5	20	DJBD	
Cc1cc([N+](=O)[O-])ccc1NCc1ccc(-c2ccncc2)cc1	474150427	NPGSKHKOCUZAFK-UHFFFAOYSA-N	319.364	4.577	5	20	DJBD	
CCSc1cccc(N[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1	538628489	RAIOUKUPZHKRBS-LBPRGKRZSA-N	302.399	4.880	5	20	DJBD	
C[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1nccc2ccccc12	562082643	SNJDSUWZWXJHPC-KGLIPLIRSA-N	321.380	4.555	5	20	DJBD	
Cc1noc(CS[C@@H](C)c2ccccc2Cl)c1[N+](=O)[O-]	596024724	XDFXDMSKDDFRNS-VIFPVBQESA-N	312.778	4.539	5	20	DJBD	
CN(C(=O)c1c2ccccc2cc2ccccc12)[C@@H]1CCSC1	813095363	SKPNBPZRVBCOPB-MRXNPFEDSA-N	321.445	4.571	5	20	DJBD	
CC(=O)c1cc(NCc2ccc(C(C)C)cc2)ccc1[N+](=O)[O-]	561157097	HLJYCGWADOLEBZ-UHFFFAOYSA-N	312.369	4.533	5	20	DJBD	
CCOCCCCNC(=O)c1c2ccccc2cc2ccccc12	1116184624	JFLHBTPREVLFMK-UHFFFAOYSA-N	321.420	4.540	5	20	DJBD	
O=[N+]([O-])c1ccc(-c2nc(CSc3ccccc3)co2)cc1	89660564	CPSFUHMEYAZUFS-UHFFFAOYSA-N	312.350	4.542	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H](C)c2ccccc2Cl)cc1[N+](=O)[O-]	219863343	CWOAXNDBXRCANB-OLZOCXBDSA-N	318.804	4.968	5	20	DJBD	
Cc1c(CN[C@H](CC(C)C)c2cccs2)cccc1[N+](=O)[O-]	543486426	ICKUPENMHAZJMJ-OAHLLOKOSA-N	318.442	4.842	5	20	DJBD	
CC[C@@H](O)CCCNCc1c2ccccc2cc2ccccc12	742373900	UTHYDUFUTMOESM-GOSISDBHSA-N	307.437	4.634	5	20	DJBD	
Cc1cc([C@H](C)N[C@@H](C)c2ccccc2[N+](=O)[O-])c(C)s1	37122942	XUCNQSUNQCPGOM-RYUDHWBXSA-N	304.415	4.685	5	20	DJBD	
CSCc1ccc(N[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1	178653609	JXSOLAMZLXIAII-GFCCVEGCSA-N	302.399	4.631	5	20	DJBD	
Cc1c(N[C@H](C)c2ccccc2[N+](=O)[O-])cccc1-c1ncco1	427458959	OVAOEZLDKZOGDI-CYBMUJFWSA-N	323.352	4.731	5	20	DJBD	
O=[N+]([O-])c1ccc(CN2CCC[C@H]2c2cccs2)c(Cl)c1	542923384	FFEIMFHBWJTFLR-AWEZNQCLSA-N	322.817	4.647	5	20	DJBD	
C[C@H](NCc1ccccc1[N+](=O)[O-])c1csc2ccccc12	754738360	LODZSTJCXDGFSO-LBPRGKRZSA-N	312.394	4.660	5	20	DJBD	
CSc1cccc(NCc2ccc(Cl)cc2[N+](=O)[O-])c1	50443035	WJGFTVLPOQQABC-UHFFFAOYSA-N	308.790	4.582	5	20	DJBD	
CC[C@@H](N[C@@H]1CCCc2sccc21)c1cccc([N+](=O)[O-])c1	102196707	HSTAMSJLYNSWDV-HZPDHXFCSA-N	316.426	4.775	5	20	DJBD	
Cc1cc2cc(C(=O)Nc3cccc([N+](=O)[O-])c3C)oc2cc1C	463219707	QCRYGLWMNIZXBB-UHFFFAOYSA-N	324.336	4.519	5	20	DJBD	
CCC(=O)c1ccc(N[C@@H](CC)c2cccs2)c([N+](=O)[O-])c1	480069390	FVXDODCYSDLXCA-LBPRGKRZSA-N	318.398	4.812	5	20	DJBD	
CC(C)Oc1ccccc1[C@H](C)Nc1ccccc1[N+](=O)[O-]	603862374	NMBSZPJCRAQNHW-ZDUSSCGKSA-N	300.358	4.555	5	20	DJBD	
CCC[C@@H](Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccn1	609585843	QOGKWSRCELKUIY-OAHLLOKOSA-N	305.765	4.597	5	20	DJBD	
O=[N+]([O-])c1cccc(-c2nnc(-c3cc4ccccc4s3)o2)c1	1328071140	SSNYZQBHEOXNFU-UHFFFAOYSA-N	323.333	4.527	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1C[C@H](c2ccccc2)C1	574509556	CTTJUTHDWPQSMU-XIRDDKMYSA-N	310.397	4.500	5	20	DJBD	
CC(C)N(Cc1cccs1)Cc1ccc(Cl)cc1[N+](=O)[O-]	609705179	AEZASKHTDOEJGQ-UHFFFAOYSA-N	324.833	4.720	5	20	DJBD	
O=C(CC1CCC1)OCc1nc2ccccc2c2ccccc12	745570632	IHSBWBYSYSUQIN-UHFFFAOYSA-N	305.377	4.621	5	20	DJBD	
CO[C@@H](C)c1cccc(NCc2c(Cl)cccc2[N+](=O)[O-])c1	155527502	XPVJZUSFSRUABA-NSHDSACASA-N	320.776	4.568	5	20	DJBD	
CCC[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccsc1	191223017	UONQJQPETJYWEN-BLLLJJGKSA-N	304.415	4.848	5	20	DJBD	
CC(C)c1nc(CSCc2cccc([N+](=O)[O-])c2)cs1	195539647	SKXBHQDVGRKERA-UHFFFAOYSA-N	308.428	4.608	5	20	DJBD	
Cc1ccc([C@H](C)NCc2cccc3ccccc23)cc1[N+](=O)[O-]	237502651	VMQSDKOPOQVHPK-HNNXBMFYSA-N	320.392	4.907	5	20	DJBD	
Cc1c([C@@H](C)NCc2ccc3ccccc3c2)cccc1[N+](=O)[O-]	537937915	FRSKZQDLDGLGMR-OAHLLOKOSA-N	320.392	4.907	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H]1CCCc2sccc21	545235848	PYWXCECEIUBMRL-WBMJQRKESA-N	316.426	4.693	5	20	DJBD	
CCCC(C)(C)NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1	609544452	DYSJBDLRXCFHMP-UHFFFAOYSA-N	302.374	4.523	5	20	DJBD	
C[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1	19995584	QRMVPIIJCUGLII-NWDGAFQWSA-N	304.777	4.660	5	20	DJBD	
O=[N+]([O-])c1ccccc1Oc1ccc(Sc2ccncc2)cc1	60381361	FBWNZMQROVZSFS-UHFFFAOYSA-N	324.361	4.933	5	20	DJBD	
CCC[C@@H](N[C@H](C)c1ccsc1)c1cccc([N+](=O)[O-])c1	61361086	QFOKHTHCPKSUKB-MLGOLLRUSA-N	304.415	4.848	5	20	DJBD	
CC[C@@H](N[C@@H](C)c1c(F)cccc1F)c1cccc([N+](=O)[O-])c1	119653888	RWCMGXXTFGTIQO-MEDUHNTESA-N	320.339	4.675	5	20	DJBD	
O=[N+]([O-])c1ccc2c(c1)[C@H](NCc1cc3ccccc3o1)CCC2	192718538	PGADOWHEDPFNPJ-GOSISDBHSA-N	322.364	4.508	5	20	DJBD	
Cc1cc(OCCCCOC(C)(C)C)c(Cl)cc1[N+](=O)[O-]	506423201	QSPRABMEMINCRO-UHFFFAOYSA-N	315.797	4.531	5	20	DJBD	
C[C@H](Sc1cccc([N+](=O)[O-])c1)c1ncc(C(C)(C)C)o1	509670321	YYEMIGVIZDVGFW-JTQLQIEISA-N	306.387	4.734	5	20	DJBD	
Cc1cccc2c1CC[C@H]2N[C@H]1CCCc2ccc([N+](=O)[O-])cc21	562603588	SUUDMYIZLIEGRU-VQTJNVASSA-N	322.408	4.558	5	20	DJBD	
CC(C)n1c(-c2csc([N+](=O)[O-])c2)nc2cc(Cl)ccc21	603836126	ZPFHKRAJQGQQET-UHFFFAOYSA-N	321.789	4.907	5	20	DJBD	
Cc1ccnc(CS[C@H](C)c2cc([N+](=O)[O-])ccc2C)c1	1255680821	AMPYUELTTQFYFS-CYBMUJFWSA-N	302.399	4.601	5	20	DJBD	
CC(C)c1nc([C@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cs1	173429836	PCUDARXLGBYDLI-RYUDHWBXSA-N	319.430	4.587	5	20	DJBD	
O=[N+]([O-])c1ccccc1-c1ccc(CNCc2ccccc2)s1	237956632	QXYNAWMFEXEINX-UHFFFAOYSA-N	324.405	4.613	5	20	DJBD	
CCCOc1cccc(N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1	315523153	IGKAHRPCVSDDEZ-ZDUSSCGKSA-N	300.358	4.557	5	20	DJBD	
C[C@@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccccc1Cl	517959831	HHUBNMWLYNSTQA-BDJLRTHQSA-N	316.788	4.586	5	20	DJBD	
CC[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1F	180247025	YLENORYDLDPYGP-PXAZEXFGSA-N	302.349	4.536	5	20	DJBD	
CCSc1cccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)c1	185473146	LXORAQMBZBWPJD-CYBMUJFWSA-N	316.426	4.558	5	20	DJBD	
CCOc1cc(CNc2ccccc2C(F)F)ccc1[N+](=O)[O-]	424566822	KANNGFGTJJNDNJ-UHFFFAOYSA-N	322.311	4.543	5	20	DJBD	
C[C@@H](NCc1cc2ccccc2s1)c1cccc([N+](=O)[O-])c1	556218033	PIBDBDQWNSDBAF-GFCCVEGCSA-N	312.394	4.660	5	20	DJBD	
Cc1cc(Cl)cc(CN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1	569438140	ZURJZYMYMPKLDW-ZDUSSCGKSA-N	318.804	4.716	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)cc1CSc1ncccc1Cl	746388955	KECBLLIRRNSFMZ-UHFFFAOYSA-N	315.181	4.589	5	20	DJBD	
CCC1(C(=O)Nc2cccc([N+](=O)[O-])c2Cl)CCCCC1	813245691	WVQZSULVDASZAZ-UHFFFAOYSA-N	310.781	4.547	5	20	DJBD	
O=[N+]([O-])c1cccnc1SCc1ccc(Cl)cc1Cl	49418426	MZSWBMJFBDHUHR-UHFFFAOYSA-N	315.181	4.589	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1cc2ccccc2o1	133776897	VPAFMJWWHJZKME-CYBMUJFWSA-N	310.353	4.500	5	20	DJBD	
O=[N+]([O-])c1ccc(/C=C\c2nc(-c3ccccc3)cs2)cc1O	498296271	OFEQXWPYLQHKGF-CLFYSBASSA-N	324.361	4.594	5	20	DJBD	
CC[C@@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1F	180247046	YLENORYDLDPYGP-SJKOYZFVSA-N	302.349	4.536	5	20	DJBD	
Cc1nc(N[C@H](C)c2cc3ccccc3s2)ccc1[N+](=O)[O-]	301651360	JXSYHVCYYOPXEO-LLVKDONJSA-N	313.382	4.686	5	20	DJBD	
Cc1ccc([C@H](NCc2ccc([N+](=O)[O-])cc2)C2CCCC2)o1	537191575	OIOWKLRBHILKAR-GOSISDBHSA-N	314.385	4.517	5	20	DJBD	
CSc1ccc(COc2cc(Cl)ccc2[N+](=O)[O-])cc1	920992912	QIUHBIIHJXDIGI-UHFFFAOYSA-N	309.774	4.549	5	20	DJBD	
C[C@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(C2CC2)cc1	417352240	FPEYSSPLXDOZRC-KBPBESRZSA-N	310.397	4.884	5	20	DJBD	
Cc1ccnc(S[C@@H](C)c2ccc(Cl)cc2)c1[N+](=O)[O-]	522416644	MBCMDFSRNXCEEC-JTQLQIEISA-N	308.790	4.805	5	20	DJBD	
CCCCS[C@H](C)c1nc(-c2ccc(C)c([N+](=O)[O-])c2)no1	546987832	ILDCBPVKYAXPJW-LLVKDONJSA-N	321.402	4.548	5	20	DJBD	
C[C@@H](SCc1ccccc1[N+](=O)[O-])c1nc2ccccc2o1	183434187	SUCOBOADKVLTOT-LLVKDONJSA-N	314.366	4.730	5	20	DJBD	
C[C@@H](c1ccco1)N(Cc1ccc(Cl)cc1[N+](=O)[O-])C1CC1	440901476	MQNATKDMEYRUFT-NSHDSACASA-N	320.776	4.567	5	20	DJBD	
C[C@H](N[C@@H]1CCc2ccc(Cl)cc21)c1ccc([N+](=O)[O-])cc1	451103088	MLFWIPWOZNGORA-APPDUMDISA-N	316.788	4.586	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H]2CCc3c(C)cccc32)cc1[N+](=O)[O-]	540179319	QTVNWMVRIBHHTJ-KSSFIOAISA-N	310.397	4.550	5	20	DJBD	
O=C(c1c2ccccc2cc2ccccc12)N1CCC[C@H](F)C1	846743622	KLKZFMDLFSFERL-INIZCTEOSA-N	307.368	4.567	5	20	DJBD	
C[C@H](Nc1ccc([N+](=O)[O-])cc1F)c1cccc(C2CC2)c1	864019103	NTENLGCRFCYBEE-NSHDSACASA-N	300.333	4.784	5	20	DJBD	
CC(C)c1ccc(CN[C@H](C)Cc2ccsc2)cc1[N+](=O)[O-]	60527745	QWMSAWXJQJUXHG-CYBMUJFWSA-N	318.442	4.501	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H](c2ccccc2)C2CC2)cc1[N+](=O)[O-]	192796374	ZJRDIPLTXMBNQA-KUHUBIRLSA-N	310.397	4.705	5	20	DJBD	
CC[C@@H](N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccccc1F	494020884	PQXJEUVHHJTOJV-SUMWQHHRSA-N	316.376	4.844	5	20	DJBD	
C[C@H](CC1CC1)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1	497320852	YRRKSVJBBAYJMA-GFCCVEGCSA-N	316.426	4.602	5	20	DJBD	
C[C@@H](c1ccccc1[N+](=O)[O-])N1CC(C)(C)[C@@H]1c1cccs1	561964946	WRHKQZPRXGGKMY-LRDDRELGSA-N	316.426	4.800	5	20	DJBD	
CC[C@H](N[C@H]1CCCc2ccccc21)c1cccc([N+](=O)[O-])c1	195548123	LQSYDPJUAOTBRC-OALUTQOASA-N	310.397	4.713	5	20	DJBD	
O=[N+]([O-])c1ccccc1/C=C\c1nc2cc(Cl)ccc2o1	213623290	KQTYWGYZYKFSNI-YVMONPNESA-N	300.701	4.560	5	20	DJBD	
C[C@H](OC(=O)c1ccccc1[N+](=O)[O-])c1cccc2ccccc12	920496473	XHIVGKUXGHEEEQ-ZDUSSCGKSA-N	321.332	4.666	5	20	DJBD	
C[C@@H](N[C@H]1CC(C)(C)Cc2occc21)c1cccc([N+](=O)[O-])c1	155792913	FSDKQQBHXHJECM-WBMJQRKESA-N	314.385	4.552	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H](C)c2ccc(F)c(F)c2)cc1[N+](=O)[O-]	192724778	DSRLSZXEYVXZMZ-VXGBXAGGSA-N	320.339	4.593	5	20	DJBD	
O=[N+]([O-])c1ccccc1CN[C@H](c1cccs1)C1CCCC1	192836198	WHSFWZSRSFGCMG-KRWDZBQOSA-N	316.426	4.677	5	20	DJBD	
Cc1ccc([C@@H](C)N(C)c2ccc([N+](=O)[O-])c3cnccc23)cc1	303545380	IPCILTGOCXSAKP-CQSZACIVSA-N	321.380	4.649	5	20	DJBD	
CC[C@H](N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccsc1	453154128	RFGCUWRGLXFMKD-WFASDCNBSA-N	304.415	4.767	5	20	DJBD	
O=[N+]([O-])c1ccc(N2CCC[C@@H]2c2ccccc2)c(Cl)c1	836601049	BWHFSJLJFIRYAB-OAHLLOKOSA-N	302.761	4.590	5	20	DJBD	
CC[C@H](C)Oc1ccc(NCc2cccc([N+](=O)[O-])c2C)cc1	864006389	HUVXWJLNOYDQHQ-ZDUSSCGKSA-N	314.385	4.693	5	20	DJBD	
COc1cc(N[C@@H](C)c2c(F)cccc2Cl)ccc1[N+](=O)[O-]	301479828	DAUWSCYYXFZHKP-VIFPVBQESA-N	324.739	4.569	5	20	DJBD	
Cc1csc([C@@H](Nc2ccc([N+](=O)[O-])cc2Cl)C2CC2)n1	301483333	ZOMIQIGZFJHNIT-ZDUSSCGKSA-N	323.805	4.576	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](c1ccccc1)C(C)C	485799923	KKIHFMNSRDBPSH-DNVCBOLYSA-N	312.413	4.951	5	20	DJBD	
Cc1cccc2c1CC[C@H]2Nc1ccc2ncccc2c1[N+](=O)[O-]	609192923	QVLFTJLOGRTTSZ-QGZVFWFLSA-N	319.364	4.551	5	20	DJBD	
CC(C)c1ccc(CN[C@H](C)c2ccsc2)cc1[N+](=O)[O-]	619747839	HPOBQVHZFVAQCY-GFCCVEGCSA-N	304.415	4.631	5	20	DJBD	
C[C@@H](Sc1ncccc1[N+](=O)[O-])c1ccc(F)c(Cl)c1	49418405	VSJHUZQQOMMOSH-MRVPVSSYSA-N	312.753	4.636	5	20	DJBD	
CCSc1ccccc1[C@H](C)NCc1ccc([N+](=O)[O-])cc1	89513225	SZURTIVXPZGTRF-ZDUSSCGKSA-N	316.426	4.558	5	20	DJBD	
COc1cc(N[C@H](C)c2c(F)cccc2Cl)ccc1[N+](=O)[O-]	301479827	DAUWSCYYXFZHKP-SECBINFHSA-N	324.739	4.569	5	20	DJBD	
Cc1cccc2c1[C@H](C)C[C@H]2N[C@H](C)c1cccc([N+](=O)[O-])c1	504900158	SAQYCBRCIPNFSF-HBUWYVDXSA-N	310.397	4.802	5	20	DJBD	
O=[N+]([O-])c1ncccc1Oc1ccc(Cl)c2ccccc12	603836924	ILQKXHFGMFMOAX-UHFFFAOYSA-N	300.701	4.589	5	20	DJBD	
c1ccc2c(CNCC3CCOCC3)c3ccccc3cc2c1	749263609	KDWOEHQZKOBTPD-UHFFFAOYSA-N	305.421	4.509	5	20	DJBD	
COc1ccc(NCc2ccc(C)c([N+](=O)[O-])c2)c2ccccc12	864041880	UZQNJSCJGAHCSW-UHFFFAOYSA-N	322.364	4.677	5	20	DJBD	
C[C@H](SCc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F	60512331	LOXLPPOLIGTFRD-JTQLQIEISA-N	309.337	4.867	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)c1	321698766	ZQXMBMWHRFSAAE-JKSUJKDBSA-N	312.413	4.932	5	20	DJBD	
C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H]1c1ccsc1	434689390	VYRFGVXJMFLYME-DOMZBBRYSA-N	302.399	4.554	5	20	DJBD	
Cc1c(CNc2ccc3c4c(cccc24)CC3)cccc1[N+](=O)[O-]	462196453	BDKNAQPHVPCQLV-UHFFFAOYSA-N	318.376	4.767	5	20	DJBD	
C[C@H](Sc1ncc(C(C)(C)C)o1)c1ccccc1[N+](=O)[O-]	474412566	MCRIYKQNMJXYSC-JTQLQIEISA-N	306.387	4.734	5	20	DJBD	
c1ccc2c(CNc3nnc(C4CC4)o3)c3ccccc3cc2c1	777504722	FRAIZRSNXXDUBB-UHFFFAOYSA-N	315.376	4.866	5	20	DJBD	
O=[N+]([O-])c1ccc2sc(/C=C\c3ccc(F)cc3)nc2c1	211809971	VYYLUHCDKOIBCQ-BAQGIRSFSA-N	300.314	4.514	5	20	DJBD	
O=[N+]([O-])c1ccc2sc(/C=C\c3ccc(F)cc3F)nc2c1	213209836	ALPPAASKDRKRTB-KXFIGUGUSA-N	318.304	4.653	5	20	DJBD	
CSc1ccccc1[C@H](C)N[C@@H](C)c1ccc([N+](=O)[O-])cc1	440620549	ZUYKPPBBILAJIE-STQMWFEESA-N	316.426	4.729	5	20	DJBD	
Cc1ccc([C@H](N[C@@H](C)c2ccc([N+](=O)[O-])cc2)C2CC2)cc1	531688620	RGMBLIBQOFPJMP-LIRRHRJNSA-N	310.397	4.705	5	20	DJBD	
O=[N+]([O-])c1ccc(Sc2ncc(-c3ccc(F)cc3)o2)cc1	590832063	USVMMJBHFNOYMZ-UHFFFAOYSA-N	316.313	4.540	5	20	DJBD	
O=C(NCc1ccoc1)c1c2ccccc2cc2ccccc12	746522859	WDRAJJQYYJKXOL-UHFFFAOYSA-N	301.345	4.516	5	20	DJBD	
CCC[C@H](NCc1cc([N+](=O)[O-])ccc1Cl)c1ccsc1	785566055	BTYSJXNCEJVRLC-HNNXBMFYSA-N	324.833	4.941	5	20	DJBD	
CC(C)Oc1ccccc1NCc1ccc(Cl)cc1[N+](=O)[O-]	864004121	KLDKSFROLOQTBV-UHFFFAOYSA-N	320.776	4.648	5	20	DJBD	
CCCCN(CCCC)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C	443951270	STSFYAZCXFSHMH-UHFFFAOYSA-N	321.421	4.646	5	20	DJBD	
Cc1cccc(C)c1NCc1cc([N+](=O)[O-])ccc1OC(C)C	462210587	OQTDBDKCWFVYNC-UHFFFAOYSA-N	314.385	4.611	5	20	DJBD	
CC(C)(C)[C@H](NCc1ccccc1[N+](=O)[O-])c1cccc(F)c1	540432516	RNOWXTNOCKCMQC-QGZVFWFLSA-N	316.376	4.611	5	20	DJBD	
C[C@@H](N[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccsc1	619754110	CRFMOKBOACXGSC-BZNIZROVSA-N	316.426	4.730	5	20	DJBD	
CC(=O)c1ccc(Oc2ccc3ccccc3c2)c([N+](=O)[O-])c1	8147613	UJTWSMJCPUIIIU-UHFFFAOYSA-N	307.305	4.743	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)c(CSc2nc3ccccc3o2)c1	37404406	HZCQKPNTGBNWSI-UHFFFAOYSA-N	320.757	4.682	5	20	DJBD	
CC(C)NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1	61002572	DCBOLDJNHUAMNJ-UHFFFAOYSA-N	320.776	4.539	5	20	DJBD	
O=[N+]([O-])c1sccc1NCc1ccc(-c2ccccc2)o1	63263260	MKQHWOUXHVVIQZ-UHFFFAOYSA-N	300.339	4.528	5	20	DJBD	
C[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)c(Cl)c1	79723965	XWNOUPUPUHXJIZ-MNOVXSKESA-N	322.767	4.799	5	20	DJBD	
Cc1ccc([C@@H](C)NCc2ccc(C3CC3)cc2)cc1[N+](=O)[O-]	477850992	DXCXFZGVDXFCHG-CQSZACIVSA-N	310.397	4.631	5	20	DJBD	
Cc1ccccc1[C@@H](C(C)C)N(C)Cc1csc([N+](=O)[O-])c1	488694853	ITRDYIFEUVKDGS-QGZVFWFLSA-N	318.442	4.794	5	20	DJBD	
C[C@H](N[C@@H]1CC(C)(C)c2ccccc21)c1ccc([N+](=O)[O-])cc1	536846347	QGAKLZXUVSRRHU-SCLBCKFNSA-N	310.397	4.668	5	20	DJBD	
Cc1cc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2C)ccc1Cl	541767996	BADLDIXYCBHVRA-ZDUSSCGKSA-N	318.804	4.716	5	20	DJBD	
CO[C@H](CS[C@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1	583765643	AVWUNZOGBXLBDD-CXAGYDPISA-N	317.410	4.777	5	20	DJBD	
Cc1cccc2c1CC[C@@H]2Nc1ccc2ncccc2c1[N+](=O)[O-]	609192921	QVLFTJLOGRTTSZ-KRWDZBQOSA-N	319.364	4.551	5	20	DJBD	
Cc1cc([C@H](C)N[C@H](C)c2ccccc2[N+](=O)[O-])c(C)s1	37122944	XUCNQSUNQCPGOM-NEPJUHHUSA-N	304.415	4.685	5	20	DJBD	
CC(C)[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1	390683026	VBIZNRKHOGCWBU-UGSOOPFHSA-N	316.376	4.782	5	20	DJBD	
Cc1cc(NCc2cccc([N+](=O)[O-])c2C)ccc1OC(C)C	864012581	BWPNYTGPHDRJNM-UHFFFAOYSA-N	314.385	4.611	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H]2CCCc3sccc32)cc1[N+](=O)[O-]	102196729	NZIUHXNDNJKDLD-SWLSCSKDSA-N	316.426	4.693	5	20	DJBD	
C[C@@H](Nc1ncc([N+](=O)[O-])cc1Cl)c1cc2ccccc2o1	301270264	JNMFCZOBLQSWNL-SECBINFHSA-N	317.732	4.563	5	20	DJBD	
Cc1cc(N[C@H](c2ccc(Cl)cc2)C(C)C)ncc1[N+](=O)[O-]	470869433	CWLAFQCBQOXKQT-INIZCTEOSA-N	319.792	4.761	5	20	DJBD	
C[C@H](Sc1ncc([N+](=O)[O-])cc1Cl)c1cccs1	737423691	VUMHQLRPYGBJCR-ZETCQYMHSA-N	300.792	4.558	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)cc1CN[C@@H](c1cccs1)C1CC1	754121385	CLGIPUMKHGSIIT-OAHLLOKOSA-N	322.817	4.551	5	20	DJBD	
C[C@H](Nc1nc2cccc(F)c2s1)c1ccc([N+](=O)[O-])cc1	864019042	KTYFODXDPLDNMI-VIFPVBQESA-N	317.345	4.517	5	20	DJBD	
O=[N+]([O-])c1ccc2sc(/C=C/c3c(F)cccc3F)nc2c1	7746248	IVNXFVJEROFYQL-FNORWQNLSA-N	318.304	4.653	5	20	DJBD	
CC[C@H](N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1cccs1	49529260	UJFHJSOWYVDRCK-JSGCOSHPSA-N	304.415	4.767	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H](C)c2cccc(F)c2F)cc1[N+](=O)[O-]	90963239	DJLBASLGHYRJFE-RYUDHWBXSA-N	320.339	4.593	5	20	DJBD	
Cc1cc(C)cc([C@H](C)N[C@H](C)c2cc([N+](=O)[O-])ccc2C)c1	492849873	DTCJHRQQDRXFFI-JKSUJKDBSA-N	312.413	4.932	5	20	DJBD	
CC(C)(O)CNCc1c2ccccc2c(Cl)c2ccccc12	732229530	FWYPVGCTMZBSRO-UHFFFAOYSA-N	313.828	4.507	5	20	DJBD	
Cc1cc(NC(=O)c2c3ccccc3cc3ccccc23)no1	1338339195	OZGSRSBVFBYMHV-UHFFFAOYSA-N	302.333	4.542	5	20	DJBD	
Cc1cc(NCc2cccc([N+](=O)[O-])c2)ccc1-c1ccncc1	427424236	LHYPQGVWHLFSDW-UHFFFAOYSA-N	319.364	4.577	5	20	DJBD	
Cc1cc([C@@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc(C)c1F	536807227	RQOZZYHECDKSNL-UONOGXRCSA-N	316.376	4.763	5	20	DJBD	
Cc1ccc(CNc2ccc(CC(F)(F)F)cc2)cc1[N+](=O)[O-]	742373219	HYEDIKABOFLWIP-UHFFFAOYSA-N	324.302	4.620	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)cc1CN1CCC[C@@H]1c1ccsc1	746657368	GUKZSEPGTPVCBW-CQSZACIVSA-N	322.817	4.647	5	20	DJBD	
CSCc1ccc(NCc2ccc([N+](=O)[O-])c(Cl)c2)cc1	783586059	YWUOBVZYWMTLSN-UHFFFAOYSA-N	322.817	4.723	5	20	DJBD	
CCC(CC)N(CC(C)C)C(=O)Nc1cc([N+](=O)[O-])ccc1C	483848803	GXEXIVMNDVHOAD-UHFFFAOYSA-N	321.421	4.582	5	20	DJBD	
Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1sccc1C(C)C	505999757	NHROQHSKLCWHTA-UHFFFAOYSA-N	318.398	4.649	5	20	DJBD	
c1ccc2c(CNCCOCC3CC3)c3ccccc3cc2c1	731041100	QXJLZLZUTHVFIZ-UHFFFAOYSA-N	305.421	4.509	5	20	DJBD	
Cc1ccc(SCc2nc3cc([N+](=O)[O-])ccc3o2)cc1C	434806588	BHMBAIOWKLLEOL-UHFFFAOYSA-N	314.366	4.645	5	20	DJBD	
CSc1ccc(C)c(N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1	553928940	HJUUJGVWAHINBB-LBPRGKRZSA-N	302.399	4.798	5	20	DJBD	
Cc1cccc2c1CC[C@H]2Nc1ccc([N+](=O)[O-])c2cccnc12	609192845	KWXNTEGTSSDKGY-MRXNPFEDSA-N	319.364	4.551	5	20	DJBD	
CCCCn1c(S/C=C\c2ccc([N+](=O)[O-])o2)nc(C)c1C	863871547	RTUGCIMNWMCUKW-NTMALXAHSA-N	321.402	4.564	5	20	DJBD	
CC[C@H](NCc1ccc(Cl)cc1[N+](=O)[O-])c1cccs1	50443827	KAZITNIIUKVELR-LBPRGKRZSA-N	310.806	4.551	5	20	DJBD	
CCc1ccc(Oc2ccc([N+](=O)[O-])c3cnccc23)c(OC)c1	301859878	KIODEBREHVZMNA-UHFFFAOYSA-N	324.336	4.506	5	20	DJBD	
Cc1ccc([C@@H](C)NCc2ccc(C(C)C)c([N+](=O)[O-])c2)cc1	302925627	CPMOCFTZNWOKHY-OAHLLOKOSA-N	312.413	4.877	5	20	DJBD	
Cc1ccc(C[C@@H](C)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1	315330308	VSNAZPNLNLHCHZ-OCCSQVGLSA-N	318.442	4.555	5	20	DJBD	
CCC[C@@H](NC1CCC(F)(F)CC1)c1cccc([N+](=O)[O-])c1	540150186	CFCYDRIIBICPON-OAHLLOKOSA-N	312.360	4.604	5	20	DJBD	
C[C@H](N[C@H]1c2ccccc2CC[C@@H]1C)c1cccc([N+](=O)[O-])c1	541846873	DXUSZBBZJDREQW-CKFHNAJUSA-N	310.397	4.569	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H](C)c2c(C)cccc2C)cc1[N+](=O)[O-]	544897201	BKKYKTKXBLWCBV-HZPDHXFCSA-N	312.413	4.932	5	20	DJBD	
O=[N+]([O-])c1ccc2sc(/C=C\c3c(F)cccc3F)nc2c1	211814443	IVNXFVJEROFYQL-ALCCZGGFSA-N	318.304	4.653	5	20	DJBD	
O=[N+]([O-])c1ccccc1Nc1cccc(Oc2ccccn2)c1	463068308	KJLWPNYVKKUZOQ-UHFFFAOYSA-N	307.309	4.526	5	20	DJBD	
CCN(Cc1cccc([N+](=O)[O-])c1C)[C@@H](C)c1ccc(F)cc1	507719512	SVMQYIQAJUSLON-AWEZNQCLSA-N	316.376	4.625	5	20	DJBD	
O=[N+]([O-])c1cccc(F)c1Oc1ccc(-c2ccccc2)nc1	557617680	BEDODAGXZKOQKX-UHFFFAOYSA-N	310.284	4.588	5	20	DJBD	
CC(C)c1ccc(CN[C@@H](C)c2ccsc2)cc1[N+](=O)[O-]	619747840	HPOBQVHZFVAQCY-LBPRGKRZSA-N	304.415	4.631	5	20	DJBD	
C[C@@H](NCc1ccccc1[N+](=O)[O-])c1ccc(C(C)(C)C)cc1	319751291	YZCFGXFRDXCRIN-CQSZACIVSA-N	312.413	4.743	5	20	DJBD	
CC[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1cccc(F)c1	186842570	AXVMSVIXLWDSJS-PXAZEXFGSA-N	302.349	4.536	5	20	DJBD	
Cc1ccc([C@H](C)Nc2ccc3cc([N+](=O)[O-])ccc3n2)s1	301111273	WKGUBERHMPXGIM-NSHDSACASA-N	313.382	4.686	5	20	DJBD	
Cc1ccc([C@@H](C)Nc2ccc3cc([N+](=O)[O-])ccc3n2)cc1	320462939	ZRVDJEWDOAFWEW-CYBMUJFWSA-N	307.353	4.625	5	20	DJBD	
Cc1cc([C@H](C)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)ccc1F	611336106	JCDGYDOCWKJTHV-UONOGXRCSA-N	316.376	4.763	5	20	DJBD	
Cc1cccc(/C=C(\c2ccncc2)c2ccc([N+](=O)[O-])cc2)c1	502181222	DPCRQLMSMIYKDW-ZHZULCJRSA-N	316.360	4.887	5	20	DJBD	
Cc1ccc([C@H](C)NCc2cc3c(C)cccc3[nH]2)cc1[N+](=O)[O-]	594940684	QTWYNMIEXWVPFP-AWEZNQCLSA-N	323.396	4.544	5	20	DJBD	
C[C@H](N[C@@H]1CCc2ccc(Cl)cc21)c1cccc([N+](=O)[O-])c1	479254706	WEMLWZZRLYOGRC-APPDUMDISA-N	316.788	4.586	5	20	DJBD	
O=[N+]([O-])c1ccccc1CN[C@@H](c1ccccc1)C1CCCC1	507928611	DOSYKGBDTOZRNY-IBGZPJMESA-N	310.397	4.616	5	20	DJBD	
COc1ccc([C@@H](Nc2ccc([N+](=O)[O-])cc2F)C(C)C)cc1	513108602	QGNDNWWJKJVRCN-KRWDZBQOSA-N	318.348	4.552	5	20	DJBD	
CC(C)c1nsc(Oc2ccc([N+](=O)[O-])c3ccccc23)n1	538937657	OFRCZVPXGBNVDP-UHFFFAOYSA-N	315.354	4.515	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1ccc2ccccc2c1	539047919	XCEAUUTVQKKOIG-OAHLLOKOSA-N	320.392	4.907	5	20	DJBD	
CCC[C@@H](Nc1ccc([N+](=O)[O-])c(C(C)=O)c1)c1ccccc1	561104832	CEPWFEUJGYNIKF-QGZVFWFLSA-N	312.369	4.751	5	20	DJBD	
O=[N+]([O-])c1ccc(CCNc2ccc(SC(F)F)cc2)cc1	758074217	PNSGQORAAVCGGI-UHFFFAOYSA-N	324.352	4.564	5	20	DJBD	
COCC[C@H](Sc1ccc([N+](=O)[O-])cc1F)c1ccccc1	618965347	XLSBYWKNLHGHSY-HNNXBMFYSA-N	321.373	4.604	5	20	DJBD	
CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)c1ccsc1	872068965	KGQGUBLNFVCPKB-QWRGUYRKSA-N	322.455	4.790	5	20	DJBD	
CC[C@H](Nc1cccc2ccncc12)c1cccc([N+](=O)[O-])c1	322371588	ZQMXOASAKAPKGU-KRWDZBQOSA-N	307.353	4.706	5	20	DJBD	
C[C@H](SCc1cccc([N+](=O)[O-])c1)c1ccc(F)c(F)c1	498116935	JMKFVLUULZKTHG-JTQLQIEISA-N	309.337	4.867	5	20	DJBD	
Cc1ccc([C@@H](N[C@H](C)c2ccc([N+](=O)[O-])cc2)C2CC2)cc1	531688617	RGMBLIBQOFPJMP-AUUYWEPGSA-N	310.397	4.705	5	20	DJBD	
Cc1cc([C@H](C)N[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c(C)s1	531943720	IDKYCIJQCYMOMZ-STQMWFEESA-N	318.442	4.993	5	20	DJBD	
C[C@H](N[C@H]1c2ccccc2CC[C@H]1C)c1ccc([N+](=O)[O-])cc1	560910573	UQMDSBAOHZHZCH-BIENJYKASA-N	310.397	4.569	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H](C)c2sccc2C)cc1[N+](=O)[O-]	90217587	UVNAFSULBASPHS-STQMWFEESA-N	304.415	4.685	5	20	DJBD	
Cc1c(CN[C@H](C)c2ccc(F)cc2Cl)cccc1[N+](=O)[O-]	183793344	IICJUXUKUBJYDK-LLVKDONJSA-N	322.767	4.547	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H]2CCCc3ccccc32)cc1[N+](=O)[O-]	219866840	QXKCNWDTWKAPSO-KBXCAEBGSA-N	310.397	4.631	5	20	DJBD	
Cc1ccc([C@H]2CCCN2[C@H](C)c2ccccc2[N+](=O)[O-])s1	444159064	KQOPXYKBSWIRAU-CZUORRHYSA-N	316.426	4.863	5	20	DJBD	
CC[C@H](Nc1ccc([N+](=O)[O-])cc1F)c1ccc(F)cc1F	523084815	UMOLKQWQSKGLLG-AWEZNQCLSA-N	310.275	4.575	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](CC(F)(F)F)C(C)C	527100168	PELQPSPFYDCUHC-RISCZKNCSA-N	318.339	4.531	5	20	DJBD	
Cc1cccc(C)c1[C@H](C)N[C@@H](C)c1cccc([N+](=O)[O-])c1C	544898934	YLOKIVCECNERBS-HOTGVXAUSA-N	312.413	4.932	5	20	DJBD	
C[C@@H](SCc1ccc([N+](=O)[O-])cc1)c1ccc(F)c(F)c1	572024789	BRTYQPFGQZLKFM-SNVBAGLBSA-N	309.337	4.867	5	20	DJBD	
C[C@H](c1ccccc1Cl)N(C)Cc1cc(F)ccc1[N+](=O)[O-]	917067680	TTZGSOSJCQWOAI-LLVKDONJSA-N	322.767	4.580	5	20	DJBD	
O=[N+]([O-])c1ccc2sc(/C=C/C=C\c3ccccc3)nc2c1	517806732	SJRQDKOZJNPDFZ-MVTUOISNSA-N	308.362	4.931	5	20	DJBD	
Cc1c(CN[C@@H](CC(C)C)c2cccs2)cccc1[N+](=O)[O-]	543486420	ICKUPENMHAZJMJ-HNNXBMFYSA-N	318.442	4.842	5	20	DJBD	
CCCCCC[C@@H](CC)C(=O)N(C)Cc1ccccc1[N+](=O)[O-]	734997491	TUXNRTGYOXRXGC-OAHLLOKOSA-N	320.433	4.550	5	20	DJBD	
CC[C@@H](N[C@@H](C)c1ccc(F)cc1F)c1cccc([N+](=O)[O-])c1	121494954	JCMHALXWYPBMSG-APPDUMDISA-N	320.339	4.675	5	20	DJBD	
C[C@H](N[C@@H](C)c1ccc2ccccc2n1)c1cccc([N+](=O)[O-])c1	178687134	HPICIUROOBKSTB-KBPBESRZSA-N	321.380	4.555	5	20	DJBD	
Cc1cccc([C@@H](C)Nc2ccc([N+](=O)[O-])c3cnccc23)c1C	303729105	UJPOGJOUEPNBBX-CQSZACIVSA-N	321.380	4.933	5	20	DJBD	
CCOC1CC(CS[C@H](C)c2cc([N+](=O)[O-])ccc2C)C1	507132789	PDVUAUPYQCBDKB-DNOWBOINSA-N	309.431	4.513	5	20	DJBD	
Cc1ccc([C@@H](C)NCc2cc(F)ccc2Cl)cc1[N+](=O)[O-]	189346701	SZEWJDIBJAACEY-LLVKDONJSA-N	322.767	4.547	5	20	DJBD	
O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@H]1CCCc3ccccc31)CCC2	447517809	UMFONYNIDNPXON-VQTJNVASSA-N	322.408	4.639	5	20	DJBD	
Cc1ccc([C@H]2CCCN2[C@@H](C)c2ccccc2[N+](=O)[O-])s1	444159066	KQOPXYKBSWIRAU-XJKSGUPXSA-N	316.426	4.863	5	20	DJBD	
CC(C)Oc1ccc([N+](=O)[O-])cc1CNc1cccc(Cl)c1	462218301	MGHFMVYTCDLVMW-UHFFFAOYSA-N	320.776	4.648	5	20	DJBD	
Cc1c([C@@H](C)NCc2cccc3ccccc23)cccc1[N+](=O)[O-]	540496375	LGCOWPHQEGBBOA-OAHLLOKOSA-N	320.392	4.907	5	20	DJBD	
Cc1c(CN(C)[C@@H](C)c2cc3ccccc3o2)cccc1[N+](=O)[O-]	558724781	GTRHFHAWIGIBIW-AWEZNQCLSA-N	324.380	4.842	5	20	DJBD	
Cc1nc(CS[C@H](C)c2ccccc2[N+](=O)[O-])c(C)s1	1341052931	XKACUKFTVMOLDW-SECBINFHSA-N	308.428	4.663	5	20	DJBD	
C[C@H]1C[C@@H]1c1ccc(CNc2ccc([N+](=O)[O-])cc2Cl)o1	36971044	RGNHHCDQFGPTGZ-CABZTGNLSA-N	306.749	4.577	5	20	DJBD	
Cc1cc(N[C@@H](C)c2oc3ccccc3c2C)ncc1[N+](=O)[O-]	301454115	VQSOYAXKSRWZIB-LBPRGKRZSA-N	311.341	4.526	5	20	DJBD	
C[C@@H](N[C@H](CC(F)F)c1ccccc1)c1ccc([N+](=O)[O-])cc1	421875033	JMOWZMCHBXNYLX-MLGOLLRUSA-N	320.339	4.642	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2ccc(Cl)cc2)c2ncccc12	514977834	XINPZOMYIAAUDN-UHFFFAOYSA-N	300.701	4.589	5	20	DJBD	
C[C@H](NC1CC=CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1	610832594	NCGRBOHKNISFLG-LBPRGKRZSA-N	314.410	4.693	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](c1ccccc1)C1CC1	120383513	XIXSJSBINOLDHH-KUHUBIRLSA-N	310.397	4.705	5	20	DJBD	
CCOc1cccc(N[C@@H](C)c2ccc(C)s2)c1[N+](=O)[O-]	134911692	PGQYDVCLSHIBOQ-NSHDSACASA-N	306.387	4.537	5	20	DJBD	
Cc1cc(S[C@H](C)c2ccc(Cl)cc2)ncc1[N+](=O)[O-]	470866636	NHKLNHYGPHDZMM-SNVBAGLBSA-N	308.790	4.805	5	20	DJBD	
Cc1cccc(Cc2nc(-c3ccc([N+](=O)[O-])cc3)cs2)c1	515600637	AXTPFCOQTNCKSU-UHFFFAOYSA-N	310.378	4.618	5	20	DJBD	
O=[N+]([O-])c1cccc2c(NCc3cc4ccccc4o3)ccnc12	516947517	PBZFHRIHMLADAX-UHFFFAOYSA-N	319.320	4.501	5	20	DJBD	
O=[N+]([O-])c1ccccc1CN1CCC[C@@H]1c1ccccc1Cl	603857418	RPLBSIWOAZPOJA-QGZVFWFLSA-N	316.788	4.585	5	20	DJBD	
CCC[C@@H](CC)NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1	609223357	JGWMHRXYYMDLQC-CQSZACIVSA-N	302.374	4.523	5	20	DJBD	
c1ccc2c(CN3CCC4(CCO4)CC3)c3ccccc3cc2c1	800538132	KKKLTCRPJLDWAH-UHFFFAOYSA-N	317.432	4.748	5	20	DJBD	
CN(C(=O)c1c2ccccc2cc2ccccc12)c1ccccn1	81852912	HSVFZYVYQCLMEI-UHFFFAOYSA-N	312.372	4.665	5	20	DJBD	
C[C@@H](N[C@@H]1CCc2c(Cl)cccc21)c1cccc([N+](=O)[O-])c1	173361784	FBVFGPRKBKWHKZ-PIGZYNQJSA-N	316.788	4.586	5	20	DJBD	
COCc1cccc(CS[C@@H](C)c2ccccc2[N+](=O)[O-])c1	446960651	ZZILEIOSCYDIAB-ZDUSSCGKSA-N	317.410	4.736	5	20	DJBD	
Cc1ccc(C)c([C@H](C)N(C)Cc2c(F)cccc2[N+](=O)[O-])c1	505790069	KPOIEYJKFWIGQH-AWEZNQCLSA-N	316.376	4.544	5	20	DJBD	
C[C@@H](N[C@@H](c1ccccc1)C1CCC1)c1cccc([N+](=O)[O-])c1	531960962	JYSBCQMFMQLZFB-KUHUBIRLSA-N	310.397	4.787	5	20	DJBD	
CC(C)Oc1cccc([C@H](C)Nc2ccccc2[N+](=O)[O-])c1	603859945	MELTXQVJNGZZQN-ZDUSSCGKSA-N	300.358	4.555	5	20	DJBD	
CCC[C@H](N[C@H](C)c1ccsc1)c1cccc([N+](=O)[O-])c1	61361085	QFOKHTHCPKSUKB-WBMJQRKESA-N	304.415	4.848	5	20	DJBD	
C[C@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])c1cc2ccccc2o1	122079449	UTLLVNHIFWUXEC-STQMWFEESA-N	310.353	4.753	5	20	DJBD	
O=[N+]([O-])c1ccccc1/C=C\CN1CCC[C@H]1c1cccs1	506112054	GJLYNYHLMXJHEP-QTONRWBISA-N	314.410	4.507	5	20	DJBD	
O=[N+]([O-])c1ccc(-c2nc(CSC3CCCCC3)co2)cc1	534790076	ZUOQERFSKKBNPA-UHFFFAOYSA-N	318.398	4.816	5	20	DJBD	
CCOCc1ccc(N[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1	540753958	WOCISBLGQPASCO-AWEZNQCLSA-N	314.385	4.613	5	20	DJBD	
CC[C@@](C)(NCc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1	775388440	RQYNUPNTXAPYPB-QGZVFWFLSA-N	318.804	4.663	5	20	DJBD	
Cc1c([C@@H](C)NCc2ccccc2[N+](=O)[O-])oc2ccccc12	120082155	KOMJXHSTBYCLRV-CYBMUJFWSA-N	310.353	4.500	5	20	DJBD	
Cc1nc2ccc(N[C@@H](C)c3ccccc3[N+](=O)[O-])cc2s1	315397534	GAMCMEKYAYDPPQ-JTQLQIEISA-N	313.382	4.686	5	20	DJBD	
CC[C@H](C)n1ncc(N[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1C	564773011	GIVGTUKROUMDFH-STQMWFEESA-N	316.405	4.552	5	20	DJBD	
CCCNCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1	61003452	TUDHWMPQAIYFKB-UHFFFAOYSA-N	320.776	4.540	5	20	DJBD	
Cc1nc(C)c(CS[C@H](C)c2ccccc2[N+](=O)[O-])s1	437435949	ZMPDNPMUXKBFIS-SNVBAGLBSA-N	308.428	4.663	5	20	DJBD	
Cc1csc(CS[C@H](C)c2cc([N+](=O)[O-])ccc2C)n1	486077086	PRLVSBQQPZETSA-LLVKDONJSA-N	308.428	4.663	5	20	DJBD	
O=[N+]([O-])c1ccc(N[C@@H]2CCCOc3ccccc32)c(Cl)c1	504177847	VRSFQYFBJREGTB-CQSZACIVSA-N	318.760	4.574	5	20	DJBD	
CC[C@@H](NC1(c2ccccc2)CCC1)c1cccc([N+](=O)[O-])c1	539668545	UPPAXASORXMLEC-GOSISDBHSA-N	310.397	4.715	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H]2C[C@@H](C)c3ccccc32)cc1[N+](=O)[O-]	552905517	HFTAUVAMFXROLV-GLJUWKHASA-N	310.397	4.802	5	20	DJBD	
CC(=O)c1cc(N[C@H]2CCCc3ccc(C)cc32)ccc1[N+](=O)[O-]	561698014	LEOCRITWYPOYIA-SFHVURJKSA-N	324.380	4.595	5	20	DJBD	
C[C@@H](N[C@H](C)c1csc(Cl)c1)c1ccc([N+](=O)[O-])cc1	903287000	LSLVADASFIQLTK-NXEZZACHSA-N	310.806	4.722	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1cccc(C(F)F)c1	1343273296	PIBYHSYXLIRQQI-GFCCVEGCSA-N	320.339	4.692	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)c1cccc(F)c1F	179557810	QJTJEEMYRHRFEB-RYUDHWBXSA-N	320.339	4.593	5	20	DJBD	
C[C@H](O)[C@@H]1CCCN(Cc2c3ccccc3cc3ccccc23)C1	780893304	VZZCGCPKNUELRX-QFBILLFUSA-N	319.448	4.586	5	20	DJBD	
CC(=O)c1ccc(N[C@H](C)c2ccccc2Cl)c([N+](=O)[O-])c1	8054112	HZPGVEPJOFUUTL-SNVBAGLBSA-N	318.760	4.624	5	20	DJBD	
CC(C)(C)OCc1ccc(NCc2ccc([N+](=O)[O-])cc2)cc1	84052448	UMGVFPNATLDQLJ-UHFFFAOYSA-N	314.385	4.522	5	20	DJBD	
CSc1ccc(Cl)cc1NCc1ccccc1[N+](=O)[O-]	237280507	BTFLCKPMUIYRQS-UHFFFAOYSA-N	308.790	4.582	5	20	DJBD	
CCSCc1ccc(NCc2csc([N+](=O)[O-])c2)cc1	449604178	SLBHSAMBPPQYMB-UHFFFAOYSA-N	308.428	4.522	5	20	DJBD	
Cc1ccc2c(c1)[C@@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)CCC2	488005226	IQROXICVPKTBQN-KUHUBIRLSA-N	310.397	4.631	5	20	DJBD	
CCOc1cc(N[C@@H](C)CCCC(F)(F)F)ccc1[N+](=O)[O-]	493637492	YDTRRYVHLIILKX-JTQLQIEISA-N	320.311	4.527	5	20	DJBD	
Cc1ccc(OCc2csc(C3CCCC3)n2)c([N+](=O)[O-])c1	520165562	MNOCQBQAQIHBFT-UHFFFAOYSA-N	318.398	4.596	5	20	DJBD	
C/C=C/c1ccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1	557936737	PDDWMPNTMKDEHN-NSCUHMNNSA-N	316.744	4.534	5	20	DJBD	
O=Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(Cl)c1	163870687	PTHBPMOLRNCOFI-UHFFFAOYSA-N	312.108	4.506	5	20	DJBD	
C[C@H](N[C@H]1CC(C)(C)Cc2occc21)c1ccc([N+](=O)[O-])cc1	453228666	AVSZAWFYSIZYDK-LRDDRELGSA-N	314.385	4.552	5	20	DJBD	
CCC[C@H](NCc1c(F)cc([N+](=O)[O-])cc1F)c1ccccc1	509036469	YKBXSGBSRAMVNY-KRWDZBQOSA-N	320.339	4.504	5	20	DJBD	
O=[N+]([O-])c1ccccc1/C=C\CNc1ccccc1OCC1CC1	562142000	BUIOLBRNVYTWNM-ALCCZGGFSA-N	324.380	4.509	5	20	DJBD	
COc1ccc(Cl)cc1CSc1ccc([N+](=O)[O-])cc1	9479544	CKBGLIADZMYWNX-UHFFFAOYSA-N	309.774	4.549	5	20	DJBD	
C[C@H](Nc1ccc(CC(F)(F)F)cc1)c1cccc([N+](=O)[O-])c1	173441480	MTDTYRVUQWMBTN-NSHDSACASA-N	324.302	4.873	5	20	DJBD	
O=[N+]([O-])c1ccc2oc(/C(Cl)=C\c3cccc(F)c3)nc2c1	255713128	RNLMYVMKIDEEKB-KPKJPENVSA-N	318.691	4.612	5	20	DJBD	
C[C@H](SCc1ccc(F)c(F)c1)c1ccccc1[N+](=O)[O-]	437263360	AOADESRNOUWDPW-JTQLQIEISA-N	309.337	4.867	5	20	DJBD	
Cc1c([C@H](C)NCc2c(F)cccc2Cl)cccc1[N+](=O)[O-]	481712993	BMQFBKDJZXAQKC-NSHDSACASA-N	322.767	4.547	5	20	DJBD	
O=[N+]([O-])c1cncc(Cl)c1Oc1ccc2ccccc2c1	589103715	IOXLFIGPIUWPIH-UHFFFAOYSA-N	300.701	4.589	5	20	DJBD	
C[C@H](c1ccccc1)c1ccc(Oc2ncccc2[N+](=O)[O-])cc1	609143817	XPJVUSLAKISRGT-CQSZACIVSA-N	320.348	4.934	5	20	DJBD	
CCOc1ccc(Cl)c(NCc2ccc(C)c([N+](=O)[O-])c2)c1	864038817	ZSOMLFINXMSORS-UHFFFAOYSA-N	320.776	4.567	5	20	DJBD	
C[C@H](N[C@H](C)c1c(F)cccc1Cl)c1cccc([N+](=O)[O-])c1	90180322	IQNVDGSVTOIGBY-WDEREUQCSA-N	322.767	4.799	5	20	DJBD	
C[C@@H](Nc1ccc([N+](=O)[O-])cc1)c1ccccc1C(F)(F)F	315179380	JBYPUBDXLQWWRL-SNVBAGLBSA-N	310.275	4.787	5	20	DJBD	
Cc1cc(Oc2ccc(Cl)c3ccccc23)ncc1[N+](=O)[O-]	470867735	YPYDUKVCEDGIOD-UHFFFAOYSA-N	314.728	4.897	5	20	DJBD	
CCc1noc(C)c1CS[C@H](C)c1cc([N+](=O)[O-])ccc1C	486081220	XUXYAUGQELUTDG-GFCCVEGCSA-N	320.414	4.756	5	20	DJBD	
Cc1ccccc1C(C)(C)NCc1ccc(Cl)c([N+](=O)[O-])c1	815149424	MSZNZVBWWWSOFC-UHFFFAOYSA-N	318.804	4.582	5	20	DJBD	
O=[N+]([O-])c1sccc1Sc1ccc(Br)cc1	144682369	UJLKWCFVKCYGGT-UHFFFAOYSA-N	316.201	4.570	5	20	DJBD	
Oc1nc(SCc2ccccc2)nc2cc3ccccc3cc12	432506975	PMIIKFIDKSTZIR-UHFFFAOYSA-N	318.401	4.781	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1cccc(Cl)c1F	1322645785	JMVXSJPHZZSABS-NSHDSACASA-N	322.767	4.547	5	20	DJBD	
C[C@H](N[C@H](C)c1ccc(Cl)s1)c1ccc([N+](=O)[O-])cc1	36992057	URWOYAFYKXHHCG-VHSXEESVSA-N	310.806	4.722	5	20	DJBD	
O=[N+]([O-])c1cccc(SCc2nc(Cl)ccc2Cl)c1	313561619	IWRMLSBOBMJMCC-UHFFFAOYSA-N	315.181	4.589	5	20	DJBD	
CC(C)c1ccc(C(=O)N(C)C2CCCCCC2)cc1[N+](=O)[O-]	439131193	HFRMRAZWBYSSBQ-UHFFFAOYSA-N	318.417	4.513	5	20	DJBD	
CC[C@@H](C)Oc1ccc(N[C@H](C)c2ccccc2[N+](=O)[O-])cc1	743473382	WGRBQRZAZOWFOY-ZIAGYGMSSA-N	314.385	4.945	5	20	DJBD	
Cc1ccc2ccccc2c1CN[C@H](C)c1cccc([N+](=O)[O-])c1	540377624	RAOALEMRVQTILG-OAHLLOKOSA-N	320.392	4.907	5	20	DJBD	
CCC[C@@H](CC)NC(=O)c1cc2ccccc2c2cccnc12	572229481	GILXGLGIJFNQFW-OAHLLOKOSA-N	306.409	4.697	5	20	DJBD	
Cc1cc2cc(Nc3ccc4ncccc4c3[N+](=O)[O-])ccc2[nH]1	480375867	LMMQAWPHNPKYMJ-UHFFFAOYSA-N	318.336	4.676	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H](C)c2c(C)cccc2C)cc1[N+](=O)[O-]	544897202	BKKYKTKXBLWCBV-JKSUJKDBSA-N	312.413	4.932	5	20	DJBD	
C[C@@H](c1ccco1)N(Cc1ccc(Cl)c([N+](=O)[O-])c1)C1CC1	768548908	KFQDWYLGAYCIBH-NSHDSACASA-N	320.776	4.567	5	20	DJBD	
CC[C@H](Nc1cc(F)c(OC)cc1C)c1cccc([N+](=O)[O-])c1	775562166	CFBMXVWHZJCXOV-HNNXBMFYSA-N	318.348	4.614	5	20	DJBD	
C[C@@H](N[C@@H]1CC(C)(C)c2ccccc21)c1ccc([N+](=O)[O-])cc1	536846342	QGAKLZXUVSRRHU-FZKQIMNGSA-N	310.397	4.668	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H]1CCCc2sccc21	545235847	PYWXCECEIUBMRL-MLGOLLRUSA-N	316.426	4.693	5	20	DJBD	
CC[C@@H](Sc1ncccc1[N+](=O)[O-])c1ccc(F)cc1F	609962277	OZGYZIMEUSDVLT-CYBMUJFWSA-N	310.325	4.511	5	20	DJBD	
O=C(Nc1cccc(F)c1)c1cc2ccccc2c2cccnc12	643103259	KQNIMFWAWPYXJM-UHFFFAOYSA-N	316.335	4.779	5	20	DJBD	
CC(C)Oc1ccc(N[C@H](C)c2cccc([N+](=O)[O-])c2)c(F)c1	777290208	IEBMUNWEYDLIPZ-GFCCVEGCSA-N	318.348	4.694	5	20	DJBD	
Cc1cnc(CS[C@H](C)c2cc([N+](=O)[O-])ccc2C)s1	778623920	SPDWEMQJXAPRAO-LLVKDONJSA-N	308.428	4.663	5	20	DJBD	
O=[N+]([O-])c1cc(CSc2nc3ccccc3o2)ccc1Cl	36964981	FEVFCXZVKDNYBA-UHFFFAOYSA-N	320.757	4.682	5	20	DJBD	
O=[N+]([O-])c1cc(NCc2ccc(C(F)F)cc2)ccc1Cl	131336925	ZEAQJKCOXLOFGB-UHFFFAOYSA-N	312.703	4.798	5	20	DJBD	
C[C@H](Nc1ccc([N+](=O)[O-])cc1F)c1cc2ccccc2o1	314797510	DEUXVMIHKJPKQF-JTQLQIEISA-N	300.289	4.653	5	20	DJBD	
COCCCC[C@@H](Nc1ccc([N+](=O)[O-])s1)c1ccccc1	619501134	VHDMSCGLBALJEY-CQSZACIVSA-N	320.414	4.626	5	20	DJBD	
CC(C)[C@H](Nc1ncc([N+](=O)[O-])s1)c1ccccc1Cl	443511491	TXAKVOLNMZJTSZ-LBPRGKRZSA-N	311.794	4.514	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H](C)c1c(C)cccc1C	546224112	KRMBQUNRFCEYSR-HZPDHXFCSA-N	312.413	4.932	5	20	DJBD	
Cc1cc(Nc2cc(Cl)c(N)c(Cl)c2)ccc1[N+](=O)[O-]	917007090	XNARUHGSGUXRKL-UHFFFAOYSA-N	312.156	4.536	5	20	DJBD	
O=[N+]([O-])c1ccc2oc(/C(Cl)=C\c3ccccc3F)nc2c1	255499311	DSJLMWJVQXBFAW-YRNVUSSQSA-N	318.691	4.612	5	20	DJBD	
C[C@H](NCc1cc2ccccc2s1)c1cccc([N+](=O)[O-])c1	556218038	PIBDBDQWNSDBAF-LBPRGKRZSA-N	312.394	4.660	5	20	DJBD	
Cc1c([C@H](C)NCc2coc3ccccc23)cccc1[N+](=O)[O-]	571349331	KSCUOVLLASPVDN-ZDUSSCGKSA-N	310.353	4.500	5	20	DJBD	
COCc1ccc(S[C@H](C)c2ccccc2[N+](=O)[O-])cc1	610480781	WGOVSERSQFVUEI-GFCCVEGCSA-N	303.383	4.595	5	20	DJBD	
Cc1ccccc1C(C)(C)NCc1cc([N+](=O)[O-])ccc1Cl	815148829	MGNGZOWCHCFKPO-UHFFFAOYSA-N	318.804	4.582	5	20	DJBD	
Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)[C@H](C)CC1CCCCC1	1339921998	ZMGZLZLBPFCXKX-LLVKDONJSA-N	322.380	4.587	5	20	DJBD	
C[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(Cl)c(F)c1	317211142	GIZVWQQJTUTHQZ-MNOVXSKESA-N	322.767	4.799	5	20	DJBD	
O=[N+]([O-])c1cccc(F)c1COc1ccccc1-c1ccccc1	505612114	OMSNBMZDBHTOJW-UHFFFAOYSA-N	323.323	4.980	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)CC1(C)CCCCC1	509884506	VTRJDTQYUGEPEJ-UHFFFAOYSA-N	304.390	4.511	5	20	DJBD	
Cc1cc(N[C@H](C)c2cnn(C(C)C)c2)c(Cl)cc1[N+](=O)[O-]	747220795	PMALNYINJYWGCA-LLVKDONJSA-N	322.796	4.507	5	20	DJBD	
c1ccc(CCNCc2c3ccccc3cc3ccccc23)nc1	60815664	DMXGVOFWHNECGJ-UHFFFAOYSA-N	312.416	4.720	5	20	DJBD	
Cc1c([C@H](C)N[C@H]2C[C@H](c3ccccc3)C2)cccc1[N+](=O)[O-]	436286326	AUPHPYDISBMFNV-XIRDDKMYSA-N	310.397	4.500	5	20	DJBD	
CC[C@@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])c1cc(F)ccc1F	537094407	CRYHSDFGVIXOCS-MEDUHNTESA-N	320.339	4.675	5	20	DJBD	
Cc1ccccc1C(C)(C)NCc1cc(Cl)ccc1[N+](=O)[O-]	815149081	YOJRKVUWVCPRLC-UHFFFAOYSA-N	318.804	4.582	5	20	DJBD	
O=[N+]([O-])c1ccc(NCc2csc3ccccc23)c(F)c1	48337145	WEZJLVCRBCQIRP-UHFFFAOYSA-N	302.330	4.561	5	20	DJBD	
O=[N+]([O-])c1cccc2ccc(/C=C/C=C/c3ccccc3)nc12	58464593	YWVQCPCGZKBAJK-HINBXAKRSA-N	302.333	4.870	5	20	DJBD	
O=[N+]([O-])c1cccc2ccc(/C=C\c3cccc(F)c3F)nc12	209916965	DOMLPJMFYDIIDM-CLFYSBASSA-N	312.275	4.592	5	20	DJBD	
O=[N+]([O-])c1ccccc1/C=C/C=C\c1ccc2cccc(O)c2n1	508598725	NTGKXBFSSQKSGJ-TWFXYNTASA-N	318.332	4.575	5	20	DJBD	
COc1ccc(CS[C@H](C)c2cccc(F)c2)cc1[N+](=O)[O-]	517939689	KIDPBNHXCHQASQ-LLVKDONJSA-N	321.373	4.737	5	20	DJBD	
CCCC(C)(C)NCc1ccc(-c2ccccc2[N+](=O)[O-])o1	518980249	NPMUYAGARQTCDT-UHFFFAOYSA-N	302.374	4.523	5	20	DJBD	
O=[N+]([O-])c1cc(C(F)F)ccc1N1CCC[C@@H]1c1ccsc1	853162393	AQSCZTGTYFXCFB-GFCCVEGCSA-N	324.352	4.935	5	20	DJBD	
C[C@H](NC1(c2cccc(Cl)c2)CC1)c1ccc([N+](=O)[O-])cc1	182258826	VBUUXEOCGCDLKX-LBPRGKRZSA-N	316.788	4.588	5	20	DJBD	
CC[C@H](N[C@@H]1CCc2cc(C)ccc21)c1cccc([N+](=O)[O-])c1	540139255	PJKVHUSZYPALJZ-RBUKOAKNSA-N	310.397	4.631	5	20	DJBD	
CC(C)c1nccn1Cc1nc2ccccc2c2ccccc12	543717218	QDBLOMRKIPHNJV-UHFFFAOYSA-N	301.393	4.756	5	20	DJBD	
C[C@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1cc2ccccc2o1	573020656	RRFLRSBZPQAMGS-BLLLJJGKSA-N	322.364	4.679	5	20	DJBD	
O=[N+]([O-])c1ccc(SCc2cc(-c3ccccc3)on2)cc1	609900307	CINVGYWGKDRNFZ-UHFFFAOYSA-N	312.350	4.542	5	20	DJBD	
CC(C)c1ccc(SCC(=O)c2ccc([N+](=O)[O-])cc2)cc1	315670954	QBULYJGJCNYQRR-UHFFFAOYSA-N	315.394	4.693	5	20	DJBD	
O=[N+]([O-])c1ccc2oc(CSc3cccc(Cl)c3)nc2c1	434799369	RPOTWUVZNQOVNW-UHFFFAOYSA-N	320.757	4.682	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1	447530092	LYIGDHJNZRFGKU-LIRRHRJNSA-N	310.397	4.631	5	20	DJBD	
C[C@@H](Sc1nc2ccccc2o1)c1ccccc1[N+](=O)[O-]	463029982	UTBFRNJOPSZOMU-SNVBAGLBSA-N	300.339	4.589	5	20	DJBD	
CC[C@H](N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccccc1F	494020882	PQXJEUVHHJTOJV-DYVFJYSZSA-N	316.376	4.844	5	20	DJBD	
CN(CC(C)(C)C)C(=O)c1cc2ccccc2c2cccnc12	588802216	WZKMNRSLBRREHV-UHFFFAOYSA-N	306.409	4.506	5	20	DJBD	
Cc1cc(NCc2ccc(C(F)(F)F)cc2)ccc1[N+](=O)[O-]	108105240	FAYNHMPFKURHOV-UHFFFAOYSA-N	310.275	4.534	5	20	DJBD	
CCc1nc(CS[C@@H](C)c2ccccc2[N+](=O)[O-])cs1	437259850	OZJVPIAJMNWZHO-JTQLQIEISA-N	308.428	4.608	5	20	DJBD	
O=[N+]([O-])c1ccc2sc(/C=C/C=C/c3ccccc3)nc2c1	517806731	SJRQDKOZJNPDFZ-KBXRYBNXSA-N	308.362	4.931	5	20	DJBD	
C[C@@H](c1ccco1)N(Cc1cc([N+](=O)[O-])ccc1Cl)C1CC1	754869861	BGQSWODFKRZGIY-NSHDSACASA-N	320.776	4.567	5	20	DJBD	
CC[C@@H](Nc1ccc(SC)cc1)c1cccc([N+](=O)[O-])c1	37010408	GSLSRLSKKAKUIT-MRXNPFEDSA-N	302.399	4.880	5	20	DJBD	
C[C@H](N[C@H]1CC[C@@H](C)c2ccccc21)c1cccc([N+](=O)[O-])c1	322132115	YVOZDBSXTWHVQA-TYILLQQXSA-N	310.397	4.884	5	20	DJBD	
CC[C@H](N[C@H](CC(F)(F)F)C(C)C)c1cccc([N+](=O)[O-])c1	437071805	AOUNGXRXMKPFCJ-UONOGXRCSA-N	318.339	4.613	5	20	DJBD	
CSc1ccccc1[C@H](C)Nc1ncc(Cl)cc1[N+](=O)[O-]	440679840	ZAPCQVYDBKYJAJ-VIFPVBQESA-N	323.805	4.538	5	20	DJBD	
CC(C)(NCc1ccc2ccccc2c1)c1ccccc1[N+](=O)[O-]	492000815	PIOYYXSWUWUKCH-UHFFFAOYSA-N	320.392	4.773	5	20	DJBD	
CCCCn1c(S/C=C/c2ccc([N+](=O)[O-])o2)nc(C)c1C	863871546	RTUGCIMNWMCUKW-CSKARUKUSA-N	321.402	4.564	5	20	DJBD	
C[C@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)c(F)c1	1254111255	SDIDRQLAALRRSP-MNOVXSKESA-N	322.767	4.799	5	20	DJBD	
C[C@H](NCc1ccccc1[N+](=O)[O-])c1cccc2ccccc12	194782993	MXOLDDFDSRUFOP-AWEZNQCLSA-N	306.365	4.599	5	20	DJBD	
CCc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc2ccccc2c1	464721434	XCXOAMGAGNCPNI-UHFFFAOYSA-N	320.348	4.563	5	20	DJBD	
Cc1cc([C@H](C)NCc2c(Cl)cccc2[N+](=O)[O-])ccc1F	494782643	MKWXIVBWBPBHJW-NSHDSACASA-N	322.767	4.547	5	20	DJBD	
Cc1cc(C)cc([C@H](C)NCc2ccc(Cl)cc2[N+](=O)[O-])c1	538205284	WJPQPRRYKAUTFL-ZDUSSCGKSA-N	318.804	4.716	5	20	DJBD	
CC(C)c1nc([C@@H](C)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)cs1	90049652	ODENTRZXKGUZOJ-NWDGAFQWSA-N	319.430	4.587	5	20	DJBD	
CCC(CC)[C@@H](NCc1ccccc1[N+](=O)[O-])c1cccs1	507914472	OWZZOHVONLCHQS-QGZVFWFLSA-N	318.442	4.923	5	20	DJBD	
CC(C)N(Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H](C)c1ccccc1	794681657	BPUNHMHTBKLVQU-AWEZNQCLSA-N	316.376	4.706	5	20	DJBD	
COc1ccc([N+](=O)[O-])cc1CSc1ccccc1Cl	60649976	UZIBVYCZXXGDRJ-UHFFFAOYSA-N	309.774	4.549	5	20	DJBD	
Cc1nc(CS[C@@H](C)c2ccccc2[N+](=O)[O-])sc1C	88309645	QUNYZWBLWAUNPT-NSHDSACASA-N	308.428	4.663	5	20	DJBD	
CC(C)C[C@H](NCc1ccccc1[N+](=O)[O-])c1cccs1	171128953	JMNXHBQWVMVKEQ-AWEZNQCLSA-N	304.415	4.533	5	20	DJBD	
O=[N+]([O-])c1ccccc1N1CCC[C@@H]1c1cccc(Cl)c1	515551165	BFPDSJMKUZQSPS-CQSZACIVSA-N	302.761	4.590	5	20	DJBD	
COc1ccc([N+](=O)[O-])cc1CS[C@H](C)c1ccccc1	520664997	PLUGCYRQQYVAJJ-GFCCVEGCSA-N	303.383	4.598	5	20	DJBD	
CCC[C@@H](N[C@@H](CC)CC(F)(F)F)c1cccc([N+](=O)[O-])c1	546165328	DZTACNIHEOJEJJ-GXTWGEPZSA-N	318.339	4.757	5	20	DJBD	
Cc1c(CN[C@H](C)c2cccc(C3CC3)c2)cccc1[N+](=O)[O-]	556179798	XNWYIJJZMSNDMK-CQSZACIVSA-N	310.397	4.631	5	20	DJBD	
CCOc1cc(N[C@H](CC)c2cccs2)ccc1[N+](=O)[O-]	111048589	BFMGAMXROORBEA-GFCCVEGCSA-N	306.387	4.618	5	20	DJBD	
O=[N+]([O-])c1ccccc1CN[C@H](CC1CCC1)c1ccccc1	344163427	HRXRPFAYTRKYAH-GOSISDBHSA-N	310.397	4.616	5	20	DJBD	
Cc1ccc(C(F)(F)F)cc1NCc1cccc([N+](=O)[O-])c1	387730719	NYUAFBGGAOGWMK-UHFFFAOYSA-N	310.275	4.534	5	20	DJBD	
Cc1ccc2c(c1)[C@@H](N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)CC2	540221214	VAQFWAFWVRKFIP-KDOFPFPSSA-N	310.397	4.550	5	20	DJBD	
CCS[C@H](C)c1noc(-c2ccc(C(C)C)c([N+](=O)[O-])c2)n1	566940818	XZGJYTKFQRLZGE-SNVBAGLBSA-N	321.402	4.582	5	20	DJBD	
C[C@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccccc1Cl	582855965	HHUBNMWLYNSTQA-ZBEGNZNMSA-N	316.788	4.586	5	20	DJBD	
C[C@@H](Nc1ccc([N+](=O)[O-])cc1Cl)c1c(F)cccc1F	36971056	CLNHEDWWZBIXRF-MRVPVSSYSA-N	312.703	4.700	5	20	DJBD	
CCCC(CCC)SCCC(=O)Nc1ccccc1[N+](=O)[O-]	64049225	VSKJZXNYSBOQOD-UHFFFAOYSA-N	324.446	4.625	5	20	DJBD	
CC(C)Oc1c(Cl)cccc1NCc1ccccc1[N+](=O)[O-]	236609346	PGHWCHKIDJXRQW-UHFFFAOYSA-N	320.776	4.648	5	20	DJBD	
O=[N+]([O-])c1ccccc1CNc1ccccc1Oc1ccccc1	323873610	SEGBIZGUPRUNDI-UHFFFAOYSA-N	320.348	4.999	5	20	DJBD	
CC[C@H](CC1CCCC1)c1nnc(-c2cccc([N+](=O)[O-])c2)o1	1341331401	UGFFUTYJDXUQOC-CYBMUJFWSA-N	315.373	4.719	5	20	DJBD	
Cc1c([C@H](C)Nc2ccsc2[N+](=O)[O-])oc2ccccc12	63263103	QHCZRPWBVWIBLP-JTQLQIEISA-N	302.355	4.884	5	20	DJBD	
C[C@H](SCCOc1cccc(F)c1)c1ccccc1[N+](=O)[O-]	437264719	FYWSGUVWJYMMIN-LBPRGKRZSA-N	321.373	4.607	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H](C)CCCC(F)(F)F)cc1[N+](=O)[O-]	480215580	RVSGTMBGEDJFPY-NEPJUHHUSA-N	318.339	4.675	5	20	DJBD	
Cc1ncc(CS[C@H](C)c2cc([N+](=O)[O-])ccc2C)s1	486031591	SBNAEAFDUMKAPH-SNVBAGLBSA-N	308.428	4.663	5	20	DJBD	
O=[N+]([O-])c1ccccc1/C=C/CN1CCC[C@@H]1c1cccs1	506112045	GJLYNYHLMXJHEP-LERPRCHQSA-N	314.410	4.507	5	20	DJBD	
O=C(Nc1ccc([N+](=O)[O-])cc1)c1sccc1-c1ccccc1	603824178	QANIARKXCAOPHH-UHFFFAOYSA-N	324.361	4.576	5	20	DJBD	
CC[C@H](CC(=O)Nc1cc([N+](=O)[O-])c(Cl)cc1C)C(C)C	736159523	XCJOMJVVPZWLAS-LLVKDONJSA-N	312.797	4.567	5	20	DJBD	
C[C@H](SCc1nc2cc([N+](=O)[O-])ccc2o1)c1cccs1	751471369	VLLRJZQSMKIYEY-VIFPVBQESA-N	320.395	4.792	5	20	DJBD	
CC[C@@H](N[C@H]1CCCc2sccc21)c1cccc([N+](=O)[O-])c1	102196716	HSTAMSJLYNSWDV-CVEARBPZSA-N	316.426	4.775	5	20	DJBD	
CCOc1cc(N[C@H](C)c2ccc(C)s2)ccc1[N+](=O)[O-]	111048336	AIEOBYXOVHGPAI-LLVKDONJSA-N	306.387	4.537	5	20	DJBD	
CCC[C@@H](NCc1ccc(CC)s1)c1cccc([N+](=O)[O-])c1	319142467	UOLGWPBYBRLJDD-QGZVFWFLSA-N	318.442	4.850	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(Oc2ccc3c(c2)[nH]c2ccccc23)n1	765453967	ULYBHODWFVWXMP-UHFFFAOYSA-N	319.320	4.725	5	20	DJBD	
O=[N+]([O-])c1cccc(-c2csc(-c3ccc(F)cc3)n2)c1	7845427	FHJSMTJGHGFIAS-UHFFFAOYSA-N	300.314	4.524	5	20	DJBD	
CC(C)c1cccc(NCc2ccc(Cl)cc2[N+](=O)[O-])c1	50443325	ZPZXBRFCDPJZFG-UHFFFAOYSA-N	304.777	4.984	5	20	DJBD	
Cc1ccc([C@H](NCc2ccccc2[N+](=O)[O-])C2CCCC2)o1	539395475	YOXJYUHABFFTKT-GOSISDBHSA-N	314.385	4.517	5	20	DJBD	
O=[N+]([O-])c1ccc(-c2noc(-c3ccc4sccc4c3)n2)cc1	546258172	JSYYQCQPLWEELP-UHFFFAOYSA-N	323.333	4.527	5	20	DJBD	
CC1(O)CCC(NCc2c3ccccc3cc3ccccc23)CC1	749296541	PMFGSGCVXPVJOB-UHFFFAOYSA-N	319.448	4.776	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H](C)c2ccc(F)cc2F)cc1[N+](=O)[O-]	78970818	VHPPAMYMPXZVLE-RYUDHWBXSA-N	320.339	4.593	5	20	DJBD	
C[C@H](N[C@H](C)c1ccc(F)cc1Cl)c1cccc([N+](=O)[O-])c1	119703478	ZITNNFPTOKCDJM-WDEREUQCSA-N	322.767	4.799	5	20	DJBD	
C[C@H](N[C@@H]1CC(C)(C)Cc2occc21)c1ccc([N+](=O)[O-])cc1	453228664	AVSZAWFYSIZYDK-BLLLJJGKSA-N	314.385	4.552	5	20	DJBD	
Cc1c([C@@H](C)NCc2c(F)cccc2Cl)cccc1[N+](=O)[O-]	481712992	BMQFBKDJZXAQKC-LLVKDONJSA-N	322.767	4.547	5	20	DJBD	
C[C@@H](SCc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F	498117186	LOXLPPOLIGTFRD-SNVBAGLBSA-N	309.337	4.867	5	20	DJBD	
CC[C@H](NCc1ccc([N+](=O)[O-])c(Cl)c1)c1ccc(F)cc1	1338648628	GEHWJSQENCJSJV-HNNXBMFYSA-N	322.767	4.628	5	20	DJBD	
C[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc2ccccc2n1	178687151	HPICIUROOBKSTB-KGLIPLIRSA-N	321.380	4.555	5	20	DJBD	
C[C@H](Nc1ccc(F)cc1[N+](=O)[O-])c1nc(C(C)(C)C)cs1	301181269	HZHBFYHWNVMNNC-VIFPVBQESA-N	323.393	4.661	5	20	DJBD	
Cc1ccc2nc(S[C@H](C)c3ccccc3[N+](=O)[O-])[nH]c2c1	463039102	XOJJUKMDUANBER-LLVKDONJSA-N	313.382	4.633	5	20	DJBD	
CC[C@H](NCc1cccc([N+](=O)[O-])c1C)c1cccc(Cl)c1	195673454	CHDBJUFYQXYTRZ-INIZCTEOSA-N	318.804	4.798	5	20	DJBD	
Cc1c(CN[C@@H](C)c2ccc(Cl)c(F)c2)cccc1[N+](=O)[O-]	318472310	FOLYQZYMCWESMC-NSHDSACASA-N	322.767	4.547	5	20	DJBD	
Cc1cc(N[C@H](C)c2cccc(OC(F)F)c2)ccc1[N+](=O)[O-]	321617310	TXPGAPGEWXHKRQ-LLVKDONJSA-N	322.311	4.678	5	20	DJBD	
CC(C)Oc1ccccc1NCc1c(Cl)cccc1[N+](=O)[O-]	488129983	CTCMAGFFSMPEEG-UHFFFAOYSA-N	320.776	4.648	5	20	DJBD	
Cc1ccc2c(c1)[C@@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)CCC2	490247902	OYWSIKYOLAGXKY-KUHUBIRLSA-N	310.397	4.631	5	20	DJBD	
CC(C)(C)OCc1cccc(CNc2ccc([N+](=O)[O-])cc2)c1	301145174	AICUSJDKOXDNIF-UHFFFAOYSA-N	314.385	4.522	5	20	DJBD	
O=[N+]([O-])c1ccc(-c2nc(-c3cc(F)ccc3F)cs2)cc1	71971772	OMLHSSXFOLWETO-UHFFFAOYSA-N	318.304	4.664	5	20	DJBD	
C[C@H](N[C@H](C)c1c(F)cccc1Cl)c1ccc([N+](=O)[O-])cc1	178661492	YINMQJMUDZREHJ-WDEREUQCSA-N	322.767	4.799	5	20	DJBD	
C[C@H](Oc1ccc([N+](=O)[O-])c(Cl)c1)c1ncc(C(C)(C)C)o1	756864807	ZTOASZFRGPDQPJ-VIFPVBQESA-N	324.764	4.674	5	20	DJBD	
O=[N+]([O-])c1ccc(CN2CCC[C@@H]2c2cccs2)cc1Cl	761505156	HHBVVOALGTZBJN-CQSZACIVSA-N	322.817	4.647	5	20	DJBD	
Cc1c([C@@H](C)Nc2ccc(OC(F)F)cc2)cccc1[N+](=O)[O-]	776802751	WHDPFETYOITVQN-LLVKDONJSA-N	322.311	4.678	5	20	DJBD	
CCC[C@@H](NCc1ccc(F)cc1F)c1cccc([N+](=O)[O-])c1	320707322	ZIEBVTSARMFICJ-QGZVFWFLSA-N	320.339	4.504	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H](CC(F)(F)F)C(C)C)cc1[N+](=O)[O-]	437098965	YAZXBMRTBWPASX-WCQYABFASA-N	318.339	4.531	5	20	DJBD	
Cc1ccccc1NCc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	600851329	NKXUZBXZHZSJJL-UHFFFAOYSA-N	310.275	4.534	5	20	DJBD	
Cc1cc(C)c([C@@H](C)Sc2ncccc2[N+](=O)[O-])c(C)c1	520088116	ZMGPDLQEQYMQTL-CYBMUJFWSA-N	302.399	4.768	5	20	DJBD	
O=[N+]([O-])c1cc(C(F)(F)F)ccc1Oc1ccc(F)c(F)c1	57366571	UGVKDUONUIFEIN-UHFFFAOYSA-N	319.185	4.684	5	20	DJBD	
Cc1cc([C@H](C)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cs1	453143240	DOPJURWKWNSSLB-STQMWFEESA-N	304.415	4.685	5	20	DJBD	
C[C@@H](SCc1c(F)cccc1[N+](=O)[O-])c1ccc(F)cc1	504508392	UKZAGBZITLUXNP-SNVBAGLBSA-N	309.337	4.867	5	20	DJBD	
C[C@H](SCCOc1ccccc1[N+](=O)[O-])c1ccccc1F	507879959	MODGWXRACNNIKE-LBPRGKRZSA-N	321.373	4.607	5	20	DJBD	
C/C=C/c1ccc(Oc2ccc([N+](=O)[O-])cc2F)c(OC)c1	513081252	HWTOLRCETJBKQF-ONEGZZNKSA-N	303.289	4.568	5	20	DJBD	
Cc1ccc2oc(CN[C@H](C)c3cccc([N+](=O)[O-])c3)cc2c1	553277674	TUZKFCNDDBZMIE-CYBMUJFWSA-N	310.353	4.500	5	20	DJBD	
CC[C@@H](C)n1ncc(N[C@H](C)c2cc([N+](=O)[O-])ccc2C)c1C	564773004	GIVGTUKROUMDFH-CHWSQXEVSA-N	316.405	4.552	5	20	DJBD	
C[C@H](N[C@@H]1CCc2sc(Cl)cc21)c1cccc([N+](=O)[O-])c1	123377811	RTBBNFICGOYAPM-TVQRCGJNSA-N	322.817	4.648	5	20	DJBD	
CC(C)[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])c2ccccc21	447572254	AWSZJRFDELBLHN-MSOLQXFVSA-N	310.397	4.569	5	20	DJBD	
COc1ccccc1[C@@H](C)Sc1ncc([N+](=O)[O-])cc1Cl	463077106	FJIUBYRHHCOGBZ-SECBINFHSA-N	324.789	4.505	5	20	DJBD	
Cc1ccc([C@H](C)NCc2cccc(F)c2Cl)cc1[N+](=O)[O-]	567372038	TUNFRKGDLDCQKB-NSHDSACASA-N	322.767	4.547	5	20	DJBD	
O=[N+]([O-])c1ccc(F)cc1CNc1cccc(Cl)c1Cl	35308175	HLOLMVRRRBMPRY-UHFFFAOYSA-N	315.131	4.653	5	20	DJBD	
Cc1c([C@@H](C)NCc2ccc(F)c(Cl)c2)cccc1[N+](=O)[O-]	155168601	HNGPUKMCAUTNEM-LLVKDONJSA-N	322.767	4.547	5	20	DJBD	
Cc1c(CN[C@@H](C)c2c(F)cccc2Cl)cccc1[N+](=O)[O-]	181752642	UFVCRWYVILPOBW-NSHDSACASA-N	322.767	4.547	5	20	DJBD	
Cc1ccc([C@H](C)NCc2ccc(C(C)C)c([N+](=O)[O-])c2)cc1	302925626	CPMOCFTZNWOKHY-HNNXBMFYSA-N	312.413	4.877	5	20	DJBD	
CCCCCN(C(=O)c1cc(F)cc([N+](=O)[O-])c1)[C@H](C)CCC	524681072	SNECROCCHJROER-CYBMUJFWSA-N	324.396	4.555	5	20	DJBD	
C[C@@H](c1cccs1)N(C)Cc1ccc(Cl)cc1[N+](=O)[O-]	609705235	JHIPMJCTTVULIE-JTQLQIEISA-N	310.806	4.503	5	20	DJBD	
CCC[C@@H](NCc1cc([N+](=O)[O-])ccc1Cl)c1ccsc1	785566056	BTYSJXNCEJVRLC-OAHLLOKOSA-N	324.833	4.941	5	20	DJBD	
O=[N+]([O-])c1ccccc1CNc1ccc(SC(F)F)cc1	35038259	ODXMNYVVHYZRAJ-UHFFFAOYSA-N	310.325	4.522	5	20	DJBD	
COc1ccccc1SCc1cc(Cl)ccc1[N+](=O)[O-]	746388682	GTTLRADDFMJFLP-UHFFFAOYSA-N	309.774	4.549	5	20	DJBD	
CC(C)C[C@H](NCc1cc(F)ccc1[N+](=O)[O-])c1ccccc1	774816549	ZYEOYFXQNWXRSX-KRWDZBQOSA-N	316.376	4.611	5	20	DJBD	
CCSCc1cccc(NCc2cccc([N+](=O)[O-])c2C)c1	864013257	RKWCGFMUEOWJRU-UHFFFAOYSA-N	316.426	4.768	5	20	DJBD	
CC(=O)c1ccc(Oc2ccc(C)cc2Cl)c([N+](=O)[O-])c1	54351577	PROSLCPLVSIMTL-UHFFFAOYSA-N	305.717	4.552	5	20	DJBD	
CC1(C)C[C@@H](NC2(c3ccccc3)CC2)c2cc([N+](=O)[O-])ccc21	433244876	ZAGZGWWRJTUWIT-GOSISDBHSA-N	322.408	4.596	5	20	DJBD	
CC[C@H](c1ccccc1)N(CC)Cc1c(F)cccc1[N+](=O)[O-]	505802128	LUUZWOYUPUAZFK-QGZVFWFLSA-N	316.376	4.707	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2ccccc2OC(F)F)c(Cl)c1	584248302	JYEZYWVPSXYWQS-UHFFFAOYSA-N	315.659	4.642	5	20	DJBD	
O=Cc1ccc(Oc2cc(Cl)ccc2[N+](=O)[O-])c(Cl)c1	163877097	BMMKNJHMUQSRIU-UHFFFAOYSA-N	312.108	4.506	5	20	DJBD	
CC[C@@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1cc(F)ccc1F	173437955	RWTWVPLJWNBEQO-PIGZYNQJSA-N	320.339	4.675	5	20	DJBD	
CC[C@@H](NCc1ccc(Cl)cc1F)c1cccc([N+](=O)[O-])c1	427880799	XEEBKAYRVMOKCI-MRXNPFEDSA-N	322.767	4.628	5	20	DJBD	
C[C@H]1C[C@@H](C)CN(C(=O)c2cc3ccccc3c3cccnc23)C1	642518974	OMLOOLPELCRPDF-GASCZTMLSA-N	318.420	4.506	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H]2CCCc3ccccc32)cc1[N+](=O)[O-]	219866925	QXKCNWDTWKAPSO-KSSFIOAISA-N	310.397	4.631	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2ccc3cccnc3c2)c(Cl)c1	225848435	HPOMYSFGHNVCMY-UHFFFAOYSA-N	300.701	4.589	5	20	DJBD	
CC(C)[C@H](Nc1ncc([N+](=O)[O-])s1)c1ccc(Cl)cc1	443442552	ZAISVBWAEZDBNS-LBPRGKRZSA-N	311.794	4.514	5	20	DJBD	
C[C@H](c1ccco1)N(Cc1cc([N+](=O)[O-])ccc1Cl)C1CC1	754869860	BGQSWODFKRZGIY-LLVKDONJSA-N	320.776	4.567	5	20	DJBD	
C[C@H]1C[C@H](NCc2cc([N+](=O)[O-])ccc2Cl)c2ccccc21	808706314	HAOAOANLFSJUDR-GTNSWQLSSA-N	316.788	4.586	5	20	DJBD	
C/C(=C/c1ccc(-c2cccc([N+](=O)[O-])c2)s1)c1ncccn1	821017955	UAOVVOGTAVIJCS-BENRWUELSA-N	323.377	4.674	5	20	DJBD	
Cc1ccccc1NC(=O)c1cc2ccccc2c2cccnc12	58184401	XNSNZJQEJMFIMR-UHFFFAOYSA-N	312.372	4.949	5	20	DJBD	
Cc1cc(Nc2ccc(COC(C)C)cc2)ccc1[N+](=O)[O-]	511712455	BFEUPVVRXJRMTF-UHFFFAOYSA-N	300.358	4.572	5	20	DJBD	
Cc1cc(Nc2cccc(COC(C)C)c2)ccc1[N+](=O)[O-]	517096801	MXVRJSMFKQKQIV-UHFFFAOYSA-N	300.358	4.572	5	20	DJBD	
Cc1ccc(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1	1262006334	LRCYWESFTVXWOG-UHFFFAOYSA-N	310.275	4.534	5	20	DJBD	
CC[C@H](N[C@H](c1ccccc1)C1CC1)c1cccc([N+](=O)[O-])c1	195614327	WNTYHWOGRVJMSH-RBUKOAKNSA-N	310.397	4.787	5	20	DJBD	
CC[C@H](C)[C@H](C)NC(=O)c1cc2ccccc2c2cccnc12	195646057	RQSRBLPHBPFJAK-KBPBESRZSA-N	306.409	4.552	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1N1CCC[C@H]1c1cccs1	301239239	IFQZRCCOVJBIKY-LBPRGKRZSA-N	308.790	4.651	5	20	DJBD	
CC(C)(C)C[C@H](NCc1ccccc1[N+](=O)[O-])c1ccccc1	390359819	CMYZYZMJUACQGG-KRWDZBQOSA-N	312.413	4.862	5	20	DJBD	
C[C@@H](Sc1ccnc2ccccc12)c1ccccc1[N+](=O)[O-]	463262899	UOYGEBASKPWFMQ-GFCCVEGCSA-N	310.378	4.996	5	20	DJBD	
Cc1cc(NC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)ccc1C1CC1	562301306	LHPAIKJCOHFJOP-CYBMUJFWSA-N	324.380	4.523	5	20	DJBD	
Cc1ccccc1CNc1ccc([N+](=O)[O-])cc1C(F)(F)F	108055919	LRLRGTYTNWDLCS-UHFFFAOYSA-N	310.275	4.534	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(N[C@@H](C)c2ncc(-c3ccccc3)o2)c1	301558376	JLFGNUWQPZFROK-ZDUSSCGKSA-N	323.352	4.731	5	20	DJBD	
C[C@H]1OCC[C@H]1SCc1nc2ccccc2c2ccccc12	549929801	SCOYNHZCXUONCX-BFUOFWGJSA-N	309.434	4.799	5	20	DJBD	
COCc1ccc(SCc2ccc(Cl)cc2[N+](=O)[O-])cc1	610480457	JUDHPRMXFMGUPU-UHFFFAOYSA-N	323.801	4.687	5	20	DJBD	
C[C@@H](Nc1ccc(OCC2CC2)cc1)c1cccc([N+](=O)[O-])c1	746047462	NHZGULHCBJFMQT-CYBMUJFWSA-N	312.369	4.557	5	20	DJBD	
CCSc1cccc(NCc2ccc([N+](=O)[O-])c(Cl)c2)c1	761514858	GYPLSEPBECOTLB-UHFFFAOYSA-N	322.817	4.972	5	20	DJBD	
CC(C)N(Cc1cccs1)Cc1cc([N+](=O)[O-])ccc1Cl	49028494	MBXCLNSBTXEINN-UHFFFAOYSA-N	324.833	4.720	5	20	DJBD	
C/C(=C\c1ccc(-c2cccc([N+](=O)[O-])c2)s1)c1cnccn1	187649187	CBYDAAVXEMEZFU-FMIVXFBMSA-N	323.377	4.674	5	20	DJBD	
C[C@H](N[C@H](C)c1csc(Cl)c1)c1ccc([N+](=O)[O-])cc1	297288822	LSLVADASFIQLTK-VHSXEESVSA-N	310.806	4.722	5	20	DJBD	
Cc1ccc(C)c(CSc2ncc([N+](=O)[O-])cc2Cl)c1	609893070	CCIZKTSEUWXYCJ-UHFFFAOYSA-N	308.790	4.552	5	20	DJBD	
O=[N+]([O-])c1cc(CN(Cc2ccoc2)C2CCCCC2)cs1	610215448	VIEWWZFEQXFMTF-UHFFFAOYSA-N	320.414	4.584	5	20	DJBD	
CCCCC[C@@H](C)CC(=O)Nc1c(F)ccc([N+](=O)[O-])c1C	800145200	FFFMWDQLYVBNFH-LLVKDONJSA-N	310.369	4.587	5	20	DJBD	
CC[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1	451107878	UJLFFODGKZSTOI-YVEFUNNKSA-N	302.349	4.536	5	20	DJBD	
Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)CCCCCC(C)C	800148146	YLSXRYAHSTUCEZ-UHFFFAOYSA-N	310.369	4.587	5	20	DJBD	
Cc1ccccc1[C@@H]1CCCN1Cc1cccc([N+](=O)[O-])c1C	603857572	YAGIQCJOQXDIBM-IBGZPJMESA-N	310.397	4.549	5	20	DJBD	
CC(C)Oc1ccc(Oc2ccc([N+](=O)[O-])c3cnccc23)cc1	609765046	HIOCPDSKSMOTCT-UHFFFAOYSA-N	324.336	4.723	5	20	DJBD	
CC(=O)c1ccc(Oc2cc(C)ccc2Cl)c([N+](=O)[O-])c1	7982800	QYRIUPHZWUZFLP-UHFFFAOYSA-N	305.717	4.552	5	20	DJBD	
C[C@H](N[C@@H](C)c1cc2ccccc2o1)c1ccc([N+](=O)[O-])cc1	191370136	XQRTYVLQXUJGNF-STQMWFEESA-N	310.353	4.753	5	20	DJBD	
Cc1ccc(C)c([C@@H](C)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1	319687771	BHXZNLPWWJRSEO-HZPDHXFCSA-N	312.413	4.932	5	20	DJBD	
CCn1c(C)nc([N+](=O)[O-])c1Oc1ccc(-c2ccccc2)cc1	517196836	MFAGYGWOFYNACD-UHFFFAOYSA-N	323.352	4.579	5	20	DJBD	
CC[C@H](N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccc(F)cc1	531205109	WRUIZTWMXOJKTK-GUYCJALGSA-N	316.376	4.844	5	20	DJBD	
CSCc1ccc(N[C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1	540836823	ZEJIJSICABDCTG-CYBMUJFWSA-N	316.426	4.939	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)s1	774141536	VEORLVQEMIGYIR-BLLLJJGKSA-N	316.426	4.693	5	20	DJBD	
CCc1cccc(C)c1NCc1ccc(Cl)cc1[N+](=O)[O-]	863996712	XPWFRXXGIGZWFB-UHFFFAOYSA-N	304.777	4.731	5	20	DJBD	
CSCc1ccc(NCc2ccc(Cl)cc2[N+](=O)[O-])cc1	864010754	LLXJNEDPJCAOFO-UHFFFAOYSA-N	322.817	4.723	5	20	DJBD	
O=C(Nc1nccs1)c1c2ccccc2cc2ccccc12	865143599	ZETPSTOHIUAIKK-UHFFFAOYSA-N	304.374	4.702	5	20	DJBD	
Cc1cccc(/C=C(\Cl)c2nc3cc([N+](=O)[O-])ccc3[nH]2)c1	7133416	QPCHLMMGJFFLAT-JYRVWZFOSA-N	313.744	4.516	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1CN1CCC[C@H]1c1cccs1	522534921	XZWWFKOETUJBEZ-ZDUSSCGKSA-N	322.817	4.647	5	20	DJBD	
O=[N+]([O-])c1ccc2c(c1)[C@@H](NCc1ccc3occc3c1)CCC2	595072584	HPDNFKTWYWDPHP-SFHVURJKSA-N	322.364	4.508	5	20	DJBD	
C[C@H](N[C@@H](C)c1ccc(F)c(Cl)c1)c1ccc([N+](=O)[O-])cc1	178649636	DFEVCNITRGYSSW-QWRGUYRKSA-N	322.767	4.799	5	20	DJBD	
COc1cccc(CS[C@H](C)c2ccccc2[N+](=O)[O-])c1	463251711	YFRYERCNTPZXMN-GFCCVEGCSA-N	303.383	4.598	5	20	DJBD	
Oc1nc(CCCc2ccsc2)nc2cc3ccccc3cc12	541259366	MPVUORIMRXHHBK-UHFFFAOYSA-N	320.417	4.725	5	20	DJBD	
Cc1cc(NCc2cccc(C(F)F)c2)c(F)cc1[N+](=O)[O-]	1327616932	HDOGQXZQSKYVJO-UHFFFAOYSA-N	310.275	4.592	5	20	DJBD	
COc1cc(N[C@H](C)c2cccc3ccccc23)ccc1[N+](=O)[O-]	462923278	AENONEKKYHKEJR-CYBMUJFWSA-N	322.364	4.930	5	20	DJBD	
C[C@@H](Nc1ccccc1OCC1CC1)c1ccccc1[N+](=O)[O-]	525720337	XAFPWTUZWNJGGD-CYBMUJFWSA-N	312.369	4.557	5	20	DJBD	
C[C@H](N[C@H]1CC(C)(C)c2ccccc21)c1cccc([N+](=O)[O-])c1	540117292	BYNXWZZMRXESAJ-UGSOOPFHSA-N	310.397	4.668	5	20	DJBD	
Cc1cc2cc(CN[C@H](C)c3cccc([N+](=O)[O-])c3C)ccc2[nH]1	556913061	PYVZPNAQZDTWPI-CQSZACIVSA-N	323.396	4.544	5	20	DJBD	
C[C@@H](Nc1ccc2ccccc2c1)c1ccc(N)c([N+](=O)[O-])c1	788693058	UNWKPJNCGXSIEB-GFCCVEGCSA-N	307.353	4.503	5	20	DJBD	
CC[C@@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)c1cc(F)ccc1F	90078075	CREIXQKSWLEQID-PIGZYNQJSA-N	320.339	4.675	5	20	DJBD	
Cc1ccc(N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1OC(F)F	537448613	COPAVLPTICQXCM-NSHDSACASA-N	322.311	4.678	5	20	DJBD	
O=[N+]([O-])c1ncccc1Oc1ccc2oc3ccccc3c2c1	603836635	QUQHQSATYGTMGH-UHFFFAOYSA-N	306.277	4.682	5	20	DJBD	
CCCOc1ccc(N[C@H](C)c2ccccc2[N+](=O)[O-])c(C)c1	742703374	JGFHAMHVHVBGKF-CQSZACIVSA-N	314.385	4.865	5	20	DJBD	
CC(=O)c1ccc(N[C@H](C)c2cc(C)sc2C)c([N+](=O)[O-])c1	25497793	UDBUSGDDXPLPRA-SNVBAGLBSA-N	318.398	4.649	5	20	DJBD	
C[C@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1Cl	178657454	RIGPGWDXFXCIIS-MNOVXSKESA-N	322.767	4.799	5	20	DJBD	
C[C@@H](Nc1ccc([N+](=O)[O-])cc1F)c1nc(C(C)(C)C)cs1	301173345	FJVRLPYXWIXRFR-SECBINFHSA-N	323.393	4.661	5	20	DJBD	
O=[N+]([O-])c1cccc2nc(/C=C\c3scnc3C3CC3)ccc12	447358937	JVHJAYOLXVEGHM-CLFYSBASSA-N	323.377	4.647	5	20	DJBD	
CC[C@@H](NCc1ccc([N+](=O)[O-])c(Cl)c1)c1ccc(C)cc1	761520170	MGGHYBHHQOKHJT-MRXNPFEDSA-N	318.804	4.798	5	20	DJBD	
C[C@H](N[C@H](C)c1ccccc1Cl)c1ccc([N+](=O)[O-])cc1	37177049	WSBPRKZWXZAGQP-NWDGAFQWSA-N	304.777	4.660	5	20	DJBD	
CCCCCN(C(=O)c1cccc([N+](=O)[O-])c1C)[C@H](C)CCC	63327362	SGSSGOONOPPEDY-CQSZACIVSA-N	320.433	4.724	5	20	DJBD	
CC[C@H](NCc1ccc(Cl)cc1F)c1cccc([N+](=O)[O-])c1	427880793	XEEBKAYRVMOKCI-INIZCTEOSA-N	322.767	4.628	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1Oc1cnc2ccccc2c1	471628666	NJOVMQOPCRGLDG-UHFFFAOYSA-N	300.701	4.589	5	20	DJBD	
C[C@H](c1cc2ccccc2o1)N(C)CCc1ccc([N+](=O)[O-])cc1	524425143	QRGSBECROUQNSP-CQSZACIVSA-N	324.380	4.577	5	20	DJBD	
Cc1nc([C@H](C)NCc2c3ccccc3cc3ccccc23)no1	1325734227	RAAWKIMYTFXDEV-ZDUSSCGKSA-N	317.392	4.535	5	20	DJBD	
CC[C@@H](N[C@H](C)c1ccc(C)s1)c1cccc([N+](=O)[O-])c1	49159411	XUSDCNJCJHBXAD-IUODEOHRSA-N	304.415	4.767	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc2oc(C)c(C)c2c1	477899754	FVIUQTCADXXCFW-UHFFFAOYSA-N	324.336	4.519	5	20	DJBD	
C[C@@H](N[C@@H]1CCc2sc(Cl)cc21)c1ccc([N+](=O)[O-])cc1	571486376	CIPYBJHVXGIJNS-NOZJJQNGSA-N	322.817	4.648	5	20	DJBD	
C/C=C/c1ccc(OCc2cccc([N+](=O)[O-])c2C)c(OC)c1	60803953	RQEXDBPRVAFAEJ-GQCTYLIASA-N	313.353	4.524	5	20	DJBD	
CCCCCN(C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C)C(C)C	127545882	FLAAJYXERDEMDG-UHFFFAOYSA-N	321.421	4.644	5	20	DJBD	
CC(=O)c1ccc(Sc2ccc(C)cc2C)c([N+](=O)[O-])c1	7983499	ZDUVTGORQMHAQQ-UHFFFAOYSA-N	301.367	4.565	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1	447530087	LYIGDHJNZRFGKU-AUUYWEPGSA-N	310.397	4.631	5	20	DJBD	
Cc1ccccc1[C@@H](Nc1ncc([N+](=O)[O-])cc1Cl)C1CC1	522936111	FNFXVOPSYATHKQ-HNNXBMFYSA-N	317.776	4.515	5	20	DJBD	
CCC[C@H](N[C@@H](CC)c1cccc([N+](=O)[O-])c1)c1ccccn1	610810439	JPWNRCBREKZEGB-WMZOPIPTSA-N	313.401	4.572	5	20	DJBD	
O=[N+]([O-])c1cccc2ccc(/C=C/c3cccc(F)c3F)nc12	78561127	DOMLPJMFYDIIDM-VQHVLOKHSA-N	312.275	4.592	5	20	DJBD	
Cc1ccnc(Oc2ccc(C3CC3)cc2Cl)c1[N+](=O)[O-]	432163317	ALXKNXQLOPBMNA-UHFFFAOYSA-N	304.733	4.621	5	20	DJBD	
CC(C)Oc1ccc(Oc2ccc3ncccc3c2[N+](=O)[O-])cc1	485175270	SGLFGYZLRDVONP-UHFFFAOYSA-N	324.336	4.723	5	20	DJBD	
C[C@H](Nc1ccc2oc(C3CC3)nc2c1)c1cccc([N+](=O)[O-])c1	192744109	GQXHCNSXHMGXKD-NSHDSACASA-N	323.352	4.787	5	20	DJBD	
COc1ccc(CS[C@@H](C)c2ccccc2)cc1[N+](=O)[O-]	521557528	ULPVZZHVLZCKKL-LBPRGKRZSA-N	303.383	4.598	5	20	DJBD	
Cc1ccccc1[C@H](NCc1cccc([N+](=O)[O-])c1C)C(C)C	540360796	BYOYVHVSTAITLL-LJQANCHMSA-N	312.413	4.699	5	20	DJBD	
C[C@H]1C[C@@H](NCc2c3ccccc3cc3ccccc23)CCO1	769710754	PFFZYFYUZQEAMG-YJBOKZPZSA-N	305.421	4.650	5	20	DJBD	
CC(C)c1cccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1	16494410	HPBXZYHBGKIJSH-UHFFFAOYSA-N	318.760	4.624	5	20	DJBD	
CC(C)c1ccc(NCc2ccc(Cl)cc2[N+](=O)[O-])cc1	50443123	MMUYQJNLWQKZLA-UHFFFAOYSA-N	304.777	4.984	5	20	DJBD	
CC(C)(C)OCCOc1ccc([N+](=O)[O-])cc1-c1cccs1	65233662	UAOKVGKICZAHQV-UHFFFAOYSA-N	321.398	4.517	5	20	DJBD	
Cc1ccc([C@H](NCc2ccccc2[N+](=O)[O-])C2CCC2)cc1	427551969	ZWYBDVMSAOYHGQ-LJQANCHMSA-N	310.397	4.534	5	20	DJBD	
C/C(=C/c1cccc([N+](=O)[O-])c1)CN(C)[C@@H](C)c1cccs1	470176653	XRJGWFYNMRGVOG-ZVHGMHCTSA-N	316.426	4.753	5	20	DJBD	
CCc1ccccc1NCc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	600851981	WNYICZZWPMARLR-UHFFFAOYSA-N	324.302	4.788	5	20	DJBD	
COc1cccc(CSCc2ccc(Cl)cc2[N+](=O)[O-])c1	609693008	PSMOXOJIFZXDGZ-UHFFFAOYSA-N	323.801	4.690	5	20	DJBD	
CCc1ccc([C@@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)s1	41631839	FLZXDVPXPPRQEJ-NWDGAFQWSA-N	304.415	4.631	5	20	DJBD	
O=C(Nc1ccccc1-c1ccccc1)c1csc([N+](=O)[O-])c1	42567788	NFSKEEDUONSJKG-UHFFFAOYSA-N	324.361	4.576	5	20	DJBD	
Cc1ccccc1[C@H](C(C)C)N(C)Cc1csc([N+](=O)[O-])c1	488694841	ITRDYIFEUVKDGS-KRWDZBQOSA-N	318.442	4.794	5	20	DJBD	
O=[N+]([O-])c1cccc(CNc2ccc3c(c2)Cc2ccccc2-3)c1	302834396	UGCZAFBIVALBTF-UHFFFAOYSA-N	316.360	4.778	5	20	DJBD	
CSc1ccc([C@@H](C)N[C@H](C)c2ccccc2[N+](=O)[O-])cc1	315381505	DLPMSQMQAHNZJF-CHWSQXEVSA-N	316.426	4.729	5	20	DJBD	
Cc1ccc2cc([C@@H](C)NCc3ccc([N+](=O)[O-])cc3)oc2c1	426057334	ICLHWPICMHVFGY-CYBMUJFWSA-N	310.353	4.500	5	20	DJBD	
O=[N+]([O-])c1ccccc1/C=C\CN1CCC[C@@H]1c1cccs1	506112053	GJLYNYHLMXJHEP-NKPXIPJASA-N	314.410	4.507	5	20	DJBD	
CC(C)Oc1ccccc1CSc1ccc([N+](=O)[O-])cc1	515779915	KVOMCLMMMSUQMR-UHFFFAOYSA-N	303.383	4.674	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1ccc(Cl)cc1F	548635780	VOSGPXPIBYTRBK-NSHDSACASA-N	322.767	4.547	5	20	DJBD	
CN(C(=O)c1c2ccccc2cc2ccccc12)[C@H]1CCSC1	813095362	SKPNBPZRVBCOPB-INIZCTEOSA-N	321.445	4.571	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N(C)Cc1cc2ccccc2[nH]1	1323550424	BHWDLTFYCNYBMV-CQSZACIVSA-N	323.396	4.578	5	20	DJBD	
O=[N+]([O-])c1cccc2ccc(/C=C\c3cc(F)ccc3F)nc12	206957711	AJFUIXLZIZXAOK-YVMONPNESA-N	312.275	4.592	5	20	DJBD	
O=[N+]([O-])c1c(Oc2cccc(Cl)c2)ccc2ncccc12	485851827	ZPILQDKWXKYIGW-UHFFFAOYSA-N	300.701	4.589	5	20	DJBD	
O=[N+]([O-])c1ccc(CNc2ccc(C3CCC3)cc2)c(F)c1	487160863	PGXPLMQDAOVMQF-UHFFFAOYSA-N	300.333	4.614	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)c1c(F)cccc1F	492727978	LZROMRSMSPZYOA-RYUDHWBXSA-N	320.339	4.593	5	20	DJBD	
C[C@@H](N[C@H](c1ccccc1)C1CCC1)c1cccc([N+](=O)[O-])c1	531960959	JYSBCQMFMQLZFB-AUUYWEPGSA-N	310.397	4.787	5	20	DJBD	
Cc1cc([C@@H](C)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)ccc1F	611336107	JCDGYDOCWKJTHV-ZIAGYGMSSA-N	316.376	4.763	5	20	DJBD	
C[C@@H](NCc1ccc(C(C)(F)F)cc1)c1ccc([N+](=O)[O-])cc1	293860842	YZXPVHRVXIQBPM-GFCCVEGCSA-N	320.339	4.557	5	20	DJBD	
Cc1ccc([C@H](C)Nc2ccc([N+](=O)[O-])c3cnccc23)cc1	301089858	MSTSSSOXBCWNGF-ZDUSSCGKSA-N	307.353	4.625	5	20	DJBD	
CC(C)Sc1ccc([C@H](C)Nc2ncccc2[N+](=O)[O-])cc1	301208112	SORKKMVYQQRWFU-LBPRGKRZSA-N	317.414	4.663	5	20	DJBD	
CCc1ccc([C@H](C)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)s1	453251329	ZJEFYLNABGOKST-RYUDHWBXSA-N	304.415	4.631	5	20	DJBD	
Cc1ccc2[nH]c(CN[C@H](C)c3ccccc3[N+](=O)[O-])cc2c1C	472038213	MNRCECMTUUJKHK-CQSZACIVSA-N	323.396	4.544	5	20	DJBD	
O=[N+]([O-])c1cc(F)c(CNc2cccc3ccsc23)c(F)c1	506246546	GUFAQSNYLIHXKE-UHFFFAOYSA-N	320.320	4.700	5	20	DJBD	
CC[C@@H](N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1cccc(F)c1	525868736	BXUDNHQIGKDXIY-SUMWQHHRSA-N	316.376	4.844	5	20	DJBD	
CCC[C@@H](N[C@@H](C)c1cnc(C)s1)c1cccc([N+](=O)[O-])c1	601298658	PYSPRIMWMVSZOQ-XHDPSFHLSA-N	319.430	4.552	5	20	DJBD	
Cc1c(CN[C@@H](C)c2cc3ccccc3o2)cccc1[N+](=O)[O-]	182635124	ZZPDNGBUSGMOLN-ZDUSSCGKSA-N	310.353	4.500	5	20	DJBD	
Cc1c([C@@H](C)N[C@@H](c2ccccc2)C(C)C)cccc1[N+](=O)[O-]	480162296	KZXMTLQPEYUURN-DNVCBOLYSA-N	312.413	4.951	5	20	DJBD	
C[C@H](N[C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(F)cc1Cl	451108679	SZERNBNIHYKDOD-WDEREUQCSA-N	322.767	4.799	5	20	DJBD	
Cc1ccc([C@@H](C)NCCc2ccc(Cl)cc2[N+](=O)[O-])s1	495433900	PVYAIHMFTVAORK-LLVKDONJSA-N	324.833	4.511	5	20	DJBD	
Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)CCC1CCCCC1	514473824	GOYQLRKOQIEUMP-UHFFFAOYSA-N	304.390	4.511	5	20	DJBD	
CCC[C@H](CC)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1	517547283	KTMWUIJNTLYLDC-AWEZNQCLSA-N	302.374	4.523	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H](C)c2ccc3c(c2)CCC3)cc1[N+](=O)[O-]	540221438	GKSTUYZBZWREHF-CABCVRRESA-N	324.424	4.804	5	20	DJBD	
Cc1c([C@H](C)NCC(C)(C)c2cccs2)cccc1[N+](=O)[O-]	483130764	XZNYQCMPPHRABE-ZDUSSCGKSA-N	318.442	4.593	5	20	DJBD	
Cc1ccc([C@H](C)Nc2ccc3scnc3c2)cc1[N+](=O)[O-]	488477477	JNVIIBQUZWJNHZ-NSHDSACASA-N	313.382	4.686	5	20	DJBD	
Cc1c(CSCc2csc(C3CC3)n2)cccc1[N+](=O)[O-]	534683808	JHACYPXLCHYCAJ-UHFFFAOYSA-N	320.439	4.671	5	20	DJBD	
C[C@@H](c1ccc(F)cc1)N(C)Cc1ccc(Cl)cc1[N+](=O)[O-]	609704863	XEODMKGUTCWFND-NSHDSACASA-N	322.767	4.580	5	20	DJBD	
COc1cc([N+](=O)[O-])ccc1[C@@H](C)Nc1ccc(C)c(Cl)c1	863988196	FFMKZWRZHMAFKQ-LLVKDONJSA-N	320.776	4.738	5	20	DJBD	
CN(CC(F)(F)F)C(=O)c1c2ccccc2cc2ccccc12	81846003	BXDPNRQQZQOUHR-UHFFFAOYSA-N	317.310	4.627	5	20	DJBD	
C[C@H](N[C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(C2CC2)cc1	417356293	PASRIKHKZBNJRX-UONOGXRCSA-N	310.397	4.884	5	20	DJBD	
O=[N+]([O-])c1cnc(N[C@H](c2ccc(F)cc2)C2CCCC2)s1	443514472	GVWAJJVFRAUEHE-AWEZNQCLSA-N	321.377	4.534	5	20	DJBD	
Cc1ccc([C@@H](C)NCc2cccc(F)c2Cl)cc1[N+](=O)[O-]	567372037	TUNFRKGDLDCQKB-LLVKDONJSA-N	322.767	4.547	5	20	DJBD	
CSc1cc(NCc2ccc(C)c([N+](=O)[O-])c2)ccc1Cl	864041581	VCAUVACZFYRTCY-UHFFFAOYSA-N	322.817	4.891	5	20	DJBD	
CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1cscc1C	872065738	ANNZTSFGMBCQHK-NSHDSACASA-N	322.455	4.537	5	20	DJBD	
CC[C@H](N[C@H](C)c1ccc(C)s1)c1cccc([N+](=O)[O-])c1	49159406	XUSDCNJCJHBXAD-DOMZBBRYSA-N	304.415	4.767	5	20	DJBD	
C[C@@H](SCc1nc(C2CC2)cs1)c1cccc([N+](=O)[O-])c1	541294493	DJFNBMXTNYJTQS-SNVBAGLBSA-N	320.439	4.923	5	20	DJBD	
C[C@@H]1C[C@@H](c2ccccc2)CN1[C@H](C)c1ccccc1[N+](=O)[O-]	441399097	UOKCDYHUYZVBAH-BFYDXBDKSA-N	310.397	4.534	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H](C)c2c(C)cccc2C)cc1[N+](=O)[O-]	544897199	BKKYKTKXBLWCBV-CVEARBPZSA-N	312.413	4.932	5	20	DJBD	
C/C(=C/c1nc(-c2ccc(C)c([N+](=O)[O-])c2)no1)c1ccccc1	546985105	HYYZQZGGFUVKDC-RAXLEYEMSA-N	321.336	4.514	5	20	DJBD	
CCCCCC[C@H](CC)C(=O)Nc1cc([N+](=O)[O-])ccc1OC	734992894	RGHXUNDDVPNYFD-ZDUSSCGKSA-N	322.405	4.539	5	20	DJBD	
O=[N+]([O-])c1cccc(-c2nnc(/C(F)=C/C3CCCCC3)o2)c1	1329096773	ZWANVESGADURKS-ZROIWOOFSA-N	317.320	4.536	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC(C)(C)CC(C)(C)C	467462633	BXAGVLGTTXDNQG-UHFFFAOYSA-N	321.421	4.548	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H](C)c1cccc(C)c1C	492934508	CDKGAIJKKMOYBC-HZPDHXFCSA-N	312.413	4.932	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2cccc(C(F)(F)F)c2)c(F)c1	513108771	SBLKUUAPRNPADD-UHFFFAOYSA-N	301.195	4.545	5	20	DJBD	
Cc1cc(C)c(NCc2cc(F)ccc2[N+](=O)[O-])c(Cl)c1	742258259	ZFPXIMYRDLADJM-UHFFFAOYSA-N	308.740	4.616	5	20	DJBD	
Cc1c([C@H](C)N[C@H](C)c2cccc(F)c2F)cccc1[N+](=O)[O-]	90963323	YPBKXSFCTRJLQH-NWDGAFQWSA-N	320.339	4.593	5	20	DJBD	
CC[C@@H](NCc1cccc([N+](=O)[O-])c1C)c1ccc(Cl)cc1	195669321	HFLJSKJTZZLHTC-MRXNPFEDSA-N	318.804	4.798	5	20	DJBD	
Cc1ccc(C[C@H](C)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1	315330305	VSNAZPNLNLHCHZ-GXTWGEPZSA-N	318.442	4.555	5	20	DJBD	
C[C@H](N[C@H](C)c1ccc(F)cc1Cl)c1ccccc1[N+](=O)[O-]	451111421	SZERNBNIHYKDOD-MNOVXSKESA-N	322.767	4.799	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)c(CN2CCC[C@H]2c2cccs2)c1	735493505	ZWLOGIXXRXJOOF-AWEZNQCLSA-N	322.817	4.647	5	20	DJBD	
Cc1ccc(Cl)c(NCc2ccc(Cl)cc2[N+](=O)[O-])c1	232244020	YLUYBQWQDUUHET-UHFFFAOYSA-N	311.168	4.822	5	20	DJBD	
C[C@H](N[C@@H](CC(F)F)c1ccccc1)c1ccc([N+](=O)[O-])cc1	421875031	JMOWZMCHBXNYLX-LRDDRELGSA-N	320.339	4.642	5	20	DJBD	
Cc1cc(N[C@H](C)CCCC(F)(F)F)c(F)cc1[N+](=O)[O-]	461939912	YXWKRWSBQLERFZ-SECBINFHSA-N	308.275	4.575	5	20	DJBD	
CCN(Cc1cccs1)[C@H](C)c1cc([N+](=O)[O-])ccc1C	485743064	JMHXHRAPCNFROT-CYBMUJFWSA-N	304.415	4.548	5	20	DJBD	
CC[C@@H](C)CN(CC)C(=O)c1cc2ccccc2c2cccnc12	490883931	DAOUVNUIMLSXJG-OAHLLOKOSA-N	320.436	4.896	5	20	DJBD	
Cc1ccc(CN(Cc2cc(F)ccc2[N+](=O)[O-])C(C)C)s1	920091259	MCTDTUHRSOAOIU-UHFFFAOYSA-N	322.405	4.514	5	20	DJBD	
C[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1Cl	20015683	SBSVRGNNKJYZMS-NEPJUHHUSA-N	304.777	4.660	5	20	DJBD	
C[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1Cl	119703348	ZITNNFPTOKCDJM-MNOVXSKESA-N	322.767	4.799	5	20	DJBD	
COc1ccc([C@H](C)Nc2ccc(Cl)cc2[N+](=O)[O-])cc1F	302639215	WVBFQNVRGMNDFZ-VIFPVBQESA-N	324.739	4.569	5	20	DJBD	
O=[N+]([O-])c1cccc2nc(/C=C/c3scnc3C3CC3)ccc12	447358938	JVHJAYOLXVEGHM-VQHVLOKHSA-N	323.377	4.647	5	20	DJBD	
CCCN(CC(C)C)C(=O)c1cc2ccccc2c2cccnc12	643153800	FBRZWVIHEFKGJV-UHFFFAOYSA-N	320.436	4.896	5	20	DJBD	
C[C@@H](Sc1ccc([N+](=O)[O-])cc1F)c1nc2ccccc2o1	187581555	RGWXQRPBTNOANK-SECBINFHSA-N	318.329	4.728	5	20	DJBD	
C[C@H](c1ccccc1[N+](=O)[O-])N1CCC(c2ccccc2)CC1	441194213	YVORUXICSBZZDH-OAHLLOKOSA-N	310.397	4.535	5	20	DJBD	
C[C@H](SCCOc1ccccc1[N+](=O)[O-])c1ccc(F)cc1	520676491	OTILGSPGOWADHI-LBPRGKRZSA-N	321.373	4.607	5	20	DJBD	
Cc1c([C@H](C)NCc2ccc([N+](=O)[O-])cc2)oc2ccccc12	77221002	PEXDJRVDBQBAID-ZDUSSCGKSA-N	310.353	4.500	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H](C)c2sccc2C)cc1[N+](=O)[O-]	90217588	UVNAFSULBASPHS-CHWSQXEVSA-N	304.415	4.685	5	20	DJBD	
Cc1c(NCc2ccccc2C(F)(F)F)cccc1[N+](=O)[O-]	302892025	ATVILKYJFTUJES-UHFFFAOYSA-N	310.275	4.534	5	20	DJBD	
Cc1cccc2c1[C@@H](C)C[C@H]2NCc1cccc([N+](=O)[O-])c1C	478499971	TUHNAXQGPJYQFZ-SUMWQHHRSA-N	310.397	4.550	5	20	DJBD	
O=[N+]([O-])c1c[nH]c(-c2csc(-c3c(F)cccc3Cl)n2)c1	504424179	MBTKGJDQVVRJOA-UHFFFAOYSA-N	323.736	4.506	5	20	DJBD	
Cc1cc(Oc2ncc([N+](=O)[O-])cc2Cl)cc(C)c1Cl	609891478	QSGWMAPQKZASKX-UHFFFAOYSA-N	313.140	4.706	5	20	DJBD	
CCC1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1	617193892	ZMTUTDKGSVDHBS-UHFFFAOYSA-N	318.420	4.650	5	20	DJBD	
CC[C@H](NCCc1ccc(Cl)cc1[N+](=O)[O-])c1cccs1	495413030	CSQFQOSGBAVENH-ZDUSSCGKSA-N	324.833	4.593	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1c(F)cccc1Cl	531949657	QNLXBXAUTAIQOQ-NSHDSACASA-N	322.767	4.547	5	20	DJBD	
C/C=C\c1ccc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1	565976070	PBPIPJLNDIKUCT-RQOWECAXSA-N	316.744	4.534	5	20	DJBD	
O=[N+]([O-])c1cc(F)c(N[C@@H]2CCSc3ccccc32)c(F)c1	301813798	ZEISVAOKDITAGO-CYBMUJFWSA-N	322.336	4.522	5	20	DJBD	
C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H]1c1cccs1	432978042	QGAYVQXWCDQSCT-DOMZBBRYSA-N	302.399	4.554	5	20	DJBD	
Cc1c(CN(C2CC2)[C@H](C)c2ccccc2)cccc1[N+](=O)[O-]	746115047	HGTPLHWCTPFJEY-OAHLLOKOSA-N	310.397	4.629	5	20	DJBD	
Cc1cnc(NC(=O)c2c3ccccc3cc3ccccc23)o1	754616927	ZHPFGAAXBQGKKK-UHFFFAOYSA-N	302.333	4.542	5	20	DJBD	
O=[N+]([O-])c1ccc(/C=C/Sc2nc(-c3ccccc3)co2)o1	789981641	ASOFBWHBSXDCHU-CMDGGOBGSA-N	314.322	4.606	5	20	DJBD	
CC(C)C[C@@H](NCc1ccc([N+](=O)[O-])c(F)c1)c1ccccc1	801529145	ZXRQLLBEYIIFNC-QGZVFWFLSA-N	316.376	4.611	5	20	DJBD	
Cc1ccccc1CSc1ccc([N+](=O)[O-])c2cnccc12	15171045	YLJYLVAFUMPZQK-UHFFFAOYSA-N	310.378	4.744	5	20	DJBD	
CC(=O)c1cc(N[C@H](C)c2cc(C)sc2C)ccc1[N+](=O)[O-]	557520301	XKSUSOXYJZJMJZ-SNVBAGLBSA-N	318.398	4.649	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1CNc1cc(F)cc(Cl)c1	230001406	JACNTFBLWBFYRO-UHFFFAOYSA-N	315.131	4.653	5	20	DJBD	
C[C@H](CSCc1ccc(Cl)cc1[N+](=O)[O-])C(F)(F)F	439061815	KZEPFNOPXPJCAG-SSDOTTSWSA-N	313.728	4.680	5	20	DJBD	
c1ccc2c(c1)nc(CS[C@@H]1CCCOC1)c1ccccc12	542788197	XBWOENADNWJABI-CQSZACIVSA-N	309.434	4.800	5	20	DJBD	
C[C@H](N[C@H](C)c1ccccc1[N+](=O)[O-])c1cccc(C2CC2)c1	551103589	LYWYVEOVJALHTL-UONOGXRCSA-N	310.397	4.884	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2ccc3oc4ccccc4c3c2)nc1	591633740	OTOCUEHRRHFFBE-UHFFFAOYSA-N	306.277	4.682	5	20	DJBD	
CCSc1cccc(N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1	537523546	MGWVHBVPOMHIFS-LBPRGKRZSA-N	302.399	4.880	5	20	DJBD	
Cc1cccc(C)c1[C@@H](C)N[C@H](C)c1cccc([N+](=O)[O-])c1C	544898936	YLOKIVCECNERBS-HZPDHXFCSA-N	312.413	4.932	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H](C)c2cc([N+](=O)[O-])ccc2C)s1	765305407	OWCLRAFIPSWYJN-QWHCGFSZSA-N	304.415	4.685	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H](C)c2cc([N+](=O)[O-])ccc2C)s1	765305408	OWCLRAFIPSWYJN-STQMWFEESA-N	304.415	4.685	5	20	DJBD	
O=C(CCCC1CCCC1)Nc1cccc([N+](=O)[O-])c1Cl	813244239	SVUHFDYHFYCDAE-UHFFFAOYSA-N	310.781	4.547	5	20	DJBD	
O=C(NCCC(F)(F)F)c1c2ccccc2cc2ccccc12	1318871181	HFQAJIRINGALPC-UHFFFAOYSA-N	317.310	4.675	5	20	DJBD	
C[C@H](Sc1ncccc1[N+](=O)[O-])c1ccc(F)c(Cl)c1	49418403	VSJHUZQQOMMOSH-QMMMGPOBSA-N	312.753	4.636	5	20	DJBD	
O=[N+]([O-])c1ccccc1/C=C/CN1CCC[C@H]1c1ccsc1	507167398	LCXVLIHBVUTLQH-GIZXNFQBSA-N	314.410	4.507	5	20	DJBD	
C/C=C\c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1	516505886	MJGZOFBYQKDVEH-IHWYPQMZSA-N	316.744	4.534	5	20	DJBD	
O=[N+]([O-])c1cc(CSC2=Nc3ccccc3C2)ccc1Cl	768385381	CORGUJQFDICUFT-UHFFFAOYSA-N	318.785	4.768	5	20	DJBD	
Cc1c(CN[C@@H](C)c2oc3ccccc3c2C)cccc1[N+](=O)[O-]	326443757	MNCUVKUXFLEZRO-AWEZNQCLSA-N	324.380	4.809	5	20	DJBD	
C[C@H](SCc1ncc(Cl)s1)c1ccccc1[N+](=O)[O-]	478914928	YTXXKGIOGRRJAX-QMMMGPOBSA-N	314.819	4.699	5	20	DJBD	
O=[N+]([O-])c1ccc(NCc2coc3ccccc23)c2ncccc12	511691383	LSYTWWGOBZOCNV-UHFFFAOYSA-N	319.320	4.501	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)c1c(C)cccc1C	546224113	KRMBQUNRFCEYSR-JKSUJKDBSA-N	312.413	4.932	5	20	DJBD	
Cc1cc([C@@H](C)N[C@@H](C)c2ccccc2[N+](=O)[O-])c(C)s1	37122941	XUCNQSUNQCPGOM-NWDGAFQWSA-N	304.415	4.685	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1	49159191	UVNXDXDXINMCTR-OLZOCXBDSA-N	304.415	4.685	5	20	DJBD	
Cc1cc(C)cc([C@H](C)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1	531719732	IDYMKYKRUSMIGM-CVEARBPZSA-N	312.413	4.932	5	20	DJBD	
COc1cc(N[C@@H](C)c2ccc(Cl)c(F)c2)ccc1[N+](=O)[O-]	1324644765	OQORSYFRDXBTOU-VIFPVBQESA-N	324.739	4.569	5	20	DJBD	
O=[N+]([O-])c1cccc(CSc2cccc(Br)c2)c1	78460806	KLLHRDSODZOLSM-UHFFFAOYSA-N	324.199	4.650	5	20	DJBD	
Cc1cc(C)c(CNc2ccc([N+](=O)[O-])c3cnccc23)c(C)c1	195732204	KXZBSLGAUCSLLV-UHFFFAOYSA-N	321.380	4.680	5	20	DJBD	
C[C@H](N[C@@H](CC(F)F)c1ccccc1)c1cccc([N+](=O)[O-])c1	421877900	MPNFRWHHWOKZSX-LRDDRELGSA-N	320.339	4.642	5	20	DJBD	
Cc1cc(Cl)cc(CNC(C)(C)c2ccc([N+](=O)[O-])cc2)c1	559282067	BSOVSJGDOLZRHL-UHFFFAOYSA-N	318.804	4.582	5	20	DJBD	
C[C@@H](NC1(c2ccccc2Cl)CC1)c1cccc([N+](=O)[O-])c1	592391933	YLSOATVXZCFRBO-GFCCVEGCSA-N	316.788	4.588	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C[C@@H](C)CC(C)(C)C	610664572	HQDDBAVDOFRLAK-LLVKDONJSA-N	306.406	4.613	5	20	DJBD	
Cc1ccc(CN[C@H](CC(C)C)c2ccccc2)cc1[N+](=O)[O-]	61030623	SXKIIRUYFJMLQI-GOSISDBHSA-N	312.413	4.780	5	20	DJBD	
CC[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1cccc(F)c1	186842525	AXVMSVIXLWDSJS-SJCJKPOMSA-N	302.349	4.536	5	20	DJBD	
C[C@H](N[C@H](C)c1cccc(C2CC2)c1)c1ccc([N+](=O)[O-])cc1	451118663	YBPKHZBNQVEDTH-UONOGXRCSA-N	310.397	4.884	5	20	DJBD	
CCSc1ccc(Cl)cc1NCc1cccc([N+](=O)[O-])c1	462237035	XPIDYWDEVOTYHO-UHFFFAOYSA-N	322.817	4.972	5	20	DJBD	
Cc1cc(C)c(CNC(C)(C)c2ccccc2[N+](=O)[O-])cc1C	492228443	VXECOCFIHKKCES-UHFFFAOYSA-N	312.413	4.545	5	20	DJBD	
CC1(C(=O)OCc2nc3ccccc3c3ccccc23)CCC1	750534010	FODZDHRFLNQRBH-UHFFFAOYSA-N	305.377	4.621	5	20	DJBD	
C[C@@H](NCc1ccc2ccccc2c1)c1ccc([N+](=O)[O-])cc1	157323706	NAQMHMZZCCFTCB-CQSZACIVSA-N	306.365	4.599	5	20	DJBD	
CCOCc1cccc(N[C@@H](C)c2cccc([N+](=O)[O-])c2C)c1	182947378	SBFQXHZLOWIDSI-AWEZNQCLSA-N	314.385	4.613	5	20	DJBD	
CC(C)Sc1ccc([C@H](C)Nc2ccc([N+](=O)[O-])cn2)cc1	301214741	XENSQVQGXYUMEZ-LBPRGKRZSA-N	317.414	4.663	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H](c2ccccc2)C(C)C)cc1[N+](=O)[O-]	319840297	OFXJWIGUJWZIAN-HNAYVOBHSA-N	312.413	4.951	5	20	DJBD	
CC(C)Oc1ccc([C@@H](C)Nc2ccc([N+](=O)[O-])cc2F)cc1	390703539	FNDAYFUFHJYWIC-GFCCVEGCSA-N	318.348	4.694	5	20	DJBD	
C[C@@H]1CCN(C(=O)c2cc3ccccc3c3cccnc23)C[C@@H]1C	501626195	IGBJTTYPWKEXCN-CABCVRRESA-N	318.420	4.506	5	20	DJBD	
CCOc1ccc(S[C@H](C)c2ccccc2[N+](=O)[O-])cc1	742452375	OJKXUORCACAEPU-GFCCVEGCSA-N	303.383	4.847	5	20	DJBD	
CSc1ccc(CSCc2ccccc2[N+](=O)[O-])cc1	58690956	FMHVQGDWMPNLSP-UHFFFAOYSA-N	305.424	4.750	5	20	DJBD	
CC[C@H](Nc1cc(C)c([N+](=O)[O-])cn1)c1ccc(Cl)s1	426901427	SGCYMDNGIAUPJY-VIFPVBQESA-N	311.794	4.576	5	20	DJBD	
C/C=C\c1ccc(Oc2ccc([N+](=O)[O-])cc2F)c(OC)c1	513081251	HWTOLRCETJBKQF-ARJAWSKDSA-N	303.289	4.568	5	20	DJBD	
CC(C)(C)[C@@H](NCc1ccccc1[N+](=O)[O-])c1cccc(F)c1	540432515	RNOWXTNOCKCMQC-KRWDZBQOSA-N	316.376	4.611	5	20	DJBD	
CC[C@H](NCc1ccc([N+](=O)[O-])cc1Cl)c1ccc(F)cc1	546639732	LMCMISXABSAFTG-INIZCTEOSA-N	322.767	4.628	5	20	DJBD	
C[C@H](Nc1ccc(-c2ccccn2)cc1)c1ccccc1[N+](=O)[O-]	572537248	GUBLQGSLLIIFIF-AWEZNQCLSA-N	319.364	4.830	5	20	DJBD	
O=[N+]([O-])c1cc(/C=C\c2nc3cc(Cl)ccc3o2)cs1	603893820	GLCOUXBNLFQUBU-RJRFIUFISA-N	306.730	4.621	5	20	DJBD	
CC[C@@](C)(NCc1cc([N+](=O)[O-])ccc1Cl)c1ccccc1	730817787	VMYJWXACBQHNNN-QGZVFWFLSA-N	318.804	4.663	5	20	DJBD	
Cc1nc(CS[C@H](C)c2cc([N+](=O)[O-])ccc2C)c(C)s1	1116495198	RQODHMMZXVGPPC-SNVBAGLBSA-N	322.455	4.971	5	20	DJBD	
O=[N+]([O-])c1cccc(F)c1CSc1ccnc2ccccc12	609451994	FVVBRXBGEYDYHI-UHFFFAOYSA-N	314.341	4.574	5	20	DJBD	
CCC(=O)c1ccc(N2CCC[C@H]2c2ccccc2)c([N+](=O)[O-])c1	795064639	FYFFSCPHBCSFNN-INIZCTEOSA-N	324.380	4.529	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)cc1Oc1ccc2ncccc2c1	804388098	OEDJAQUZPVTKDJ-UHFFFAOYSA-N	300.701	4.589	5	20	DJBD	
CSc1cc(C)ccc1NCc1ccc(Cl)cc1[N+](=O)[O-]	864029962	GEBOJDZIYVCPCY-UHFFFAOYSA-N	322.817	4.891	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2ccc(Cl)c3ccccc23)nc1	14206555	SMVAPILKHWPIKM-UHFFFAOYSA-N	300.701	4.589	5	20	DJBD	
C[C@@H](Nc1ccc(Br)cc1[N+](=O)[O-])c1ccccc1	21506170	QIDGGPOHUFHUNZ-SNVBAGLBSA-N	321.174	4.530	5	20	DJBD	
O=[N+]([O-])c1cccc(-c2nc(-c3cc(F)ccc3F)cs2)c1	71971798	XNEKJVLHHBBJIH-UHFFFAOYSA-N	318.304	4.664	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H](C)c2cc(F)ccc2F)cc1[N+](=O)[O-]	78968588	LORSCBFNXIDBTM-NEPJUHHUSA-N	320.339	4.593	5	20	DJBD	
CC(=O)c1ccc(N[C@H](C)c2cccc(C)c2C)c([N+](=O)[O-])c1	303732460	VFYMMANYGFMDEJ-CYBMUJFWSA-N	312.369	4.587	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)SC[C@H](C)C(F)(F)F	486168183	DPZVRXYPGGLCHT-UWVGGRQHSA-N	307.337	4.896	5	20	DJBD	
CC[C@@H](NCc1ccc([N+](=O)[O-])cc1)c1cccc2ccccc12	615085679	FREPJXJDFUGACI-HXUWFJFHSA-N	320.392	4.989	5	20	DJBD	
CC(C)[C@@H](NCc1ccc([N+](=O)[O-])c(Cl)c1)c1ccccc1	761520448	GDIYSNGVVCGFLH-QGZVFWFLSA-N	318.804	4.735	5	20	DJBD	
CC(C)(C)[C@@H](NCc1ccc([N+](=O)[O-])c(F)c1)c1ccccc1	788494425	PKCRYRBBWQNEGB-KRWDZBQOSA-N	316.376	4.611	5	20	DJBD	
Cc1c(CN[C@@H](c2ccc(F)cc2)C(C)C)cccc1[N+](=O)[O-]	52035279	WSQCPSNYESHEBI-GOSISDBHSA-N	316.376	4.529	5	20	DJBD	
CCCc1cccc(C(C)C)c1NC(=O)CCC(C)(C)[N+](=O)[O-]	296469385	XTARNPJSOSEEDV-UHFFFAOYSA-N	320.433	4.537	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)cnc1Oc1ccc2ccccc2c1	301734782	GRGSIFMPTXYRCV-UHFFFAOYSA-N	300.701	4.589	5	20	DJBD	
Cc1cc(NCc2ccc([N+](=O)[O-])cc2)ccc1C(F)(F)F	462191732	SUMDIVHYAVXZBA-UHFFFAOYSA-N	310.275	4.534	5	20	DJBD	
CCOc1cc(OCc2cccc(C(F)F)c2)ccc1[N+](=O)[O-]	475889032	OZBKYJXRYCBMJQ-UHFFFAOYSA-N	323.295	4.510	5	20	DJBD	
C[C@@H](Nc1ccc(F)c(C2CC2)c1)c1ccccc1[N+](=O)[O-]	507468659	HOWCEAHVJOOZCB-LLVKDONJSA-N	300.333	4.784	5	20	DJBD	
Cc1cccc([C@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2C)c1C	531711320	OROCDDDYXIRKPD-JKSUJKDBSA-N	312.413	4.932	5	20	DJBD	
O=C(OCc1nc2ccccc2c2ccccc12)[C@@H]1CC12CCC2	759985181	YLWOPGMCSOGUID-KRWDZBQOSA-N	317.388	4.621	5	20	DJBD	
c1ccc2c(-c3cn[nH]c3)c3ccccc3c(-c3cn[nH]c3)c2c1	2048534659	DCVXONZIPIYOAC-UHFFFAOYSA-N	310.360	4.773	5	20	DJBD	
CC(C)Oc1cccc([C@H](C)Nc2sccc2[N+](=O)[O-])c1	301992566	NZVCZFBUACWTER-NSHDSACASA-N	306.387	4.617	5	20	DJBD	
Cc1c(CNc2ccccc2C(C)(F)F)cccc1[N+](=O)[O-]	453158115	KKAKAXQYFGZPPA-UHFFFAOYSA-N	306.312	4.627	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H](C)c2cc3ccccc3[nH]2)cc1[N+](=O)[O-]	775630356	HOSUNGZTQNLLJG-KGLIPLIRSA-N	323.396	4.796	5	20	DJBD	
CC[C@@H](C)c1nnc(-c2cc3ccccc3c3cccnc23)o1	1345513182	MMRUZNJJLXKZDF-GFCCVEGCSA-N	303.365	4.952	5	20	DJBD	
C[C@H](N[C@H](C)c1ccc(C2CC2)cc1)c1cccc([N+](=O)[O-])c1	417357811	SDNANARXZJGGLZ-KGLIPLIRSA-N	310.397	4.884	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)CCC1CCCCC1	530779872	TURAPQXFAJJMEX-UHFFFAOYSA-N	304.390	4.511	5	20	DJBD	
CC[C@H](NCc1cc(F)ccc1[N+](=O)[O-])c1cccc(Cl)c1	774875165	KMNRRPNKXQXJHT-HNNXBMFYSA-N	322.767	4.628	5	20	DJBD	
O=Cc1cccc(Oc2ccc([N+](=O)[O-])cc2Cl)c1Cl	814903077	QGLDIMKYCVHIHW-UHFFFAOYSA-N	312.108	4.506	5	20	DJBD	
Cc1ccccc1-c1noc(-c2ccc(C(C)C)c([N+](=O)[O-])c2)n1	904569559	RUAYTQUZHPIKCH-UHFFFAOYSA-N	323.352	4.744	5	20	DJBD	
CCC[C@@H](Nc1ccc(C(C)=O)cc1[N+](=O)[O-])c1ccccc1	8204887	FIDWSBIIGDFRLV-MRXNPFEDSA-N	312.369	4.751	5	20	DJBD	
O=[N+]([O-])c1ccc(N[C@@H]2CSc3ccccc32)c(Cl)c1	83748548	HMRMJPKGDUZMKC-CYBMUJFWSA-N	306.774	4.507	5	20	DJBD	
Cc1cc(N[C@@H](c2ccccc2Cl)C(C)C)ncc1[N+](=O)[O-]	470866768	YGZJQKDIJXIGNK-MRXNPFEDSA-N	319.792	4.761	5	20	DJBD	
CCC[C@@H](CC)S[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C	477060269	CQIZXWOQXUKBNA-CHWSQXEVSA-N	324.446	4.542	5	20	DJBD	
C[C@H](N[C@@H](C)c1ccccc1Cl)c1cccc([N+](=O)[O-])c1	20015686	SBSVRGNNKJYZMS-RYUDHWBXSA-N	304.777	4.660	5	20	DJBD	
C[C@H](Nc1cccc(CC(F)(F)F)c1)c1cccc([N+](=O)[O-])c1	179975931	ITMOHPFNPCXWGD-NSHDSACASA-N	324.302	4.873	5	20	DJBD	
O=[N+]([O-])c1ccc(N[C@@H](c2ccccc2)c2ccc(F)cc2)cc1	392150837	ZMEJEJWDFGIMOR-IBGZPJMESA-N	322.339	4.935	5	20	DJBD	
CSc1ccc(Nc2ccc3ncccc3c2[N+](=O)[O-])cc1	480420921	QHLTXJZYZPPOMV-UHFFFAOYSA-N	311.366	4.609	5	20	DJBD	
CSCc1ccc(N[C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1	538634279	QSRFZBFRVNATHK-ZDUSSCGKSA-N	316.426	4.939	5	20	DJBD	
CCC(=O)c1ccc(Oc2nc3ccccc3cc2[N+](=O)[O-])cc1	473514142	QKRUPMILHLYDEP-UHFFFAOYSA-N	322.320	4.528	5	20	DJBD	
Cc1ccc(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1C	600851950	UJXASCDTMBBGND-UHFFFAOYSA-N	324.302	4.843	5	20	DJBD	
O=[N+]([O-])c1cnc(Oc2ccc3ccccc3c2)c(Cl)c1	301296932	YHTYPZLOEXMVPS-UHFFFAOYSA-N	300.701	4.589	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N(C)Cc1cccc2[nH]ccc12	494000174	OTPYVPAZAKHCJW-AWEZNQCLSA-N	323.396	4.578	5	20	DJBD	
CCOCc1ccc(N[C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1	537451288	XBIAHTLLSPQQBY-AWEZNQCLSA-N	314.385	4.613	5	20	DJBD	
Cc1c(CN[C@@H](C)c2ccc(F)cc2Cl)cccc1[N+](=O)[O-]	183793329	IICJUXUKUBJYDK-NSHDSACASA-N	322.767	4.547	5	20	DJBD	
Cc1cc(C)cc([C@@H](C)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1	531719734	IDYMKYKRUSMIGM-HZPDHXFCSA-N	312.413	4.932	5	20	DJBD	
Cc1cc([C@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2C)c(C)s1	122852741	MMVRYYSCLNTNHN-OLZOCXBDSA-N	318.442	4.993	5	20	DJBD	
O=[N+]([O-])c1ccc(N[C@@H](c2ccccc2)C2CC2)c2ccncc12	140360640	DGZYOWXEHISAKZ-IBGZPJMESA-N	319.364	4.706	5	20	DJBD	
CCC[C@H](N[C@@H](CC)c1ccncc1)c1cccc([N+](=O)[O-])c1	163720971	OQPZYCOPHUCYPZ-ROUUACIJSA-N	313.401	4.572	5	20	DJBD	
CC[C@H](NCc1ccc2[nH]c(C)cc2c1)c1cccc([N+](=O)[O-])c1	353818482	HTMODQHLGDFQAT-SFHVURJKSA-N	323.396	4.625	5	20	DJBD	
Cc1nc(C)c(CS[C@@H](C)c2cc([N+](=O)[O-])ccc2C)s1	486170615	LLCTUJWULYTFMT-NSHDSACASA-N	322.455	4.971	5	20	DJBD	
CSc1ccc(Cl)c(NCc2ccc(C)c([N+](=O)[O-])c2)c1	864040148	AEYCSSDNJAFMHA-UHFFFAOYSA-N	322.817	4.891	5	20	DJBD	
O=[N+]([O-])c1ccc2sc(/C=C/c3ccc(F)cc3F)nc2c1	69130209	ALPPAASKDRKRTB-QHHAFSJGSA-N	318.304	4.653	5	20	DJBD	
Cc1ccc(NCc2ccc(Cl)c([N+](=O)[O-])c2)cc1Cl	107789662	YQEUQJOGPOJWCR-UHFFFAOYSA-N	311.168	4.822	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H](C)c2ccc(F)c(F)c2)cc1[N+](=O)[O-]	192724791	DSRLSZXEYVXZMZ-NEPJUHHUSA-N	320.339	4.593	5	20	DJBD	
COc1ccccc1[C@@H](C)Sc1ccc(F)cc1[N+](=O)[O-]	463077100	FFWPBQNLHCBOLG-SNVBAGLBSA-N	307.346	4.596	5	20	DJBD	
Cc1ncc(CS[C@@H](C)c2cc([N+](=O)[O-])ccc2C)s1	486031561	SBNAEAFDUMKAPH-JTQLQIEISA-N	308.428	4.663	5	20	DJBD	
Cc1cc([C@H](C)N[C@H](C)c2cc([N+](=O)[O-])ccc2C)c(C)s1	531943718	IDKYCIJQCYMOMZ-OLZOCXBDSA-N	318.442	4.993	5	20	DJBD	
C[C@H](Nc1ccc([N+](=O)[O-])s1)c1cccc(C(F)(F)F)c1	604408814	SXCYZASNOBBRHC-QMMMGPOBSA-N	316.304	4.848	5	20	DJBD	
CC[C@H](C)Oc1ccc(N[C@@H](C)c2ccccc2[N+](=O)[O-])cc1	743473379	WGRBQRZAZOWFOY-KBPBESRZSA-N	314.385	4.945	5	20	DJBD	
O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNc1ccccc1F	811470024	RXGRAIHYNHPXMW-UHFFFAOYSA-N	315.131	4.653	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2cccc(Oc3ccccc3)c2)cn1	559582088	RMIGTRFEBFUDMT-UHFFFAOYSA-N	308.293	4.574	5	20	DJBD	
CSc1ccc(C)c(NCc2ccc([N+](=O)[O-])c(Cl)c2)c1	783584811	LPYTZOIGZCHRGI-UHFFFAOYSA-N	322.817	4.891	5	20	DJBD	
Cc1ccc(N[C@@H]2CCc3c2cccc3[N+](=O)[O-])cc1Cl	863988131	ATSFBLRYPIMJGU-OAHLLOKOSA-N	302.761	4.656	5	20	DJBD	
O=C(Nc1ccccc1-c1cccs1)c1ccccc1[N+](=O)[O-]	14704877	SFUMEEXIHJYMAW-UHFFFAOYSA-N	324.361	4.576	5	20	DJBD	
C[C@@H](Nc1ccc([N+](=O)[O-])cc1)c1cccc(C(F)(F)F)c1	301242734	TUGFBBDBDTYZMF-SNVBAGLBSA-N	310.275	4.787	5	20	DJBD	
COc1cc(N[C@H](C)c2cc(C)sc2C)c(F)cc1[N+](=O)[O-]	301973823	VDGGSVQHUKYSCW-SECBINFHSA-N	324.377	4.594	5	20	DJBD	
CC(C)(C)Oc1ccccc1NCc1ccc([N+](=O)[O-])cc1F	478192248	BORGEWOUIXAMFG-UHFFFAOYSA-N	318.348	4.523	5	20	DJBD	
Cc1ccccc1[C@H](NCc1ccc(C)c([N+](=O)[O-])c1)C(C)C	482159384	OTULITJGCDVRLZ-LJQANCHMSA-N	312.413	4.699	5	20	DJBD	
CC1(C)CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1	588886044	IGUOWXMWOUPZGV-UHFFFAOYSA-N	318.420	4.650	5	20	DJBD	
C[C@@H](c1ccc(F)cc1)N(C)Cc1cc([N+](=O)[O-])ccc1Cl	788464019	LYJJFBFGTIVBJO-NSHDSACASA-N	322.767	4.580	5	20	DJBD	
Cc1c(CNc2cccc(F)c2[N+](=O)[O-])oc2ccc(F)cc12	920339647	BNPNTBMNAHAMLZ-UHFFFAOYSA-N	318.279	4.540	5	20	DJBD	
CC(C)(C)OC(=O)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-]	140779191	NNIKLXVOCMLASM-UHFFFAOYSA-N	315.325	4.576	5	20	DJBD	
CC(=O)c1ccc(OCc2ccc3ccccc3c2)c([N+](=O)[O-])c1	440836889	HMZNJYGCQSSZEF-UHFFFAOYSA-N	321.332	4.530	5	20	DJBD	
O=[N+]([O-])c1ccc2c(c1)[C@@H](NC1(c3ccccc3)CCC1)CCC2	447580116	NEACQGCPSNFQED-IBGZPJMESA-N	322.408	4.641	5	20	DJBD	
Oc1nc(Cc2ccccc2Cl)nc2cc3ccccc3cc12	614115819	GSUAVLQPZUKZSV-UHFFFAOYSA-N	320.779	4.733	5	20	DJBD	
O=[N+]([O-])c1cccnc1N[C@H](c1ccc(Cl)cc1)C1CCC1	303154146	DANOYKBWPJBUGM-HNNXBMFYSA-N	317.776	4.597	5	20	DJBD	
C[C@@H](N[C@@H](CC(F)F)c1ccccc1)c1ccc([N+](=O)[O-])cc1	421875034	JMOWZMCHBXNYLX-WBMJQRKESA-N	320.339	4.642	5	20	DJBD	
C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H]1c1ccsc1	434689391	VYRFGVXJMFLYME-WFASDCNBSA-N	302.399	4.554	5	20	DJBD	
CC[C@@H](Nc1ccc2scnc2c1)c1cccc([N+](=O)[O-])c1	488493047	GBBGKTYWXUMFHP-CQSZACIVSA-N	313.382	4.768	5	20	DJBD	
Cc1cc(SCc2ccccc2[N+](=O)[O-])nc2ccccc12	25114757	UCGZGUNRXVKSIM-UHFFFAOYSA-N	310.378	4.744	5	20	DJBD	
O=[N+]([O-])c1ccc2nc(NCc3cc4ccccc4o3)ccc2c1	301095826	MQFDWXIXPJONAJ-UHFFFAOYSA-N	319.320	4.501	5	20	DJBD	
C[C@H](Nc1ccc([N+](=O)[O-])cc1)c1cccc(C(F)(F)F)c1	301242731	TUGFBBDBDTYZMF-JTQLQIEISA-N	310.275	4.787	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H](CC(F)(F)F)C(C)C)cc1[N+](=O)[O-]	437098961	YAZXBMRTBWPASX-AAEUAGOBSA-N	318.339	4.531	5	20	DJBD	
CCOc1ccccc1N[C@H](CC)c1cccc([N+](=O)[O-])c1	195548078	FSVSUNBSUJDWFW-OAHLLOKOSA-N	300.358	4.557	5	20	DJBD	
Cc1cccc([C@H](C)NCc2c(Cl)cccc2[N+](=O)[O-])c1C	494793025	IUHMLCQJBGNKGB-ZDUSSCGKSA-N	318.804	4.716	5	20	DJBD	
Cc1ccc(CS[C@H](C)c2cc([N+](=O)[O-])ccc2C)nc1	1319898948	NGOBSCDDEHSQMW-CYBMUJFWSA-N	302.399	4.601	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1CNc1cccc(Cl)c1F	50443319	PBNNYLJQGDIEOQ-UHFFFAOYSA-N	315.131	4.653	5	20	DJBD	
Cc1ccc(CNc2ccccc2C(C)(F)F)cc1[N+](=O)[O-]	449476690	VWVDFOPMCMMSAV-UHFFFAOYSA-N	306.312	4.627	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](C)c1c(F)cccc1F	492727974	LZROMRSMSPZYOA-NEPJUHHUSA-N	320.339	4.593	5	20	DJBD	
CCCn1c(-c2csc([N+](=O)[O-])c2)nc2cc(Cl)ccc21	513859163	INGZDNXKNWEIJS-UHFFFAOYSA-N	321.789	4.736	5	20	DJBD	
CC(C)c1ccc(CN[C@@H](C)Cc2cccs2)cc1[N+](=O)[O-]	603586032	CIUMEDBSDNCMJQ-ZDUSSCGKSA-N	318.442	4.501	5	20	DJBD	
Cc1cc(C)cc([C@@H](C)NCc2ccc([N+](=O)[O-])c(Cl)c2)c1	761520278	OKFCUBOCMJSTHI-CYBMUJFWSA-N	318.804	4.716	5	20	DJBD	
Cc1ccc(OCc2ccccc2C(F)(F)F)c([N+](=O)[O-])c1	60706545	JFFCYDISRDCOEN-UHFFFAOYSA-N	311.259	4.501	5	20	DJBD	
CC(C)n1ncc2ccc(N[C@H](C)c3ccc([N+](=O)[O-])cc3)cc21	183006685	UKYBDQUTXYNPFO-CYBMUJFWSA-N	324.384	4.699	5	20	DJBD	
CC[C@H](NCc1ccc([C@H]2C[C@H]2C)o1)c1cccc([N+](=O)[O-])c1	246404111	GFHXVOJHUWZQIO-DQYPLSBCSA-N	314.385	4.552	5	20	DJBD	
COc1ccccc1[C@H](C)Sc1ccc([N+](=O)[O-])cc1F	463066958	BYYKIEIFUBRGGD-JTQLQIEISA-N	307.346	4.596	5	20	DJBD	
CC(C)(C)Nc1ccccc1NCc1ccc([N+](=O)[O-])cc1F	798500671	VTNHLTPCNNLBHV-UHFFFAOYSA-N	317.364	4.556	5	20	DJBD	
C/C(=C\c1cccc([N+](=O)[O-])c1)CN[C@H]1C[C@H](c2ccccc2)C1	435780577	WQGMPECMNMEBBD-NZEICVAKSA-N	322.408	4.534	5	20	DJBD	
CCCCOc1cccc(N[C@H](C)c2ccccc2[N+](=O)[O-])c1	439561445	HZQIFIYORILJAK-CQSZACIVSA-N	314.385	4.947	5	20	DJBD	
C[C@H](SCc1ccc([N+](=O)[O-])cc1)c1ccc(F)c(F)c1	572024788	BRTYQPFGQZLKFM-JTQLQIEISA-N	309.337	4.867	5	20	DJBD	
C[C@H](Nc1ccc([N+](=O)[O-])cc1)c1cc2cccc(F)c2o1	473917655	HHVPTELIMZGUBI-JTQLQIEISA-N	300.289	4.653	5	20	DJBD	
C[C@H](N[C@H](C)c1ccc(Cl)c(F)c1)c1ccc([N+](=O)[O-])cc1	569559556	SDIDRQLAALRRSP-WDEREUQCSA-N	322.767	4.799	5	20	DJBD	
Cc1ccc2[nH]c(CN[C@@H](C)c3ccc([N+](=O)[O-])cc3)cc2c1C	449346612	BQGCZTXCNOKXFJ-AWEZNQCLSA-N	323.396	4.544	5	20	DJBD	
CC[C@H](N[C@H](c1cccs1)C1CC1)c1cccc([N+](=O)[O-])c1	480238163	ASJVMWZJCMGWLD-RDJZCZTQSA-N	316.426	4.848	5	20	DJBD	
CCSc1ccccc1[C@@H](C)NCc1ccccc1[N+](=O)[O-]	89511936	UUJBNFSUDUGJHP-CYBMUJFWSA-N	316.426	4.558	5	20	DJBD	
Cc1ccc([C@H](N[C@H](C)c2cccc([N+](=O)[O-])c2)C2CC2)cc1	390962633	LIAOCCMNOGMDQS-KUHUBIRLSA-N	310.397	4.705	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1c(C)oc2ccccc12	546649343	MQLCDPLOLMFNKQ-ZDUSSCGKSA-N	324.380	4.809	5	20	DJBD	
CC(C)c1ccc(C(C)(C)NCc2cccc([N+](=O)[O-])c2)cc1	609223742	UATIBHBNNFSHAH-UHFFFAOYSA-N	312.413	4.743	5	20	DJBD	
CC(C)c1nc([C@H](C)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)cs1	90049654	ODENTRZXKGUZOJ-RYUDHWBXSA-N	319.430	4.587	5	20	DJBD	
CCc1ccc(C(=O)Nc2ccccc2C(C)C)cc1[N+](=O)[O-]	471278491	PERDXVAVSPHCMK-UHFFFAOYSA-N	312.369	4.533	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)Sc1ncc(C(C)C)n1C	484692676	COSYFFABUXENLV-GFCCVEGCSA-N	319.430	4.613	5	20	DJBD	
C[C@H](Nc1ccc([N+](=O)[O-])s1)c1ccccc1C(F)(F)F	742414004	SEXYSVQMTPQTJB-QMMMGPOBSA-N	316.304	4.848	5	20	DJBD	
C[C@H](Nc1ccsc1[N+](=O)[O-])c1ccccc1C(F)(F)F	742414298	ZTTIMKYONDWEMP-QMMMGPOBSA-N	316.304	4.848	5	20	DJBD	
Cc1cc([C@@H](C)N[C@H](C)c2ccccc2[N+](=O)[O-])c(C)s1	37122943	XUCNQSUNQCPGOM-VXGBXAGGSA-N	304.415	4.685	5	20	DJBD	
CC[C@@H](NCc1ccc(Cl)cc1[N+](=O)[O-])c1cccs1	50443829	KAZITNIIUKVELR-GFCCVEGCSA-N	310.806	4.551	5	20	DJBD	
CC(C)c1ccc2c(c1)[C@H](NCc1csc([N+](=O)[O-])c1)CC2	189617594	JTNWYBONZPJGRJ-MRXNPFEDSA-N	316.426	4.557	5	20	DJBD	
CSc1ccc(N[C@H](C)c2cccc([N+](=O)[O-])c2C)cc1	538498500	GRBMCAQDCQTORV-GFCCVEGCSA-N	302.399	4.798	5	20	DJBD	
C[C@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1	37177030	PFUZRNXFGFEABS-NWDGAFQWSA-N	304.777	4.660	5	20	DJBD	
Cc1ccc(CNc2ccc(Cl)c(Cl)c2)cc1[N+](=O)[O-]	37200366	IOJGWPKHHRLHSD-UHFFFAOYSA-N	311.168	4.822	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1ccc2ccccc2c1	86167632	FDHDVFBEFNIGFJ-UHFFFAOYSA-N	320.348	4.617	5	20	DJBD	
Cc1cc(N[C@@H](C)c2ncc(-c3ccccc3)o2)ccc1[N+](=O)[O-]	92656526	HKCIUFOGHHHPBI-ZDUSSCGKSA-N	323.352	4.731	5	20	DJBD	
Cc1cc(N[C@H]2CCSc3ccc(F)cc32)ccc1[N+](=O)[O-]	195663389	LHJXRDFIJODZJT-AWEZNQCLSA-N	318.373	4.691	5	20	DJBD	
Cc1cc(C)cc([C@H](C)NCc2c(Cl)cccc2[N+](=O)[O-])c1	494824188	ONHLQAKGSYXPMA-ZDUSSCGKSA-N	318.804	4.716	5	20	DJBD	
C[C@@H](N[C@H]1CCc2cc(Cl)ccc21)c1cccc([N+](=O)[O-])c1	173361391	LNDVCBZJMVVSFO-DIFFPNOSSA-N	316.788	4.586	5	20	DJBD	
O=[N+]([O-])c1cccc2c(NCc3coc4ccccc34)ccnc12	432135803	MEQYKTQSBOTWME-UHFFFAOYSA-N	319.320	4.501	5	20	DJBD	
O=[N+]([O-])c1cccc(Cl)c1CN1CCC[C@@H]1c1cccs1	494161577	HRFZFKLCDSDFIQ-CQSZACIVSA-N	322.817	4.647	5	20	DJBD	
COCCCCCOc1ccc([N+](=O)[O-])cc1-c1cccs1	513822600	FWLKDGNCRSEIJV-UHFFFAOYSA-N	321.398	4.519	5	20	DJBD	
C/C=C/c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1	516505887	MJGZOFBYQKDVEH-NSCUHMNNSA-N	316.744	4.534	5	20	DJBD	
CC(C)[C@H](NCc1cc(Cl)ccc1[N+](=O)[O-])c1ccccc1	746652317	GWPSDXSTTRSCOU-KRWDZBQOSA-N	318.804	4.735	5	20	DJBD	
CC[C@@H]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)C1	478292953	YBHBNCSXQVACNF-OAHLLOKOSA-N	318.420	4.650	5	20	DJBD	
Cc1ccc(CNc2ccccc2NC(C)(C)C)cc1[N+](=O)[O-]	798500391	NESFEXTTWNLBRR-UHFFFAOYSA-N	313.401	4.726	5	20	DJBD	
CC(C)(C)[C@@H](NCc1ccccc1[N+](=O)[O-])c1ccc(F)cc1	42800682	IZALXHKNZLNXSV-KRWDZBQOSA-N	316.376	4.611	5	20	DJBD	
Cc1cc(N[C@@H](C)c2nc(C(C)(C)C)cs2)ccc1[N+](=O)[O-]	301196261	OCGRDZFKOXFVGF-NSHDSACASA-N	319.430	4.830	5	20	DJBD	
Cc1csc(CS[C@@H](C)c2cc([N+](=O)[O-])ccc2C)n1	486077088	PRLVSBQQPZETSA-NSHDSACASA-N	308.428	4.663	5	20	DJBD	
C[C@@H](Nc1ccc(Br)cc1)c1cccc([N+](=O)[O-])c1	20090332	XILHSMJWMQXJFR-SNVBAGLBSA-N	321.174	4.530	5	20	DJBD	
Cc1ccc(Cl)c(Oc2ccc([N+](=O)[O-])c3cnccc23)c1	22801622	IYOCOQRXHFXGID-UHFFFAOYSA-N	314.728	4.897	5	20	DJBD	
CC(C)Sc1ccc([C@@H](C)Nc2ccc([N+](=O)[O-])cn2)cc1	301214740	XENSQVQGXYUMEZ-GFCCVEGCSA-N	317.414	4.663	5	20	DJBD	
CCC[C@@H](CC)NCc1ccc(-c2ccccc2[N+](=O)[O-])o1	521827655	RDQYOZXSYGNLNP-CYBMUJFWSA-N	302.374	4.523	5	20	DJBD	
O=[N+]([O-])c1cccc(F)c1Oc1cnc2ccc(Cl)cc2c1	557671981	DMOJWRAZSGQLIO-UHFFFAOYSA-N	318.691	4.728	5	20	DJBD	
CC[C@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)c1cc(F)ccc1F	90078074	CREIXQKSWLEQID-DIFFPNOSSA-N	320.339	4.675	5	20	DJBD	
C[C@@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(C2CC2)cc1	417352243	FPEYSSPLXDOZRC-ZIAGYGMSSA-N	310.397	4.884	5	20	DJBD	
CC[C@@H](Nc1cc(C)c([N+](=O)[O-])cn1)c1cccc(Cl)c1	470856711	HENSGDYXIHCAIW-CYBMUJFWSA-N	305.765	4.515	5	20	DJBD	
Cc1cccc([C@H](C)NCc2cc(Cl)ccc2[N+](=O)[O-])c1C	775437542	QEYYLMUPFJEXAC-ZDUSSCGKSA-N	318.804	4.716	5	20	DJBD	
C[C@@H](Nc1cccc(CC(F)(F)F)c1)c1ccc([N+](=O)[O-])cc1	179975911	MSBORCVHRKANNR-LLVKDONJSA-N	324.302	4.873	5	20	DJBD	
O=[N+]([O-])c1cccnc1SC(c1ccccc1)c1ccccc1	301316279	TWBAHNBCQIIACT-UHFFFAOYSA-N	322.389	4.872	5	20	DJBD	
C[C@H](c1ccco1)N(Cc1ccc([N+](=O)[O-])cc1Cl)C1CC1	541537141	KZLCNACRVSRQQH-LLVKDONJSA-N	320.776	4.567	5	20	DJBD	
CC[C@@H](NCc1ccc([N+](=O)[O-])cc1Cl)c1ccc(F)cc1	546639733	LMCMISXABSAFTG-MRXNPFEDSA-N	322.767	4.628	5	20	DJBD	
Cc1cc(N[C@@H](C)c2ccsc2)c2cccc([N+](=O)[O-])c2n1	619745823	COKMNJOWHSTYLT-NSHDSACASA-N	313.382	4.686	5	20	DJBD	
C[C@H](N[C@@H](C)c1c(F)cccc1Cl)c1cccc([N+](=O)[O-])c1	90180320	IQNVDGSVTOIGBY-QWRGUYRKSA-N	322.767	4.799	5	20	DJBD	
CC(C)COc1ccccc1N[C@H](C)c1ccccc1[N+](=O)[O-]	390969580	DSJPVQJYPHAPCL-CQSZACIVSA-N	314.385	4.803	5	20	DJBD	
Cc1ccccc1[C@H](CC(C)C)NCc1cccc([N+](=O)[O-])c1	489104844	XYCRHOHXBDGPFQ-IBGZPJMESA-N	312.413	4.780	5	20	DJBD	
C[C@@H](NCc1csc2ccccc12)c1ccc([N+](=O)[O-])cc1	536805786	KKCCTDPHSMZYDQ-GFCCVEGCSA-N	312.394	4.660	5	20	DJBD	
C[C@@H](c1cccs1)N(C)Cc1cc(Cl)ccc1[N+](=O)[O-]	746657202	CYDTULNZJMPVRY-JTQLQIEISA-N	310.806	4.503	5	20	DJBD	
CCCOc1ccccc1NCc1ccc([N+](=O)[O-])c(Cl)c1	864021480	MKYACYFUANPREY-UHFFFAOYSA-N	320.776	4.649	5	20	DJBD	
Cc1cc([C@H](C)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)o1	124888394	LQYFDMCECOWTBS-OLZOCXBDSA-N	302.374	4.525	5	20	DJBD	
CC[C@@H](CN[C@@H](C)c1cccc([N+](=O)[O-])c1C)CC(F)(F)F	414255567	FRMAZHIPBSRLAM-NWDGAFQWSA-N	318.339	4.532	5	20	DJBD	
C[C@@H](NCc1ccc([N+](=O)[O-])cc1)c1ccccc1C(C)(C)C	537992246	WUPZMBWGCJPWPF-CQSZACIVSA-N	312.413	4.743	5	20	DJBD	
CSCc1cccc(NCc2ccc(Cl)cc2[N+](=O)[O-])c1	864012183	WBFWAMNTSGFYJW-UHFFFAOYSA-N	322.817	4.723	5	20	DJBD	
Cc1ccccc1[C@@H](C)Nc1ccc([N+](=O)[O-])c2ncccc12	320591947	XCIGPYOKFOFJQW-CYBMUJFWSA-N	307.353	4.625	5	20	DJBD	
CC[C@H](N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1cccc(F)c1	525868734	BXUDNHQIGKDXIY-DYVFJYSZSA-N	316.376	4.844	5	20	DJBD	
Cc1cc(C)cc([C@H](C)NCc2ccc([N+](=O)[O-])c(Cl)c2)c1	761520279	OKFCUBOCMJSTHI-ZDUSSCGKSA-N	318.804	4.716	5	20	DJBD	
Cc1ccnc(Oc2ccc(-c3ccccc3)cc2)c1[N+](=O)[O-]	303629164	FFEJFTDYLQIQNZ-UHFFFAOYSA-N	306.321	4.758	5	20	DJBD	
C[C@H](SCc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F	609237582	FZXRSCVYLKDBHO-JTQLQIEISA-N	309.337	4.867	5	20	DJBD	
O=C(NCc1ccco1)c1c2ccccc2cc2ccccc12	746504703	PHOLWOJHEIWXLB-UHFFFAOYSA-N	301.345	4.516	5	20	DJBD	
C[C@H](Sc1c(F)cc([N+](=O)[O-])cc1F)c1cccs1	749320582	ZCMFRGABFHOUKQ-ZETCQYMHSA-N	301.339	4.788	5	20	DJBD	
O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNc1cccc(F)c1	811468571	XQRDCUCOVYVULZ-UHFFFAOYSA-N	315.131	4.653	5	20	DJBD	
CC1(CC(=O)Nc2cccc([N+](=O)[O-])c2Cl)CCCCC1	813244389	ABVYGCOWTROETE-UHFFFAOYSA-N	310.781	4.547	5	20	DJBD	
C[C@H](N[C@H](C)c1ccccc1Cl)c1ccccc1[N+](=O)[O-]	20526156	WYMAVFOHSVNVMD-NEPJUHHUSA-N	304.777	4.660	5	20	DJBD	
Cc1c(CNc2cccc(C(F)(F)F)c2)cccc1[N+](=O)[O-]	302968397	RRCLTVWPLUAUCF-UHFFFAOYSA-N	310.275	4.534	5	20	DJBD	
CC(=O)c1ccc(N[C@H](c2ccccc2)C2CCC2)c([N+](=O)[O-])c1	511455660	SXNCJVSUMBDFJW-LJQANCHMSA-N	324.380	4.751	5	20	DJBD	
CC[C@@H](N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccc(F)cc1	531205100	WRUIZTWMXOJKTK-CXAGYDPISA-N	316.376	4.844	5	20	DJBD	
Cc1cc(Cl)c([N+](=O)[O-])cc1Oc1nc2ccccc2s1	735669530	QHLDFVCBJVNRFY-UHFFFAOYSA-N	320.757	4.959	5	20	DJBD	
CCCCC[C@@H](CC)c1nnc(-c2cccc([N+](=O)[O-])c2)o1	1329246932	OIBULLUUNHRTKU-GFCCVEGCSA-N	303.362	4.719	5	20	DJBD	
CCCCCC[C@@H](C)c1nnc(-c2cccc([N+](=O)[O-])c2)o1	1345675394	VLMFYEIFVQRMRI-GFCCVEGCSA-N	303.362	4.719	5	20	DJBD	
Cc1c(Cl)cccc1NCc1ccc(Cl)cc1[N+](=O)[O-]	50443076	NOBBKOXWPQLGLJ-UHFFFAOYSA-N	311.168	4.822	5	20	DJBD	
CCCOc1ccc(Cl)cc1NCc1ccc([N+](=O)[O-])cc1	314733822	QYQFOBFEGHWCFA-UHFFFAOYSA-N	320.776	4.649	5	20	DJBD	
CC[C@@H](Nc1ncc(C)cc1[N+](=O)[O-])c1cccc(Cl)c1	463053372	LACWMTXVQWKTHX-CYBMUJFWSA-N	305.765	4.515	5	20	DJBD	
C[C@@H]1CCCCN(C(=O)c2cc3ccccc3c3cccnc23)C1	479263009	YVUUMNLZRHNPIS-OAHLLOKOSA-N	318.420	4.650	5	20	DJBD	
C[C@H](N[C@@H]1c2ccccc2CC[C@H]1C)c1cccc([N+](=O)[O-])c1	541846875	DXUSZBBZJDREQW-TYILLQQXSA-N	310.397	4.569	5	20	DJBD	
O=[N+]([O-])c1cc(C(F)F)ccc1N[C@H]1CCc2cc(F)ccc21	590573955	KUDNAKZWJLURBT-ZDUSSCGKSA-N	322.286	4.771	5	20	DJBD	
CCC[C@H](Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccn1	609585842	QOGKWSRCELKUIY-HNNXBMFYSA-N	305.765	4.597	5	20	DJBD	
C[C@H]1C[C@H](C)CN(C(=O)c2cc3ccccc3c3cccnc23)C1	642518975	OMLOOLPELCRPDF-GJZGRUSLSA-N	318.420	4.506	5	20	DJBD	
CCCC(=CC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C)CCC	770683515	DKMOIMGRNRLERN-UHFFFAOYSA-N	304.390	4.677	5	20	DJBD	
C[C@H]1CCN(C(=O)c2cc3ccccc3c3cccnc23)C[C@@H]1C	501626196	IGBJTTYPWKEXCN-GJZGRUSLSA-N	318.420	4.506	5	20	DJBD	
O=C(Nc1ccc(F)cc1)c1cc2ccccc2c2cccnc12	642517971	VHIPIFPYOVKEHU-UHFFFAOYSA-N	316.335	4.779	5	20	DJBD	
C[C@@H](SCc1cc(F)ccc1[N+](=O)[O-])c1ccc(F)cc1	745019361	NZRMFBFYVZKYET-SNVBAGLBSA-N	309.337	4.867	5	20	DJBD	
CC(C)c1ccc(NC(=S)Nc2ccc([N+](=O)[O-])cc2)cc1	13789310	BZQSZTVRXPEASP-UHFFFAOYSA-N	315.398	4.527	5	20	DJBD	
C[C@H](N[C@H]1CCc2c(Cl)cccc21)c1ccc([N+](=O)[O-])cc1	178649481	LKYHVBIAYCVJQX-GTNSWQLSSA-N	316.788	4.586	5	20	DJBD	
O=[N+]([O-])c1cccc2ccc(/C=C\c3c(F)cccc3F)nc12	213173749	LMKINNLXVJPGGS-KTKRTIGZSA-N	312.275	4.592	5	20	DJBD	
COCc1cc([N+](=O)[O-])ccc1N[C@@H](C)c1cccc(C)c1C	301478698	QLTVIPGEQTZGQK-AWEZNQCLSA-N	314.385	4.531	5	20	DJBD	
Cc1cc(N[C@@H](C)c2cccc(OC(F)F)c2)ccc1[N+](=O)[O-]	321617312	TXPGAPGEWXHKRQ-NSHDSACASA-N	322.311	4.678	5	20	DJBD	
CC(C)[C@@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(F)cc1	390483851	MEPYYFZTZORCON-SCLBCKFNSA-N	316.376	4.782	5	20	DJBD	
O=[N+]([O-])c1ccc2c(c1)[C@H](NC1(c3ccccc3)CCC1)CCC2	447580117	NEACQGCPSNFQED-LJQANCHMSA-N	322.408	4.641	5	20	DJBD	
CCOc1ccc([N+](=O)[O-])cc1NCc1ccc(C(F)F)cc1	486102691	KLOVAJXWKLQSPN-UHFFFAOYSA-N	322.311	4.543	5	20	DJBD	
Cc1ccc([C@@H](NCc2ccccc2[N+](=O)[O-])C2CCCC2)o1	539395476	YOXJYUHABFFTKT-SFHVURJKSA-N	314.385	4.517	5	20	DJBD	
CCOCc1cccc(N[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1	539651462	MDQIVYNALRHDTD-AWEZNQCLSA-N	314.385	4.613	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2cnc3ccccc3c2)c(Cl)c1	117739082	VBWSDWRFNRLTAS-UHFFFAOYSA-N	300.701	4.589	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)c1cccc(C)c1C	492934507	CDKGAIJKKMOYBC-HOTGVXAUSA-N	312.413	4.932	5	20	DJBD	
CC(=O)c1ccc(N[C@@H](c2ccccc2)C2CCC2)c([N+](=O)[O-])c1	511455659	SXNCJVSUMBDFJW-IBGZPJMESA-N	324.380	4.751	5	20	DJBD	
Cc1ccc(C)c(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1	600849407	CRUADOCLQGZOGR-UHFFFAOYSA-N	324.302	4.843	5	20	DJBD	
CCC[C@H](NC1(c2ccccc2)CC1)c1cccc([N+](=O)[O-])c1	538524448	VIEORHVDDDUOGV-SFHVURJKSA-N	310.397	4.715	5	20	DJBD	
O=[N+]([O-])c1ccccc1CSCc1nc2ccccc2s1	591008462	BEDNJGNROPVDQY-UHFFFAOYSA-N	316.407	4.638	5	20	DJBD	
COc1ccc(F)cc1[C@@H](C)Nc1ccc([N+](=O)[O-])cc1Cl	603866879	NFCSPILTRNCBGJ-SECBINFHSA-N	324.739	4.569	5	20	DJBD	
Cc1ccnc(Oc2cccc(Oc3ccccc3)c2)c1[N+](=O)[O-]	609668810	QDVMVVDJSTWWOL-UHFFFAOYSA-N	322.320	4.883	5	20	DJBD	
O=[N+]([O-])c1ccc(/C=C(\Cl)c2nc3ccccc3s2)cc1	7907681	KLUSPCHPPJFGPO-XFXZXTDPSA-N	316.769	4.941	5	20	DJBD	
CC[C@@H](N[C@H](c1ccccc1)C1CC1)c1cccc([N+](=O)[O-])c1	195614325	WNTYHWOGRVJMSH-RTBURBONSA-N	310.397	4.787	5	20	DJBD	
C[C@H](NCc1ccc(C(C)(F)F)cc1)c1ccc([N+](=O)[O-])cc1	293860843	YZXPVHRVXIQBPM-LBPRGKRZSA-N	320.339	4.557	5	20	DJBD	
Cc1cccc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)c1C	438961677	QCGXDGHETQIDGK-UHFFFAOYSA-N	312.369	4.587	5	20	DJBD	
CO[C@@H](CS[C@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1	583765644	AVWUNZOGBXLBDD-DYVFJYSZSA-N	317.410	4.777	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(N[C@H](C)c2ncc(-c3ccccc3)o2)c1	301558375	JLFGNUWQPZFROK-CYBMUJFWSA-N	323.352	4.731	5	20	DJBD	
Cc1ccc2cccc(N[C@H](C)c3cccc([N+](=O)[O-])c3)c2n1	320437969	BRSKMGCVWAMZSA-CYBMUJFWSA-N	307.353	4.625	5	20	DJBD	
CCc1oc2ccccc2c1CNCc1cccc([N+](=O)[O-])c1C	392557134	CRBNNRUSQMVZBO-UHFFFAOYSA-N	324.380	4.502	5	20	DJBD	
O=[N+]([O-])c1ccc2sc(-c3nc(C4CCCC4)no3)cc2c1	521026218	CXBUNWQCLLXKDU-UHFFFAOYSA-N	315.354	4.517	5	20	DJBD	
CC[C@@H](NCc1csc([N+](=O)[O-])c1)c1cc(C)ccc1C	599006467	IQILJQPUEFOHDA-OAHLLOKOSA-N	304.415	4.514	5	20	DJBD	
CCC[C@@H](C)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1	608834814	MHEIEJAXXPRUQR-GFCCVEGCSA-N	304.415	4.602	5	20	DJBD	
CCCOc1ccc(NCc2cccc([N+](=O)[O-])c2C)c(C)c1	864007323	VPJAXRQJTDYZJG-UHFFFAOYSA-N	314.385	4.613	5	20	DJBD	
CCCCC[C@@H](Nc1ccc([N+](=O)[O-])c(C(=O)O)c1)C(C)(C)C	1776780285	NMNTULYDVQWREG-OAHLLOKOSA-N	322.405	4.700	5	20	DJBD	
CCCCCN(C(=O)c1ccc(C)c([N+](=O)[O-])c1)[C@@H](C)CCC	60084073	XWUXQPAUVFWEQW-HNNXBMFYSA-N	320.433	4.724	5	20	DJBD	
Cc1ccc2c(c1)[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)CCC2	488005228	IQROXICVPKTBQN-LIRRHRJNSA-N	310.397	4.631	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1CCCc2sccc21	545235846	PYWXCECEIUBMRL-LRDDRELGSA-N	316.426	4.693	5	20	DJBD	
Cc1cc(N[C@@H](C)c2csc3ccccc23)ncc1[N+](=O)[O-]	746388624	HFPSMYNSTMTXOF-NSHDSACASA-N	313.382	4.686	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)Nc1ccc(OC(F)F)cc1	776802520	PAIDGTPWBKPWJY-LLVKDONJSA-N	322.311	4.678	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1	447530088	LYIGDHJNZRFGKU-IFXJQAMLSA-N	310.397	4.631	5	20	DJBD	
Cc1cc([C@@H](C)N[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c(C)s1	531943719	IDKYCIJQCYMOMZ-QWHCGFSZSA-N	318.442	4.993	5	20	DJBD	
CC[C@H](N[C@H]1CCc2cc(C)ccc21)c1cccc([N+](=O)[O-])c1	540139254	PJKVHUSZYPALJZ-OALUTQOASA-N	310.397	4.631	5	20	DJBD	
CC(=O)c1cc(N[C@H](C)c2ccccc2Cl)ccc1[N+](=O)[O-]	557682002	IISCKLAHDXCOLR-SNVBAGLBSA-N	318.760	4.624	5	20	DJBD	
CC[C@H](O)CCCNCc1c2ccccc2cc2ccccc12	742373901	UTHYDUFUTMOESM-SFHVURJKSA-N	307.437	4.634	5	20	DJBD	
CCCC[C@@H](CCC)CNc1cc(C)c([N+](=O)[O-])cc1C(=O)O	1776771960	GGUDBVBCFSXONW-CYBMUJFWSA-N	322.405	4.620	5	20	DJBD	
C[C@H](NCc1cccc2ccccc12)c1cccc([N+](=O)[O-])c1	237502822	JQPJAMHSVRWXTC-AWEZNQCLSA-N	306.365	4.599	5	20	DJBD	
Cc1cccc(C(C)(C)NCc2ccc(Cl)cc2[N+](=O)[O-])c1	539314260	HREMQZVNYGRVFS-UHFFFAOYSA-N	318.804	4.582	5	20	DJBD	
Cc1cccc(C)c1[C@H](C)N[C@H](C)c1cccc([N+](=O)[O-])c1C	544898932	YLOKIVCECNERBS-CVEARBPZSA-N	312.413	4.932	5	20	DJBD	
O=C(C[C@@H]1C=CCC1)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-]	920329692	NSHOFXLMAILMEF-CQSZACIVSA-N	323.348	4.524	5	20	DJBD	
Cc1c([C@H](C)N[C@H](C)c2ccc(F)cc2F)cccc1[N+](=O)[O-]	153561043	JZKOEJXREWULGI-NWDGAFQWSA-N	320.339	4.593	5	20	DJBD	
Cc1ccc(Oc2ccc([N+](=O)[O-])c3cnccc23)c(Cl)c1	524845056	RDLAUTMKUDUQEU-UHFFFAOYSA-N	314.728	4.897	5	20	DJBD	
Cc1c(CN[C@H](c2ccccc2)C2CCCC2)cccc1[N+](=O)[O-]	731845593	FMSJDHFZXIBTMI-HXUWFJFHSA-N	324.424	4.924	5	20	DJBD	
C[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1	20545598	KRNGZNCKUMEFER-RYUDHWBXSA-N	304.777	4.660	5	20	DJBD	
CCCCc1nc(CSCc2ccc([N+](=O)[O-])cc2)cs1	517939220	CORDUKFTVDICQI-UHFFFAOYSA-N	322.455	4.827	5	20	DJBD	
Cc1cccc(C)c1[C@H](C)NCc1ccc([N+](=O)[O-])cc1Cl	545518778	WIZAMTYCVJCLAC-ZDUSSCGKSA-N	318.804	4.716	5	20	DJBD	
Cc1cc(N[C@H](C)c2ccsc2)c2cccc([N+](=O)[O-])c2n1	619745822	COKMNJOWHSTYLT-LLVKDONJSA-N	313.382	4.686	5	20	DJBD	
COc1ccc(SCc2cc(Cl)ccc2[N+](=O)[O-])cc1	746389310	MYPWBVRJIGJNEM-UHFFFAOYSA-N	309.774	4.549	5	20	DJBD	
C[C@@H](Nc1cccc(Br)c1)c1ccc([N+](=O)[O-])cc1	37176944	RESXQFCCTPBPPE-SNVBAGLBSA-N	321.174	4.530	5	20	DJBD	
Cc1c(CN2CCCCC[C@@H]2c2ccco2)cccc1[N+](=O)[O-]	78830407	DEVIUJWGUDTUHD-QGZVFWFLSA-N	314.385	4.614	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1ccc(C(C)C)cc1	86167570	PYNLUMGMBCWTQO-UHFFFAOYSA-N	312.369	4.587	5	20	DJBD	
CC[C@H](NCc1c(Cl)cccc1[N+](=O)[O-])c1ccc(C)cc1	494798455	YZYDNTBJOUMMFI-INIZCTEOSA-N	318.804	4.798	5	20	DJBD	
CSCc1cccc(N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1	537532617	AHKVXODAADFSAJ-CYBMUJFWSA-N	316.426	4.939	5	20	DJBD	
C[C@H](SCc1nc2ccc([N+](=O)[O-])cc2[nH]1)c1cccs1	788814189	YRDOJUXHEGVOJO-VIFPVBQESA-N	319.411	4.527	5	20	DJBD	
Cc1cc(F)ccc1[C@@H](C)NCc1cc([N+](=O)[O-])ccc1Cl	815596008	IDPSDKKMTPSSJV-LLVKDONJSA-N	322.767	4.547	5	20	DJBD	
Cc1ccc(CNc2ccc3oc(C4CC4)nc3c2)cc1[N+](=O)[O-]	124518509	FTXMNMYSACYXKF-UHFFFAOYSA-N	323.352	4.534	5	20	DJBD	
CC(C)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1	152534492	SGTKMXYYHGWPFX-UHFFFAOYSA-N	318.760	4.624	5	20	DJBD	
Cc1ccc2c(c1)[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)CCC2	426292693	OYWSIKYOLAGXKY-AUUYWEPGSA-N	310.397	4.631	5	20	DJBD	
CSCc1cccc(N[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1	539734499	PKOJYTAFMYLYJY-LBPRGKRZSA-N	302.399	4.631	5	20	DJBD	
CCC[C@H](C)NCc1ccc(-c2ccccc2[N+](=O)[O-])s1	608834983	YZDUBEWEPBIECT-LBPRGKRZSA-N	304.415	4.602	5	20	DJBD	
CCCCCN(C(=O)c1ccc([N+](=O)[O-])c(C)c1)[C@H](C)CCC	63327329	OBCHXGYFSFEGRR-OAHLLOKOSA-N	320.433	4.724	5	20	DJBD	
CCCCN(Cc1ccccc1[N+](=O)[O-])[C@H](C)c1ccc(C)o1	604493670	XJJVZRAISFIYJT-OAHLLOKOSA-N	316.401	4.860	5	20	DJBD	
CCC(CC)CN(CC)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C	85634835	XQHXJGGDGLDEER-UHFFFAOYSA-N	321.421	4.502	5	20	DJBD	
O=[N+]([O-])c1cccc(CNc2ccccc2-c2ccccc2)c1	302834989	YPIPFXRDBSDJMR-UHFFFAOYSA-N	304.349	4.874	5	20	DJBD	
Cc1nc(CS[C@H](C)c2cc([N+](=O)[O-])ccc2C)cs1	486050210	GVQBEFMTBKXADE-SNVBAGLBSA-N	308.428	4.663	5	20	DJBD	
Cc1ccccc1[C@@H](N[C@H](C)c1ccccc1[N+](=O)[O-])C1CC1	537290852	LTXRNXVKFFJKSW-KUHUBIRLSA-N	310.397	4.705	5	20	DJBD	
Cc1cc(N[C@@H](C)c2cnn(C(C)C)c2)c(Cl)cc1[N+](=O)[O-]	747220799	PMALNYINJYWGCA-NSHDSACASA-N	322.796	4.507	5	20	DJBD	
CC[C@H](NCc1cc([N+](=O)[O-])ccc1Cl)c1ccc(F)cc1	748820432	JQSUGPNIZVEDDK-INIZCTEOSA-N	322.767	4.628	5	20	DJBD	
CCCCC[C@H](Nc1ccc([N+](=O)[O-])c(C(=O)O)c1)C(C)(C)C	1776780284	NMNTULYDVQWREG-HNNXBMFYSA-N	322.405	4.700	5	20	DJBD	
CCSc1ccccc1[C@@H](C)NCc1ccc([N+](=O)[O-])cc1	89513224	SZURTIVXPZGTRF-CYBMUJFWSA-N	316.426	4.558	5	20	DJBD	
O=[N+]([O-])c1c(F)cccc1N[C@@H]1CCSc2ccc(F)cc21	302462655	RVAZGFIIFHNBCA-GFCCVEGCSA-N	322.336	4.522	5	20	DJBD	
CC[C@@H](Nc1ccccc1[N+](=O)[O-])c1ncc(-c2ccccc2)[nH]1	537090805	AHSLZALMIXAXNH-CQSZACIVSA-N	322.368	4.548	5	20	DJBD	
Cc1cnc(Oc2ccc3oc4ccccc4c3c2)c([N+](=O)[O-])c1	610283786	AUXHTKLBDJFXGU-UHFFFAOYSA-N	320.304	4.990	5	20	DJBD	
Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)C[C@H](C)CC(C)C	736158234	KBSDTLHAILHIQD-SNVBAGLBSA-N	312.797	4.567	5	20	DJBD	
CSc1cc(C)ccc1NCc1cccc([N+](=O)[O-])c1C	864031385	XMBVONBMDMYIIT-UHFFFAOYSA-N	302.399	4.546	5	20	DJBD	
C[C@@H](Nc1ccc(Br)cc1)c1ccc([N+](=O)[O-])cc1	37176942	PHOWQDHCSJGUBF-SNVBAGLBSA-N	321.174	4.530	5	20	DJBD	
Cc1ccc([C@@H](C)Nc2ccc([N+](=O)[O-])c3cnccc23)cc1	301089855	MSTSSSOXBCWNGF-CYBMUJFWSA-N	307.353	4.625	5	20	DJBD	
Cc1ccc([C@@H]2CCCN2[C@@H](C)c2ccccc2[N+](=O)[O-])s1	444159060	KQOPXYKBSWIRAU-BBRMVZONSA-N	316.426	4.863	5	20	DJBD	
C[C@@H](N[C@H]1CCc2ccc(Cl)cc21)c1cccc([N+](=O)[O-])c1	479254708	WEMLWZZRLYOGRC-DIFFPNOSSA-N	316.788	4.586	5	20	DJBD	
Cc1ccc([C@@H](C)N(C)Cc2c(F)cccc2[N+](=O)[O-])c(C)c1	505913402	SUTMLXFBEOXOEK-CQSZACIVSA-N	316.376	4.544	5	20	DJBD	
CC[C@@H](Nc1ccc([N+](=O)[O-])cc1F)c1ccc(F)cc1F	523084816	UMOLKQWQSKGLLG-CQSZACIVSA-N	310.275	4.575	5	20	DJBD	
CC(=O)c1ccc(N[C@@H]2CCC[C@H]2c2ccccc2)c([N+](=O)[O-])c1	609514010	POUVAIUQHARPEY-DLBZAZTESA-N	324.380	4.546	5	20	DJBD	
Cc1cccc(/C=C(\Cl)c2nc3cc([N+](=O)[O-])ccc3o2)c1	751517833	OJLUUDRZMGUQHG-JYRVWZFOSA-N	314.728	4.781	5	20	DJBD	
Cc1cc(F)ccc1[C@@H](C)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1	815595016	FVFHYWQAMFCNLB-ZIAGYGMSSA-N	316.376	4.763	5	20	DJBD	
C[C@@H](SCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cccs1	789921564	LSCVZXUZFRYYMW-SECBINFHSA-N	324.383	4.559	5	20	DJBD	
C[C@@H](SCc1ccc([N+](=O)[O-])cc1)c1nc2ccccc2o1	182386962	UBXICJTZUQIGFU-LLVKDONJSA-N	314.366	4.730	5	20	DJBD	
C/C(=C/c1cccc([N+](=O)[O-])c1)CNC1CC(c2ccccc2)C1	466415905	WQGMPECMNMEBBD-GDNBJRDFSA-N	322.408	4.534	5	20	DJBD	
CC[C@H](Nc1cc(C)c([N+](=O)[O-])cc1F)c1ccccc1OC	864001924	UZVZKQOOPUYLNU-AWEZNQCLSA-N	318.348	4.614	5	20	DJBD	
O=C(O[C@H]1CCCCC1=O)c1c2ccccc2cc2ccccc12	3376943	WVNAPOMJIUOVRP-IBGZPJMESA-N	318.372	4.662	5	20	DJBD	
Cc1cc([C@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c(C)s1	37122801	IRDOZOTWNXUFER-RYUDHWBXSA-N	304.415	4.685	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)c(N[C@H]2CCC(F)(F)C2)c(Cl)c1	311825361	FJEDOHLVCKLSKU-LURJTMIESA-N	311.115	4.501	5	20	DJBD	
CCC[C@@H](NCc1cc(C)cs1)c1cccc([N+](=O)[O-])c1	379263514	IQPAWQMLXUGELF-MRXNPFEDSA-N	304.415	4.596	5	20	DJBD	
CC[C@@H](C)Oc1cccc(NCc2ccc([N+](=O)[O-])cc2F)c1	391940895	OFGZYRVTRICQFP-GFCCVEGCSA-N	318.348	4.523	5	20	DJBD	
CSc1ccccc1[C@H](C)N[C@H](C)c1ccccc1[N+](=O)[O-]	440614962	BIVYROLSAFDUDA-OLZOCXBDSA-N	316.426	4.729	5	20	DJBD	
O=[N+]([O-])c1ccccc1N1CCC[C@H]1c1cccc(Cl)c1	515551159	BFPDSJMKUZQSPS-AWEZNQCLSA-N	302.761	4.590	5	20	DJBD	
CCCCCN(CCCCC)C(=O)c1cc(F)cc([N+](=O)[O-])c1	521336739	XIXKYZLOHVINGP-UHFFFAOYSA-N	324.396	4.557	5	20	DJBD	
c1ccc(-c2nnc(-c3cc4ccccc4c4cccnc34)o2)nc1	1325864213	VDAVTJAAYJWXSC-UHFFFAOYSA-N	324.343	4.500	5	20	DJBD	
CCCCCC[C@H](C)c1nnc(-c2cccc([N+](=O)[O-])c2)o1	1345675397	VLMFYEIFVQRMRI-LBPRGKRZSA-N	303.362	4.719	5	20	DJBD	
C[C@H](NCc1ccccc1[N+](=O)[O-])c1ccc2ccccc2c1	194757731	XGGHFPMCHPPWFV-AWEZNQCLSA-N	306.365	4.599	5	20	DJBD	
C[C@H](N[C@H](c1ccccc1)C1CCC1)c1ccc([N+](=O)[O-])cc1	482448960	GXYLFTAHJIBTRK-IFXJQAMLSA-N	310.397	4.787	5	20	DJBD	
CC(C)(C)[C@H](NCc1c(F)cccc1[N+](=O)[O-])c1ccccc1	505891260	IVWJZZVGMJIGJY-QGZVFWFLSA-N	316.376	4.611	5	20	DJBD	
Cc1c([C@@H](C)Nc2cccc3ccncc23)cccc1[N+](=O)[O-]	539727088	CFYOEMKGWBHYHQ-CYBMUJFWSA-N	307.353	4.625	5	20	DJBD	
CCC[C@@H](C)N(C)C(=O)c1cc2ccccc2c2cccnc12	78898427	BZNHEGYCIPGWTO-CQSZACIVSA-N	306.409	4.649	5	20	DJBD	
Cc1ccc([C@H](C)NCc2c(Cl)cccc2[N+](=O)[O-])cc1F	120895785	BQLODQCKTPFSOT-NSHDSACASA-N	322.767	4.547	5	20	DJBD	
O=[N+]([O-])c1ccc(N[C@@H]2CC[C@@H]3CCC[C@H]3C2)c2ccncc12	462904420	UQOOPYLPDBIUIQ-MELADBBJSA-N	311.385	4.524	5	20	DJBD	
CC(C)OCc1ccc(N[C@@H](C)c2ccccc2[N+](=O)[O-])cc1	610341415	LPMNGBJNSPCLMA-AWEZNQCLSA-N	314.385	4.693	5	20	DJBD	
CCC[C@@H](N[C@H](CC)c1cccc([N+](=O)[O-])c1)c1ccccn1	610810438	JPWNRCBREKZEGB-SJLPKXTDSA-N	313.401	4.572	5	20	DJBD	
CCC(CC)[C@@H](NCc1csc([N+](=O)[O-])c1)c1ccccc1	236683548	FFZKAEZRFDBTJC-QGZVFWFLSA-N	318.442	4.923	5	20	DJBD	
CSCc1ccc(N[C@H](C)c2cccc([N+](=O)[O-])c2C)cc1	538634278	QSRFZBFRVNATHK-CYBMUJFWSA-N	316.426	4.939	5	20	DJBD	
C[C@H](Nc1ccc(Br)cc1[N+](=O)[O-])c1ccccc1	21506172	QIDGGPOHUFHUNZ-JTQLQIEISA-N	321.174	4.530	5	20	DJBD	
C[C@@H](c1cccs1)N(C)Cc1cc([N+](=O)[O-])ccc1Cl	49726665	YOJWWFRGBPSJGG-JTQLQIEISA-N	310.806	4.503	5	20	DJBD	
CC(=O)c1ccc(NCc2ccc3ccccc3c2)c([N+](=O)[O-])c1	301130728	UGVZLUIDQVBRSZ-UHFFFAOYSA-N	320.348	4.563	5	20	DJBD	
CSc1ccccc1[C@H](C)Nc1ncc([N+](=O)[O-])cc1Cl	440645625	GGNPISITIDEROP-VIFPVBQESA-N	323.805	4.538	5	20	DJBD	
O=[N+]([O-])c1cc2ccccc2nc1Oc1cccc(Cl)c1	473507809	LWLAQJBXFLCWKB-UHFFFAOYSA-N	300.701	4.589	5	20	DJBD	
O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H]2CC=CCC2)s1	609902333	UBGAEJITQRACID-CYBMUJFWSA-N	314.410	4.522	5	20	DJBD	
COc1ccc(/C=C(/C)c2ccc3ccccc3n2)cc1[N+](=O)[O-]	1325205368	QQYHACSQQXMKPG-QBFSEMIESA-N	320.348	4.712	5	20	DJBD	
C[C@H](N[C@H](C)c1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1	37177031	PFUZRNXFGFEABS-NEPJUHHUSA-N	304.777	4.660	5	20	DJBD	
C[C@H](Nc1ccc([N+](=O)[O-])s1)c1nc(C(C)(C)C)cs1	1319389568	UXEONSIYSGWPRV-QMMMGPOBSA-N	311.432	4.583	5	20	DJBD	
O=[N+]([O-])c1ccc(-c2nc(-c3ccccc3F)cs2)cc1	71971771	SBFIESNHUICNSG-UHFFFAOYSA-N	300.314	4.524	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)c1ccccc1Cl	487947922	NJDZENKIXOEGSK-OLZOCXBDSA-N	318.804	4.968	5	20	DJBD	
Cc1cc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2C)ccc1Cl	541767987	BADLDIXYCBHVRA-CYBMUJFWSA-N	318.804	4.716	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2cc(Cl)c(Cl)cc2Cl)cn1	550327568	DNJPCBVWIFAOLC-UHFFFAOYSA-N	319.531	4.742	5	20	DJBD	
CC[C@H](C)n1ncc(N[C@H](C)c2cc([N+](=O)[O-])ccc2C)c1C	564773009	GIVGTUKROUMDFH-QWHCGFSZSA-N	316.405	4.552	5	20	DJBD	
C[C@H](Nc1ccc(OCC2CC2)cc1)c1ccccc1[N+](=O)[O-]	743476391	ASSOMPQLHQSXFW-ZDUSSCGKSA-N	312.369	4.557	5	20	DJBD	
C[C@@H](Oc1ccc([N+](=O)[O-])c(Cl)c1)c1ncc(C(C)(C)C)o1	756864802	ZTOASZFRGPDQPJ-SECBINFHSA-N	324.764	4.674	5	20	DJBD	
O=[N+]([O-])c1ccc(CSc2nc3cc(Cl)ccc3o2)cc1	60382864	JTMGQHVDBFHGNJ-UHFFFAOYSA-N	320.757	4.682	5	20	DJBD	
CCC[C@H](NCc1ccc(CC)s1)c1cccc([N+](=O)[O-])c1	319142466	UOLGWPBYBRLJDD-KRWDZBQOSA-N	318.442	4.850	5	20	DJBD	
COCCCC[C@@H](Nc1ccccc1[N+](=O)[O-])c1ccccc1	480557762	XEDRTCDSBSSIHO-MRXNPFEDSA-N	314.385	4.565	5	20	DJBD	
O=[N+]([O-])c1c(NCc2coc3ccccc23)ccc2ncccc12	485078938	NQTJKNWPJSZHNX-UHFFFAOYSA-N	319.320	4.501	5	20	DJBD	
C[C@H](SCc1ccccc1[N+](=O)[O-])c1cc(F)ccc1F	517939419	MKFPERYMVCQDOK-JTQLQIEISA-N	309.337	4.867	5	20	DJBD	
CC(C)N(C/C=C/c1ccccc1)Cc1ccc([N+](=O)[O-])cc1	518565192	JFEHGPJPFFSHNW-RMKNXTFCSA-N	310.397	4.519	5	20	DJBD	
C[C@H]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)[C@@H]1C	525548791	HPVDMCDMVYEPCE-LSDHHAIUSA-N	318.420	4.649	5	20	DJBD	
CC(C)c1ocnc1CS[C@H](C)c1ccccc1[N+](=O)[O-]	1116452417	LLIGBZSDQZEEBA-LLVKDONJSA-N	306.387	4.701	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1OCc1ccc(Cl)s1	104837418	NRGJIBIUDNQBLZ-UHFFFAOYSA-N	304.154	4.542	5	20	DJBD	
C[C@H](NCc1ccc(C2CCC2)cc1)c1ccc([N+](=O)[O-])cc1	492433108	AHHCPOZURIFPJX-AWEZNQCLSA-N	310.397	4.713	5	20	DJBD	
C[C@H](Nc1ccccc1OCC1CC1)c1ccccc1[N+](=O)[O-]	525720338	XAFPWTUZWNJGGD-ZDUSSCGKSA-N	312.369	4.557	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)c(CN[C@@H](c2cccs2)C2CC2)c1	748815982	MLYLMHIBIIUYRR-OAHLLOKOSA-N	322.817	4.551	5	20	DJBD	
Cc1ccc(CNc2ccc3c4c(cccc24)CC3)cc1[N+](=O)[O-]	864000594	VRICSTCZONEISF-UHFFFAOYSA-N	318.376	4.767	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H](C)c2ccc(F)cc2F)cc1[N+](=O)[O-]	78970832	VHPPAMYMPXZVLE-NWDGAFQWSA-N	320.339	4.593	5	20	DJBD	
Cc1ccc([C@H](C)NCCc2ccc(Cl)s2)cc1[N+](=O)[O-]	222845650	PUTLTQMKRUAQAT-NSHDSACASA-N	324.833	4.511	5	20	DJBD	
Cc1cc(NCc2ccccc2C(F)(F)F)ccc1[N+](=O)[O-]	314716375	UCOAQUTYMAIZGG-UHFFFAOYSA-N	310.275	4.534	5	20	DJBD	
O=C(Nc1cccc(-c2cccs2)c1)c1cccc([N+](=O)[O-])c1	505849428	IWWUTALKPRUGHD-UHFFFAOYSA-N	324.361	4.576	5	20	DJBD	
CC(C)c1ccccc1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1	609852524	HHQRQQVSTPDCTP-UHFFFAOYSA-N	318.760	4.624	5	20	DJBD	
CC[C@@H](N[C@H]1CCc2ccc(C)cc21)c1cccc([N+](=O)[O-])c1	610831223	UTCYMGOCXCHZCI-MOPGFXCFSA-N	310.397	4.631	5	20	DJBD	
C[C@@H](Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1ccccc1	215858959	AGKOYVOSQATAIS-SNVBAGLBSA-N	310.275	4.787	5	20	DJBD	
Cc1c([C@@H](C)N[C@H](C)c2c(F)cccc2F)cccc1[N+](=O)[O-]	480911211	OZAVNNCNPYNGCF-VXGBXAGGSA-N	320.339	4.593	5	20	DJBD	
C[C@@H](SCc1csc(C2CC2)n1)c1ccccc1[N+](=O)[O-]	535396286	IWRKOGQKLSGEOQ-SNVBAGLBSA-N	320.439	4.923	5	20	DJBD	
O=[N+]([O-])c1cccc(F)c1Oc1ccc(-c2cscn2)cc1	587991814	AIFNDONLLSYLKB-UHFFFAOYSA-N	316.313	4.650	5	20	DJBD	
CC(C)Cc1ccccc1-c1nnc(-c2cccc([N+](=O)[O-])c2)o1	1326173092	RCYVPEFIKKRTDV-UHFFFAOYSA-N	323.352	4.510	5	20	DJBD	
Cc1cc([C@H](C)NCc2ccc(Cl)c([N+](=O)[O-])c2)c(C)s1	73649976	STNROOOGDQTQPY-JTQLQIEISA-N	324.833	4.777	5	20	DJBD	
O=[N+]([O-])c1ccc2nc(Oc3cnc4ccccc4c3)sc2c1	786071084	DKBZSQCCJYCPGU-UHFFFAOYSA-N	323.333	4.545	5	20	DJBD	
CC(C)c1cccc(NC(=S)Nc2cccc([N+](=O)[O-])c2)c1	917569265	PYAXPUOVLFDVIC-UHFFFAOYSA-N	315.398	4.527	5	20	DJBD	
Cc1cccc(NC(=O)c2cc3ccccc3c3cccnc23)c1	58184287	GGUVLBZDIKNQSM-UHFFFAOYSA-N	312.372	4.949	5	20	DJBD	
C[C@H](Nc1ccccc1[N+](=O)[O-])c1nc(C(C)(C)C)cs1	301204790	RVFINGFAPVEOPB-JTQLQIEISA-N	305.403	4.522	5	20	DJBD	
C[C@@H](Cc1ccccc1[N+](=O)[O-])Nc1cccc(C(F)F)c1	449052639	DZIYTFVCSATZSL-NSHDSACASA-N	306.312	4.576	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H](CC(F)(F)F)C(C)C	527100166	PELQPSPFYDCUHC-BXUZGUMPSA-N	318.339	4.531	5	20	DJBD	
CSCc1cccc(N[C@@H]2CCc3c2cccc3[N+](=O)[O-])c1	594504322	HYOMNVCHDBKXNW-MRXNPFEDSA-N	314.410	4.557	5	20	DJBD	
CCN(CC1CC1)C(=O)c1c2ccccc2cc2ccccc12	746522263	QSAVECQLCPSGST-UHFFFAOYSA-N	303.405	4.865	5	20	DJBD	
Cc1ccc(/C=C(\Cl)c2nc3cc([N+](=O)[O-])ccc3[nH]2)s1	7133485	WMZHIRBYWZQJMG-XFFZJAGNSA-N	319.773	4.578	5	20	DJBD	
Cc1cc([C@@H](C)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)o1	124888948	LQYFDMCECOWTBS-CHWSQXEVSA-N	302.374	4.525	5	20	DJBD	
C[C@H](NC/C=C\c1ccccc1[N+](=O)[O-])c1cc2ccccc2o1	466893132	BQLZDDFOPRYHKB-PIZKADEWSA-N	322.364	4.705	5	20	DJBD	
CCC(=O)c1ccc(Oc2ccc3cccnc3c2)c([N+](=O)[O-])c1	480562934	KCBFXEGKQZSGSS-UHFFFAOYSA-N	322.320	4.528	5	20	DJBD	
CCCCn1c(SCc2ccc([N+](=O)[O-])cc2)nc(C)c1C	591559743	WGYBIIJLOPNVQH-UHFFFAOYSA-N	319.430	4.501	5	20	DJBD	
Cc1cc(CNc2ccsc2[N+](=O)[O-])c2[nH]c(C)c(C)c2c1	609560729	FRGBFLSACRBRAW-UHFFFAOYSA-N	315.398	4.675	5	20	DJBD	
O=[N+]([O-])c1ccc(CNc2ccc(C3CC3)cc2)cc1Cl	783652699	OXKWWMKDBHPSAZ-UHFFFAOYSA-N	302.761	4.738	5	20	DJBD	
O=[N+]([O-])c1ccc(/C=C\SC2=Nc3ccccc3CS2)o1	825293402	WBHDGTQOOILTTJ-FPLPWBNLSA-N	318.379	4.826	5	20	DJBD	
c1ccc2c(c1)cc(-c1nnc(-c3ccncc3)o1)c1ncccc12	1118085825	KZVUSMXGTHRMSD-UHFFFAOYSA-N	324.343	4.500	5	20	DJBD	
Cc1cc(C)cc(NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1	302992755	JOJXXTHETIBLJX-UHFFFAOYSA-N	319.748	4.509	5	20	DJBD	
CC(C)Oc1ccc([C@H](C)Nc2ccccc2[N+](=O)[O-])cc1	315740778	NUTAISAIDOXVRU-ZDUSSCGKSA-N	300.358	4.555	5	20	DJBD	
Cc1ccc2c(c1)[C@@H](N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)CC2	540221217	VAQFWAFWVRKFIP-KSSFIOAISA-N	310.397	4.550	5	20	DJBD	
CC(C)(NCc1cccc2ccccc12)c1ccc([N+](=O)[O-])cc1	561195788	GUEBZBXFEMXQFF-UHFFFAOYSA-N	320.392	4.773	5	20	DJBD	
CC[C@@H](CC(=O)Nc1cc([N+](=O)[O-])c(Cl)cc1C)C(C)C	736159524	XCJOMJVVPZWLAS-NSHDSACASA-N	312.797	4.567	5	20	DJBD	
CCOc1cc(S[C@@H](C)c2cccs2)ccc1[N+](=O)[O-]	771218257	GJSCVKPWHIOPBG-JTQLQIEISA-N	309.412	4.908	5	20	DJBD	
O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNc1ccc(F)cc1	811467972	CYJTXWMEQGBUKN-UHFFFAOYSA-N	315.131	4.653	5	20	DJBD	
CSc1c(F)cc(NCc2ccc(C)c([N+](=O)[O-])c2)cc1F	864033801	HYALELOSPHDIBG-UHFFFAOYSA-N	324.352	4.515	5	20	DJBD	
COCCCCCNC(=O)c1c2ccccc2cc2ccccc12	1323429518	WOBJGMFPVJRRTM-UHFFFAOYSA-N	321.420	4.540	5	20	DJBD	
CC1(C)CN(Cc2c3ccccc3cc3ccccc23)CC[C@@H]1O	783728788	JKNKJZYBIMEVEP-NRFANRHFSA-N	319.448	4.586	5	20	DJBD	
Cc1c(CN[C@H](c2ccc(F)cc2)C(C)C)cccc1[N+](=O)[O-]	52035281	WSQCPSNYESHEBI-SFHVURJKSA-N	316.376	4.529	5	20	DJBD	
Cc1ccc(N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1-c1ncco1	180007700	JRTIBJFLEBVSQS-CYBMUJFWSA-N	323.352	4.731	5	20	DJBD	
Cc1c(CN[C@H](C)c2cccc3ccccc23)cccc1[N+](=O)[O-]	326367361	INNYXFSZEGNJBW-OAHLLOKOSA-N	320.392	4.907	5	20	DJBD	
CC[C@H](C)N(Cc1ccccc1)Cc1c(F)cccc1[N+](=O)[O-]	505786426	ZZYNPLTVLCQFQV-AWEZNQCLSA-N	316.376	4.535	5	20	DJBD	
CCC[C@H](C)c1noc([C@@H](C)Sc2ccc([N+](=O)[O-])cc2)n1	761842164	ITAIYJRIVVAGSK-WDEREUQCSA-N	321.402	4.735	5	20	DJBD	
Cc1noc(CS[C@@H](C)c2ccc(Cl)cc2)c1[N+](=O)[O-]	596018738	BHLOLYYKVSQRJM-VIFPVBQESA-N	312.778	4.539	5	20	DJBD	
Cc1cccc(C(C)(C)NCc2cc(Cl)ccc2[N+](=O)[O-])c1	775442885	KNXSEZLLNJWVJJ-UHFFFAOYSA-N	318.804	4.582	5	20	DJBD	
C/C(=C\c1ccc(-c2cccc([N+](=O)[O-])c2)s1)c1ncccn1	821017956	UAOVVOGTAVIJCS-ZRDIBKRKSA-N	323.377	4.674	5	20	DJBD	
C[C@H](N[C@@H](C)c1csc(Cl)c1)c1cccc([N+](=O)[O-])c1	191213810	XFBQFSRALZAHSX-UWVGGRQHSA-N	310.806	4.722	5	20	DJBD	
O=[N+]([O-])c1cccc2ccc(/C=C\c3ccc(F)cc3F)nc12	206095734	XAFFPUPHTUNYOE-YVMONPNESA-N	312.275	4.592	5	20	DJBD	
Cc1cc(C)c([C@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1C	321075735	QMTAISFRMFNCQB-CVEARBPZSA-N	312.413	4.932	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H]2C[C@H](c3ccccc3)C2)cc1[N+](=O)[O-]	436292211	MPLQOIFUPCNGOW-ZTFGCOKTSA-N	310.397	4.500	5	20	DJBD	
C[C@H](N[C@H]1CCc2ccc(Cl)cc21)c1ccc([N+](=O)[O-])cc1	451103090	MLFWIPWOZNGORA-GTNSWQLSSA-N	316.788	4.586	5	20	DJBD	
CN(C(=O)c1cc2ccccc2c2cccnc12)C1CC(C)(C)C1	458204223	JUYJGFHZENTJSO-UHFFFAOYSA-N	318.420	4.649	5	20	DJBD	
Cc1ccc2c(c1)CC[C@H]2Nc1ccc([N+](=O)[O-])c2cnccc12	511698229	NMSNTZLQXKDSOX-QGZVFWFLSA-N	319.364	4.551	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1CN1CCC[C@H]1c1ccsc1	609705194	DROQVBNMCLZKOZ-AWEZNQCLSA-N	322.817	4.647	5	20	DJBD	
Cc1cc2cc(Nc3nc4ccc([N+](=O)[O-])cc4s3)ccc2[nH]1	731209448	ZDZSSBIBBMCZAJ-UHFFFAOYSA-N	324.365	4.738	5	20	DJBD	
C[C@@H](SCc1ccccc1[N+](=O)[O-])c1c(F)cccc1F	63430931	IIILSALDITVNSJ-SNVBAGLBSA-N	309.337	4.867	5	20	DJBD	
Cc1cc(NCc2cccc(C(F)(F)F)c2)ccc1[N+](=O)[O-]	107536806	NVYQZBQHUBDIRV-UHFFFAOYSA-N	310.275	4.534	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](c1ccccc1)C1CC1	120383659	XIXSJSBINOLDHH-LIRRHRJNSA-N	310.397	4.705	5	20	DJBD	
Cc1csc([C@H](Nc2ccc(Cl)cc2[N+](=O)[O-])C2CC2)n1	301742575	FQNSTRGFROZOSL-CYBMUJFWSA-N	323.805	4.576	5	20	DJBD	
CSc1ccc([C@H](C)N[C@@H](C)c2ccccc2[N+](=O)[O-])cc1	315381510	DLPMSQMQAHNZJF-STQMWFEESA-N	316.426	4.729	5	20	DJBD	
Cc1cc(N[C@@H](C)c2ccccc2OC(F)F)ccc1[N+](=O)[O-]	390553191	KSCXDKOZXOYNAV-NSHDSACASA-N	322.311	4.678	5	20	DJBD	
O=[N+]([O-])c1ccc2c(c1)[C@@H](N[C@@H](c1ccccc1)C1CC1)CCC2	447533159	ZJDBCXZGGXAZEQ-PMACEKPBSA-N	322.408	4.713	5	20	DJBD	
Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1ccc2ccoc2c1	467897902	HIUYKBACBLZODI-UHFFFAOYSA-N	324.336	4.519	5	20	DJBD	
O=[N+]([O-])c1ccccc1CNc1cccc(OC2CCCC2)c1	475181676	IJZVKEUPVIVADN-UHFFFAOYSA-N	312.369	4.528	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1C	538020605	HCTZGVYVTBKXPO-HOTGVXAUSA-N	312.413	4.932	5	20	DJBD	
Cc1ccccc1C(C)(C)NCc1c(Cl)cccc1[N+](=O)[O-]	550262656	MHKMBJHIICIUES-UHFFFAOYSA-N	318.804	4.582	5	20	DJBD	
C[C@H](N[C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1	20526141	KSKWSUFMOWZJFS-NWDGAFQWSA-N	304.777	4.660	5	20	DJBD	
CCc1ccc([C@@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)s1	41631845	FLZXDVPXPPRQEJ-VXGBXAGGSA-N	304.415	4.631	5	20	DJBD	
C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H]1c1ccsc1	72577797	VYRFGVXJMFLYME-SWLSCSKDSA-N	302.399	4.554	5	20	DJBD	
O=[N+]([O-])c1ccc2oc(/C(Cl)=C/c3ccsc3)nc2c1	83536655	HFKIUVVCEYARCN-YHYXMXQVSA-N	306.730	4.534	5	20	DJBD	
C[C@@H](Nc1ccccc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1	249702895	ZHJGUDLIWODFRY-SNVBAGLBSA-N	310.275	4.787	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3oc(C)c(C)c3c2)c1	478986869	HOZVBEWPZCVUMH-UHFFFAOYSA-N	324.336	4.519	5	20	DJBD	
Cc1ccc([C@H](C)NCCc2ccc(Cl)cc2[N+](=O)[O-])s1	495433901	PVYAIHMFTVAORK-NSHDSACASA-N	324.833	4.511	5	20	DJBD	
O=[N+]([O-])c1cc(F)ccc1N[C@@H]1CCSc2ccc(F)cc21	216291219	HQUBREUERVTXPC-GFCCVEGCSA-N	322.336	4.522	5	20	DJBD	
CC(C)c1nc(CSCc2ccc([N+](=O)[O-])cc2)cs1	513817415	HKAPZTWLJPXQQX-UHFFFAOYSA-N	308.428	4.608	5	20	DJBD	
C[C@@H](N[C@H](C)c1ccc(Cl)s1)c1cccc([N+](=O)[O-])c1	37508485	CRKCOBHLYOIZLK-NXEZZACHSA-N	310.806	4.722	5	20	DJBD	
C[C@@H](c1cccs1)N(C)Cc1ccc(Cl)c([N+](=O)[O-])c1	49726662	BKOUFJNISAPPTJ-JTQLQIEISA-N	310.806	4.503	5	20	DJBD	
CCCC(=O)Nc1cc([N+](=O)[O-])ccc1Sc1cccs1	435447361	GHUNVSOODHHJAF-UHFFFAOYSA-N	322.411	4.546	5	20	DJBD	
Cc1c([C@H](C)Nc2cccc(F)c2[N+](=O)[O-])oc2ccccc12	919963435	PAHBTRPWCGNETN-NSHDSACASA-N	314.316	4.962	5	20	DJBD	
Cc1cccc(Cc2nc(-c3cccc([N+](=O)[O-])c3)cs2)c1	603951756	BJBZVQVBGHDMLK-UHFFFAOYSA-N	310.378	4.618	5	20	DJBD	
CCC[C@@H](N[C@@H](CC)c1cccc([N+](=O)[O-])c1)c1ccccn1	610810437	JPWNRCBREKZEGB-FUHWJXTLSA-N	313.401	4.572	5	20	DJBD	
COc1cccc(SCc2cc(Cl)ccc2[N+](=O)[O-])c1	746389736	SUKSADNPYDFRQS-UHFFFAOYSA-N	309.774	4.549	5	20	DJBD	
C/C=C/C=C\C(=O)OCc1nc2ccccc2c2ccccc12	921248984	MBQZHLKLGWSRIX-CHMMKSCTSA-N	303.361	4.564	5	20	DJBD	
Cc1ccccc1[C@@H](CC(C)C)NCc1cccc([N+](=O)[O-])c1	489104845	XYCRHOHXBDGPFQ-LJQANCHMSA-N	312.413	4.780	5	20	DJBD	
CC[C@@H](Nc1ccccc1[N+](=O)[O-])c1ccccc1OC(F)F	498820526	YXEDUJFMADHALZ-GFCCVEGCSA-N	322.311	4.759	5	20	DJBD	
CC(C)(C)OCc1cccc(CNc2ccsc2[N+](=O)[O-])c1	608788490	SHBFGOQZJGEDOT-UHFFFAOYSA-N	320.414	4.584	5	20	DJBD	
CC[C@](C)(NCc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1	782497638	PJSMPMAFRUVSRR-KRWDZBQOSA-N	318.804	4.663	5	20	DJBD	
COc1ccccc1[C@@H](C)SCc1ccc([N+](=O)[O-])cc1	463208422	XPOZWKDWYDAFPN-GFCCVEGCSA-N	303.383	4.598	5	20	DJBD	
Cc1cc(OCc2ccc(C(F)F)cc2)c(F)cc1[N+](=O)[O-]	478900683	VCFVHDRUJRACQT-UHFFFAOYSA-N	311.259	4.559	5	20	DJBD	
CCC[C@@H](NC1(c2ccccc2)CC1)c1cccc([N+](=O)[O-])c1	538524447	VIEORHVDDDUOGV-GOSISDBHSA-N	310.397	4.715	5	20	DJBD	
CC[C@@H](CC1CCCC1)c1nnc(-c2cccc([N+](=O)[O-])c2)o1	1341331402	UGFFUTYJDXUQOC-ZDUSSCGKSA-N	315.373	4.719	5	20	DJBD	
Cc1c([C@H](C)NCc2cccc([N+](=O)[O-])c2)oc2ccccc12	69748861	CGPDPGZTSGUIFZ-ZDUSSCGKSA-N	310.353	4.500	5	20	DJBD	
Cc1c([C@H](C)N[C@@H](c2cccs2)C2CC2)cccc1[N+](=O)[O-]	480241488	PBMWJKICRMFFNW-YVEFUNNKSA-N	316.426	4.767	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)SC[C@H](C)C(F)(F)F	486168184	DPZVRXYPGGLCHT-VHSXEESVSA-N	307.337	4.896	5	20	DJBD	
C[C@H](N[C@H](C)c1ccccc1[N+](=O)[O-])c1c(F)cccc1Cl	531443636	GGPZYFKMKOPHNV-MNOVXSKESA-N	322.767	4.799	5	20	DJBD	
Cc1cc2cc(CN[C@@H](C)c3cccc([N+](=O)[O-])c3C)ccc2[nH]1	556913060	PYVZPNAQZDTWPI-AWEZNQCLSA-N	323.396	4.544	5	20	DJBD	
O=[N+]([O-])c1ccsc1Oc1cnc2ccc(Cl)cc2c1	588049077	HWNUXLOHHRPGJC-UHFFFAOYSA-N	306.730	4.650	5	20	DJBD	
Cc1ccc([C@@H](C)NCc2cccc3ccccc23)cc1[N+](=O)[O-]	237343505	VMQSDKOPOQVHPK-OAHLLOKOSA-N	320.392	4.907	5	20	DJBD	
CCC[C@@H](CC)S[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C	477060281	CQIZXWOQXUKBNA-QWHCGFSZSA-N	324.446	4.542	5	20	DJBD	
O=[N+]([O-])c1ccccc1Sc1ncc(-c2ccc(F)cc2)o1	590832033	BWGSWEXQNXNYFF-UHFFFAOYSA-N	316.313	4.540	5	20	DJBD	
C[C@H](SCCOc1ccccc1[N+](=O)[O-])c1cccs1	737406661	RPEQAIUKZNMHJN-NSHDSACASA-N	309.412	4.530	5	20	DJBD	
CC[C@@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F	160789885	RWDXQCCZRYWLAA-PIGZYNQJSA-N	320.339	4.675	5	20	DJBD	
CC(C)Oc1cccc([C@H](C)Nc2ccc(F)cc2[N+](=O)[O-])c1	515550400	JCWASTRMPAKRMN-LBPRGKRZSA-N	318.348	4.694	5	20	DJBD	
CCC[C@H](NCc1cscc1C)c1cccc([N+](=O)[O-])c1	94877591	OCYODCOXWZGPCN-INIZCTEOSA-N	304.415	4.596	5	20	DJBD	
CCC(C)(C)CC(=O)N(c1cccc([N+](=O)[O-])c1)C1CCCC1	467097129	WGVZFCIFWPVJBH-UHFFFAOYSA-N	318.417	4.697	5	20	DJBD	
CCCc1nc(CSCc2cccc([N+](=O)[O-])c2C)cs1	521567783	WVDYIUDIFQZQNX-UHFFFAOYSA-N	322.455	4.746	5	20	DJBD	
O=[N+]([O-])c1cc2ccccc2nc1Oc1ccc(Cl)cc1	473505714	GMYQEHMJRDZKEO-UHFFFAOYSA-N	300.701	4.589	5	20	DJBD	
Cc1cccc2c1CC[C@H]2Nc1ccc([N+](=O)[O-])c2cnccc12	609193006	WPHSATRLPHBXJS-QGZVFWFLSA-N	319.364	4.551	5	20	DJBD	
O=[N+]([O-])c1ccc(F)cc1CNc1cc(Cl)ccc1Cl	35307982	TXYRDCGGEJOSLH-UHFFFAOYSA-N	315.131	4.653	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](C)c1ccc(F)cc1F	153560292	VEOCAUKIEWFMQJ-NWDGAFQWSA-N	320.339	4.593	5	20	DJBD	
O=C(Nc1cccc([N+](=O)[O-])c1)C1CCC(c2ccccc2)CC1	463241527	CSOSKHCMIQVXOX-UHFFFAOYSA-N	324.380	4.507	5	20	DJBD	
CC[C@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(F)cc1	538138466	RCMNQEGDTOCEQV-LRDDRELGSA-N	302.349	4.536	5	20	DJBD	
C[C@H](N[C@@H]1CC(C)(C)c2ccccc21)c1cccc([N+](=O)[O-])c1	540117291	BYNXWZZMRXESAJ-SCLBCKFNSA-N	310.397	4.668	5	20	DJBD	
CCCCN(C(=O)Nc1cccc([N+](=O)[O-])c1)C1CCCCC1	559074945	LRBBXAOAICTUPD-UHFFFAOYSA-N	319.405	4.562	5	20	DJBD	
C/C(=C\c1cccc([N+](=O)[O-])c1)CN(C)C1CCC(F)(F)CC1	563328647	NDZIXAVWKUQBKT-JLHYYAGUSA-N	324.371	4.508	5	20	DJBD	
Cc1cc([C@@H](C)Nc2ccc([N+](=O)[O-])c3cnccc23)c(C)o1	69287315	CVJQYGRUPNQAHZ-LLVKDONJSA-N	311.341	4.526	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H](c1cccs1)C1CC1	531944245	NDMXRIKZSRHPSR-PXAZEXFGSA-N	316.426	4.767	5	20	DJBD	
CCOc1cc(CNc2ccc3ccccc3c2)ccc1[N+](=O)[O-]	754886511	XHXUNOJZPJRMLN-UHFFFAOYSA-N	322.364	4.759	5	20	DJBD	
COc1cc(C)c(N[C@H](C)c2cccc([N+](=O)[O-])c2C)cc1F	775565518	LOZXUVVWEVHTFZ-GFCCVEGCSA-N	318.348	4.532	5	20	DJBD	
C[C@H](Sc1cccc2cccnc12)c1ccccc1[N+](=O)[O-]	463278213	MQTCMKUDAYLKGL-LBPRGKRZSA-N	310.378	4.996	5	20	DJBD	
Cc1c([C@@H](C)NCC(C)(C)c2cccs2)cccc1[N+](=O)[O-]	483130763	XZNYQCMPPHRABE-CYBMUJFWSA-N	318.442	4.593	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H](C)c2cccc(C)c2C)cc1[N+](=O)[O-]	531711628	KIOIOLHVMCBYJM-HOTGVXAUSA-N	312.413	4.932	5	20	DJBD	
CSc1ccc(N[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1	540701366	ZPTSCUIEKACUOQ-LBPRGKRZSA-N	302.399	4.798	5	20	DJBD	
Cc1coc(SCc2nc3ccccc3c3ccccc23)n1	564776699	YUGLCYWKIZHHDJ-UHFFFAOYSA-N	306.390	4.977	5	20	DJBD	
CC[C@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1F	449347144	FVABTQOVDHWLDB-SJCJKPOMSA-N	302.349	4.536	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)Nc1ccc2scnc2c1	582880923	FZUQDMINUKWLPN-NSHDSACASA-N	313.382	4.686	5	20	DJBD	
Cc1ccc([C@@H](N[C@H](C)c2cccc([N+](=O)[O-])c2)C2CC2)cc1	390962621	LIAOCCMNOGMDQS-AUUYWEPGSA-N	310.397	4.705	5	20	DJBD	
CC[C@H](N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccsc1	453154122	RFGCUWRGLXFMKD-DOMZBBRYSA-N	304.415	4.767	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)SC[C@@H](C)C(F)(F)F	486168182	DPZVRXYPGGLCHT-NXEZZACHSA-N	307.337	4.896	5	20	DJBD	
Cc1ccc(-c2csc(-c3cccs3)n2)cc1[N+](=O)[O-]	7889395	ULYWFPMJHHNLFB-UHFFFAOYSA-N	302.380	4.755	5	20	DJBD	
COc1ccccc1[C@H](C)SCc1c(F)cccc1[N+](=O)[O-]	463192009	KCWYBIIKRUSKCI-NSHDSACASA-N	321.373	4.737	5	20	DJBD	
C[C@@H]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)[C@@H]1C	525548790	HPVDMCDMVYEPCE-HUUCEWRRSA-N	318.420	4.649	5	20	DJBD	
Cc1ccc([C@H](N[C@H](C)c2ccc([N+](=O)[O-])cc2)C2CC2)cc1	531688619	RGMBLIBQOFPJMP-KUHUBIRLSA-N	310.397	4.705	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H](C)c2ccc3c(c2)CCC3)cc1[N+](=O)[O-]	540221440	GKSTUYZBZWREHF-HUUCEWRRSA-N	324.424	4.804	5	20	DJBD	
COc1ccc([N+](=O)[O-])c(N[C@H](C)c2cc3ccccc3o2)c1	609494842	MQJBUVLAURNSJM-LLVKDONJSA-N	312.325	4.523	5	20	DJBD	
COc1ccc(CSCc2ccc(CF)cc2)cc1[N+](=O)[O-]	776905364	AHBBCFIGWVBNLE-UHFFFAOYSA-N	321.373	4.506	5	20	DJBD	
Cc1ccc(CS[C@@H](C)c2cc([N+](=O)[O-])ccc2C)nc1	1319898953	NGOBSCDDEHSQMW-ZDUSSCGKSA-N	302.399	4.601	5	20	DJBD	
O=[N+]([O-])c1cc(/C=C/c2nc3cc(Cl)ccc3o2)cs1	48579012	GLCOUXBNLFQUBU-DAFODLJHSA-N	306.730	4.621	5	20	DJBD	
O=[N+]([O-])c1ccc(N[C@@H]2CCOC3(CCCCC3)C2)c(Cl)c1	301677473	CYTWWZPDTVIXHX-GFCCVEGCSA-N	324.808	4.542	5	20	DJBD	
Cc1cc(C)c2cc(CN[C@@H](C)c3ccc([N+](=O)[O-])cc3)[nH]c2c1	449349164	PODDRRCHIPSYNZ-AWEZNQCLSA-N	323.396	4.544	5	20	DJBD	
CC[C@@H](N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccsc1	453154124	RFGCUWRGLXFMKD-IUODEOHRSA-N	304.415	4.767	5	20	DJBD	
O=[N+]([O-])c1cccnc1SCc1ccc(Cl)c(Cl)c1	518520804	LAAZOVSKQMZYAS-UHFFFAOYSA-N	315.181	4.589	5	20	DJBD	
CCSc1cccc(N[C@H](C)c2ccc([N+](=O)[O-])cc2)c1	538628478	RAIOUKUPZHKRBS-GFCCVEGCSA-N	302.399	4.880	5	20	DJBD	
Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)C1CCCCCCC1	741526211	PFVVRZOZYWLOBS-UHFFFAOYSA-N	304.390	4.511	5	20	DJBD	
Cc1cc(F)ccc1[C@H]1CCCN1c1ccc([N+](=O)[O-])cc1F	864019358	CIGNVLUIRXRAGF-MRXNPFEDSA-N	318.323	4.523	5	20	DJBD	
Cc1ccc(CN[C@H](c2ccccc2)C(C)(C)C)cc1[N+](=O)[O-]	237752429	ZLZPNTTWSJARNP-GOSISDBHSA-N	312.413	4.780	5	20	DJBD	
Cc1ccc([C@@H]2CCCN2[C@H](C)c2ccccc2[N+](=O)[O-])s1	444159062	KQOPXYKBSWIRAU-CJNGLKHVSA-N	316.426	4.863	5	20	DJBD	
CN(C(=O)c1ccc(C2CCCC2)cc1)c1cccc([N+](=O)[O-])c1	464195385	QAEPHMRLEVSCQK-UHFFFAOYSA-N	324.380	4.529	5	20	DJBD	
CCC[C@@H](NCc1ccc(F)c(C)c1)c1cccc([N+](=O)[O-])c1	480255341	BPIHLTBYWOXPLU-GOSISDBHSA-N	316.376	4.673	5	20	DJBD	
Cc1c([C@H](C)N[C@H](C)c2c(F)cccc2F)cccc1[N+](=O)[O-]	480911209	OZAVNNCNPYNGCF-NWDGAFQWSA-N	320.339	4.593	5	20	DJBD	
CC(C)(C)Oc1cc(NCCCC(F)(F)F)ccc1[N+](=O)[O-]	487091961	JBGMGLTWMKWKMV-UHFFFAOYSA-N	320.311	4.527	5	20	DJBD	
O=[N+]([O-])c1cccc(Cl)c1CN1CCC[C@H]1c1ccsc1	494166337	YQNNXXKXPUVVQU-AWEZNQCLSA-N	322.817	4.647	5	20	DJBD	
O=[N+]([O-])c1ccc(CNc2cccc(-c3cccs3)c2)cc1	506888649	IUCJGEQMAWDTGY-UHFFFAOYSA-N	310.378	4.935	5	20	DJBD	
CCC(CC)[C@H](NCc1ccccc1[N+](=O)[O-])c1cccs1	507914471	OWZZOHVONLCHQS-KRWDZBQOSA-N	318.442	4.923	5	20	DJBD	
Cc1ccc([C@@H]2CCCN2c2ccc([N+](=O)[O-])c(C)c2)s1	514082337	HFGMINULCNNUHX-HNNXBMFYSA-N	302.399	4.615	5	20	DJBD	
Cc1cc(C)c(NCc2ccc(Cl)cc2[N+](=O)[O-])c(C)c1	863996255	UGTKYZFPTDZTLA-UHFFFAOYSA-N	304.777	4.786	5	20	DJBD	
O=[N+]([O-])c1ccc(CNc2ccc3c(c2)Cc2ccccc2-3)cc1	323887722	WAFDOVOEHPNNRR-UHFFFAOYSA-N	316.360	4.778	5	20	DJBD	
CC(C)C[C@@H](NCc1ccccc1[N+](=O)[O-])c1cccs1	171128956	JMNXHBQWVMVKEQ-CQSZACIVSA-N	304.415	4.533	5	20	DJBD	
O=[N+]([O-])c1ccc(CSCc2ccco2)c(C(F)(F)F)c1	448105268	QASKSHRRQCIKJB-UHFFFAOYSA-N	317.288	4.640	5	20	DJBD	
CCCCCC[C@H](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	728163381	OGAONRVMTPDTHU-AWEZNQCLSA-N	306.406	4.554	5	20	DJBD	
Cc1ccc(C(=O)c2cc3cc(Cl)ccc3o2)cc1[N+](=O)[O-]	22695488	RGUYVGARJSHREA-UHFFFAOYSA-N	315.712	4.534	5	20	DJBD	
CC(C)(C)[C@H](NCc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1	42800656	NWHCWVDWWGHFHM-QGZVFWFLSA-N	316.376	4.611	5	20	DJBD	
Cc1cc([C@H](C)N[C@H](C)c2ccc([N+](=O)[O-])cc2)c(C)s1	37122836	GFAKHLXANKXWNH-NEPJUHHUSA-N	304.415	4.685	5	20	DJBD	
O=[N+]([O-])c1ccc(N[C@H]2CCOC3(CCCCC3)C2)c(Cl)c1	301677474	CYTWWZPDTVIXHX-LBPRGKRZSA-N	324.808	4.542	5	20	DJBD	
C[C@@H]1C[C@H]1[C@H](Nc1ncc([N+](=O)[O-])s1)c1ccc(Cl)cc1	443523516	PITPPKWEPVJREV-XTWCZFFVSA-N	323.805	4.514	5	20	DJBD	
CSc1ccc(Cl)cc1NCc1cccc([N+](=O)[O-])c1C	462238534	WSSMMVRGPXERGK-UHFFFAOYSA-N	322.817	4.891	5	20	DJBD	
O=[N+]([O-])c1ccc2c(c1)[C@H](NCc1ccc3occc3c1)CCC2	595072583	HPDNFKTWYWDPHP-GOSISDBHSA-N	322.364	4.508	5	20	DJBD	
O=[N+]([O-])c1cccc(CN2CCC[C@H]2c2ccccc2Cl)c1	603857067	PRNQFPJDEGOMOA-KRWDZBQOSA-N	316.788	4.585	5	20	DJBD	
O=[N+]([O-])c1ccccc1Nc1cccc(COCc2ccco2)c1	301099937	PZCZGIUBRCVUBT-UHFFFAOYSA-N	324.336	4.648	5	20	DJBD	
CC[C@@H](NCCc1ccc(Cl)cc1[N+](=O)[O-])c1cccs1	495413023	CSQFQOSGBAVENH-CYBMUJFWSA-N	324.833	4.593	5	20	DJBD	
CCC[C@H](Nc1ncc([N+](=O)[O-])cc1Cl)c1ccccc1	524580602	ZZCLHXGMVSLVQO-AWEZNQCLSA-N	305.765	4.597	5	20	DJBD	
Cc1ccc(Oc2ccc3ncccc3c2[N+](=O)[O-])c(Cl)c1	524849463	KLLNBAVEFDXZBG-UHFFFAOYSA-N	314.728	4.897	5	20	DJBD	
CCCOc1ccccc1NC/C=C/c1ccccc1[N+](=O)[O-]	609634118	CIPRJRIRGNYRID-VQHVLOKHSA-N	312.369	4.509	5	20	DJBD	
C[C@H](NCc1cccc([N+](=O)[O-])c1)c1csc2ccccc12	731451831	HKZQZAABMCFZEQ-LBPRGKRZSA-N	312.394	4.660	5	20	DJBD	
CC(C)[C@H](c1ccccc1)N(C)Cc1cc(F)ccc1[N+](=O)[O-]	732983974	NCOIWKOQYOFARE-GOSISDBHSA-N	316.376	4.563	5	20	DJBD	
CN(Cc1ccon1)Cc1c2ccccc2cc2ccccc12	769467401	SXICRSQDQIIQJH-UHFFFAOYSA-N	302.377	4.613	5	20	DJBD	
C[C@@H](SCc1ccc([N+](=O)[O-])cc1)c1ncc(C(C)(C)C)o1	131318335	FABWIVQAPCJPIU-LLVKDONJSA-N	320.414	4.875	5	20	DJBD	
Cc1c([C@@H](C)N[C@@H](C)CCCC(F)(F)F)cccc1[N+](=O)[O-]	426060203	QXLYPGVRXULUFS-CMPLNLGQSA-N	318.339	4.675	5	20	DJBD	
C/C(=C/c1cccc([N+](=O)[O-])c1)CNc1cccc2cc[nH]c12	527302889	NEFQUSOUIDMHHK-RAXLEYEMSA-N	307.353	4.592	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2cccc(Oc3ccccn3)c2)cc1	602093729	OVDPLIYKBAQPPG-UHFFFAOYSA-N	308.293	4.574	5	20	DJBD	
CCCCN(Cc1ccccc1[N+](=O)[O-])[C@@H](C)c1ccc(C)o1	604493669	XJJVZRAISFIYJT-HNNXBMFYSA-N	316.401	4.860	5	20	DJBD	
C/C(=C\c1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1cnccn1	187649423	BYFIKWXBZOPNTL-ZRDIBKRKSA-N	323.377	4.674	5	20	DJBD	
Cc1ccc(N[C@H](C)c2cccc([N+](=O)[O-])c2)c2cccnc12	320255613	YKUBTOPGMUAHIT-CYBMUJFWSA-N	307.353	4.625	5	20	DJBD	
C[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(C2CC2)cc1	417357813	SDNANARXZJGGLZ-UONOGXRCSA-N	310.397	4.884	5	20	DJBD	
COc1ccc(CS[C@H](C)c2ccccc2[N+](=O)[O-])cc1F	437284703	BWXMGQDPMOVNII-LLVKDONJSA-N	321.373	4.737	5	20	DJBD	
CC[C@H](NCc1c(F)cccc1[N+](=O)[O-])c1ccc(Cl)cc1	505614439	UKRCXBSOJGJGKL-HNNXBMFYSA-N	322.767	4.628	5	20	DJBD	
O=[N+]([O-])c1cc(-c2ccccc2)ccc1OCCC(F)(F)F	517912583	XINZMEJHOTYAOX-UHFFFAOYSA-N	311.259	4.593	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1CN1CCC[C@@H]1c1cccs1	522534920	XZWWFKOETUJBEZ-CYBMUJFWSA-N	322.817	4.647	5	20	DJBD	
C[C@H](SCc1cc(F)ccc1[N+](=O)[O-])c1ccc(F)cc1	745019360	NZRMFBFYVZKYET-JTQLQIEISA-N	309.337	4.867	5	20	DJBD	
Cc1cncc(CNCc2c3ccccc3cc3ccccc23)c1	760441518	NSBWVMDYPMGCMZ-UHFFFAOYSA-N	312.416	4.986	5	20	DJBD	
Cc1c([C@@H](C)NCc2cccc([N+](=O)[O-])c2)oc2ccccc12	69748859	CGPDPGZTSGUIFZ-CYBMUJFWSA-N	310.353	4.500	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H](C)c2cccc(F)c2F)cc1[N+](=O)[O-]	90963238	DJLBASLGHYRJFE-NEPJUHHUSA-N	320.339	4.593	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H](C)c2ccc(Cl)cc2)cc1[N+](=O)[O-]	314053465	PJMPZZKPFHUGMQ-QWHCGFSZSA-N	318.804	4.968	5	20	DJBD	
CC[C@@H](NCc1c(Cl)cccc1[N+](=O)[O-])c1ccc(C)cc1	494798456	YZYDNTBJOUMMFI-MRXNPFEDSA-N	318.804	4.798	5	20	DJBD	
O=[N+]([O-])c1cc(F)c(CNc2cccc3ccccc23)c(F)c1	506270803	DRQGLJNHWAZLOX-UHFFFAOYSA-N	314.291	4.638	5	20	DJBD	
C[C@@H](NCc1cc2ccccc2s1)c1ccc([N+](=O)[O-])cc1	550857312	RJTJBABFGBJOMD-GFCCVEGCSA-N	312.394	4.660	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N(C)Cc1cc2ccccc2[nH]1	1323550423	BHWDLTFYCNYBMV-AWEZNQCLSA-N	323.396	4.578	5	20	DJBD	
O=[N+]([O-])c1cccc(-c2nnc(/C(F)=C\C3CCCCC3)o2)c1	1329096771	ZWANVESGADURKS-NTEUORMPSA-N	317.320	4.536	5	20	DJBD	
CC[C@@H](NCc1ccc2[nH]c(C)cc2c1)c1cccc([N+](=O)[O-])c1	353818477	HTMODQHLGDFQAT-GOSISDBHSA-N	323.396	4.625	5	20	DJBD	
CC[C@@H](N[C@H]1C[C@H](c2ccccc2)C1)c1cccc([N+](=O)[O-])c1	436288124	FLNVLZMEFYDJPI-ZHALLVOQSA-N	310.397	4.582	5	20	DJBD	
COc1ccc(CS[C@H](C)c2ccccc2)cc1[N+](=O)[O-]	521557526	ULPVZZHVLZCKKL-GFCCVEGCSA-N	303.383	4.598	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc2ncccc2c1	302769448	MJAZDYXEFAAKKR-UHFFFAOYSA-N	300.701	4.589	5	20	DJBD	
COc1ccccc1[C@H](C)SCc1cccc([N+](=O)[O-])c1	463206899	QQUAPAKPCRZSDE-LBPRGKRZSA-N	303.383	4.598	5	20	DJBD	
C[C@@H](O)[C@H]1CCCN(Cc2c3ccccc3cc3ccccc23)C1	780893287	VZZCGCPKNUELRX-APWZRJJASA-N	319.448	4.586	5	20	DJBD	
O=[N+]([O-])c1ccc(OCc2csc(C3CCCCC3)n2)cc1	59007990	KZWVFVASMVRUIX-UHFFFAOYSA-N	318.398	4.678	5	20	DJBD	
CCSc1cccc(CN[C@H](C)c2ccc([N+](=O)[O-])cc2)c1	426333735	JCHDERMUYAMESU-CYBMUJFWSA-N	316.426	4.558	5	20	DJBD	
Cc1c(NC(=O)c2ccc(C(C)(C)C)s2)cccc1[N+](=O)[O-]	477476433	FENIOWZDBASACH-UHFFFAOYSA-N	318.398	4.515	5	20	DJBD	
O=[N+]([O-])c1ccccc1/C=C/C=C\c1nc2ccccc2s1	508596737	FHEUCFMINCWXQO-TXHIZOSNSA-N	308.362	4.931	5	20	DJBD	
CC(C)(C)C[C@@H](Nc1ccc([N+](=O)[O-])cn1)c1ccc(F)cc1	603864686	HGRPPBWPQWRKIW-OAHLLOKOSA-N	317.364	4.718	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H](C)c2ccccc2Cl)cc1[N+](=O)[O-]	219863465	CWOAXNDBXRCANB-QWHCGFSZSA-N	318.804	4.968	5	20	DJBD	
C[C@H]1CCN(C(=O)c2cc3ccccc3c3cccnc23)C[C@H]1C	501626198	IGBJTTYPWKEXCN-LSDHHAIUSA-N	318.420	4.506	5	20	DJBD	
O=[N+]([O-])c1ccc(/C=C/Sc2nc3ccccc3s2)o1	14730868	AQPZYWANLJNCHY-BQYQJAHWSA-N	304.352	4.561	5	20	DJBD	
Cc1c([C@H](C)N[C@@H]2CCCc3sccc32)cccc1[N+](=O)[O-]	134966773	VNGPUUBHLOPDJQ-SWLSCSKDSA-N	316.426	4.693	5	20	DJBD	
CC(C)c1nc2ccc(Nc3ncc([N+](=O)[O-])s3)cc2s1	443495793	AKTJAAUUUYCATE-UHFFFAOYSA-N	320.399	4.528	5	20	DJBD	
O=[N+]([O-])c1ccc(SC(c2ccccc2)c2ccccc2)nc1	497744473	RAIXQDGXQNXPTO-UHFFFAOYSA-N	322.389	4.872	5	20	DJBD	
O=[N+]([O-])c1sccc1NCc1c(Cl)cccc1Cl	604491958	ISPVBUHQHPXKAZ-UHFFFAOYSA-N	303.170	4.575	5	20	DJBD	
C[C@H](SCc1ccc2c(c1)COC2)c1ccccc1[N+](=O)[O-]	778055846	ZTFQBOVEVKXBMC-LBPRGKRZSA-N	315.394	4.619	5	20	DJBD	
CC(C)c1ocnc1CS[C@@H](C)c1ccccc1[N+](=O)[O-]	1116452418	LLIGBZSDQZEEBA-NSHDSACASA-N	306.387	4.701	5	20	DJBD	
O=[N+]([O-])c1ccccc1/C=C/c1nc2cc(Cl)ccc2o1	8321198	KQTYWGYZYKFSNI-VMPITWQZSA-N	300.701	4.560	5	20	DJBD	
Cc1cc(N[C@H](C)c2nc(C(C)(C)C)cs2)ccc1[N+](=O)[O-]	301196259	OCGRDZFKOXFVGF-LLVKDONJSA-N	319.430	4.830	5	20	DJBD	
Cc1ccsc1/C=C(/c1ccncc1)c1ccc([N+](=O)[O-])cc1	514765523	SKTMZDBRKBEYHO-SFQUDFHCSA-N	322.389	4.949	5	20	DJBD	
CSc1cccc(NCc2ccc(Cl)cc2[N+](=O)[O-])c1C	864022075	LPGMMROCVFNFRC-UHFFFAOYSA-N	322.817	4.891	5	20	DJBD	
Cc1ccc2oc(C(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)cc2c1	86624626	QIKYRRRHQITKBG-UHFFFAOYSA-N	324.336	4.519	5	20	DJBD	
CC[C@H](NCc1ccccc1[N+](=O)[O-])c1cccc(Cl)c1F	461112834	XPZCHBQDQDZVAO-AWEZNQCLSA-N	322.767	4.628	5	20	DJBD	
Cc1cc([C@@H](C)NCc2ccc(Cl)c([N+](=O)[O-])c2)ccc1F	824548698	LICMXSQJTZHTBC-LLVKDONJSA-N	322.767	4.547	5	20	DJBD	
Cc1c([C@H](C)N[C@@H](c2ccccc2)C2CC2)cccc1[N+](=O)[O-]	178494412	SRDOMZRAJYDHLR-LIRRHRJNSA-N	310.397	4.705	5	20	DJBD	
O=[N+]([O-])c1cnc(Oc2ccc(Cl)c(Cl)c2)c(Cl)c1	301260113	FXOBFGMSBCLXTH-UHFFFAOYSA-N	319.531	4.742	5	20	DJBD	
CC(=O)c1cc(N[C@@H](C)c2c(C)cccc2C)ccc1[N+](=O)[O-]	575080576	UEPMOEKYFWWMGV-ZDUSSCGKSA-N	312.369	4.587	5	20	DJBD	
Cc1cc(F)ccc1[C@@H](C)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1	815595015	FVFHYWQAMFCNLB-UONOGXRCSA-N	316.376	4.763	5	20	DJBD	
O=[N+]([O-])c1ccc2sc(/C=C/c3cccc(F)c3F)nc2c1	78560908	HZIQEJZKFDRLSD-QPJJXVBHSA-N	318.304	4.653	5	20	DJBD	
CCC[C@@H](NCc1sccc1C)c1cccc([N+](=O)[O-])c1	94875026	BZGKYQZSKLHGQF-OAHLLOKOSA-N	304.415	4.596	5	20	DJBD	
CCC(CC)n1ccc(CSc2ccc([N+](=O)[O-])cc2F)n1	618965404	ZWYVKFDOHFTLPR-UHFFFAOYSA-N	323.393	4.584	5	20	DJBD	
C[C@H](N[C@H]1CCc2cc(Cl)ccc21)c1cccc([N+](=O)[O-])c1	173361382	LNDVCBZJMVVSFO-GTNSWQLSSA-N	316.788	4.586	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](CC(F)(F)F)C(C)C	527100167	PELQPSPFYDCUHC-FZMZJTMJSA-N	318.339	4.531	5	20	DJBD	
Cc1cccc2c1CC[C@@H]2N[C@@H](C)c1cccc([N+](=O)[O-])c1C	540178957	JXBLUGCIXLKXEX-KSSFIOAISA-N	310.397	4.550	5	20	DJBD	
C[C@H](N[C@H]1c2ccccc2CC[C@@H]1C)c1ccc([N+](=O)[O-])cc1	560910575	UQMDSBAOHZHZCH-CKFHNAJUSA-N	310.397	4.569	5	20	DJBD	
C[C@@H](N[C@H]1CCc2sc(Cl)cc21)c1ccc([N+](=O)[O-])cc1	571486377	CIPYBJHVXGIJNS-RNCFNFMXSA-N	322.817	4.648	5	20	DJBD	
Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)C[C@@H](C)C1CCCCC1	800148126	XXCFZJAKLBLTPA-LLVKDONJSA-N	322.380	4.587	5	20	DJBD	
C/C=C/c1ccc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1	569524534	PKRQUQHPXDDWFK-SNAWJCMRSA-N	324.380	4.544	5	20	DJBD	
C[C@@H](Nc1ccccc1[N+](=O)[O-])c1ccc(-c2ccncc2)cc1	301414697	BEFNYHBBJQYYJL-CQSZACIVSA-N	319.364	4.830	5	20	DJBD	
C/C=C/c1ccc(Oc2ccc(F)cc2[N+](=O)[O-])c(OC)c1	497721252	CGRQDKYDENIYMQ-ONEGZZNKSA-N	303.289	4.568	5	20	DJBD	
CC(=O)c1ccc(NCc2ccc(C(C)C)cc2)c([N+](=O)[O-])c1	511670350	ICLRXKVPIHLFDW-UHFFFAOYSA-N	312.369	4.533	5	20	DJBD	
Cc1ccc2c(c1)[C@H](N[C@H](C)c1cc([N+](=O)[O-])ccc1C)CC2	611335709	PUOYJTKKQSIQMK-AUUYWEPGSA-N	310.397	4.550	5	20	DJBD	
COc1ccc([N+](=O)[O-])cc1CS[C@H](C)c1cccs1	737404741	VSCKLYMVGXRIHE-SNVBAGLBSA-N	309.412	4.659	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(-c2nc(C3CCCCCC3)no2)c1C	904686779	NADSMXUIMBPAKB-UHFFFAOYSA-N	315.373	4.699	5	20	DJBD	
CO[C@H](C)c1cccc(NCc2c(Cl)cccc2[N+](=O)[O-])c1	155527589	XPVJZUSFSRUABA-LLVKDONJSA-N	320.776	4.568	5	20	DJBD	
CCC[C@H](NCc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1	315159280	USDJDUBLKZPXFD-INIZCTEOSA-N	318.804	4.879	5	20	DJBD	
CC(=O)c1ccc(SCc2cc(C)ccc2C)c([N+](=O)[O-])c1	524670903	PJWIKARQMJVQFG-UHFFFAOYSA-N	315.394	4.707	5	20	DJBD	
CC(C)Oc1ccccc1[C@H](C)Nc1ccc(F)cc1[N+](=O)[O-]	603861893	FEJICLUDOOTGJL-LBPRGKRZSA-N	318.348	4.694	5	20	DJBD	
C[C@@H](SCCC1SCCS1)c1ccccc1[N+](=O)[O-]	853797174	KATTYFQFBCGQRG-SNVBAGLBSA-N	315.485	4.585	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)SCc1ccc(Cl)cn1	1320017800	ZDSAUBYFDURBDP-LLVKDONJSA-N	322.817	4.946	5	20	DJBD	
COc1ccc([C@@H](C)Nc2ccc([N+](=O)[O-])cc2Cl)cc1F	7903681	ZFTXWZVMLBQIGG-SECBINFHSA-N	324.739	4.569	5	20	DJBD	
O=[N+]([O-])c1cccc(-c2nc(-c3ccc(F)c(F)c3)cs2)c1	71971801	MOQVWPOTKSLACR-UHFFFAOYSA-N	318.304	4.664	5	20	DJBD	
C[C@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc(-c2ccccc2)o1	89513222	LSAWCYGPXYLKHI-AWEZNQCLSA-N	322.364	4.706	5	20	DJBD	
C[C@H](Nc1cccc(C(F)(F)F)c1)c1ccccc1[N+](=O)[O-]	314286818	CAFJSYTXQZBFHZ-JTQLQIEISA-N	310.275	4.787	5	20	DJBD	
Cc1oc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3C)cc2c1C	477924061	QPGLGSXKUGTYAX-UHFFFAOYSA-N	324.336	4.519	5	20	DJBD	
O=[N+]([O-])c1ccccc1/C=C/CNc1ccccc1OCC1CC1	562142001	BUIOLBRNVYTWNM-FNORWQNLSA-N	324.380	4.509	5	20	DJBD	
CC(C)[C@H](C)C(=O)OCc1nc2ccccc2c2ccccc12	733576064	GSCAIOIYMYOPIM-AWEZNQCLSA-N	307.393	4.723	5	20	DJBD	
CC[C@@H](Nc1ccc(N(C)C)c(C)c1)c1cccc([N+](=O)[O-])c1	777643676	VEPGKPIYQNSKOJ-QGZVFWFLSA-N	313.401	4.532	5	20	DJBD	
O=C(OCc1ccccn1)c1c2ccccc2cc2ccccc12	16702621	ALBGELVBUKGRPM-UHFFFAOYSA-N	313.356	4.745	5	20	DJBD	
Cc1ccc([C@@H](C)NCc2ccc(F)c(Cl)c2)cc1[N+](=O)[O-]	122554947	PDCBGELPYMASLL-LLVKDONJSA-N	322.767	4.547	5	20	DJBD	
Cc1cc(N[C@H](C)c2oc3ccccc3c2C)ncc1[N+](=O)[O-]	301454113	VQSOYAXKSRWZIB-GFCCVEGCSA-N	311.341	4.526	5	20	DJBD	
CC(C)[C@@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])c2ccccc21	447572256	AWSZJRFDELBLHN-ROUUACIJSA-N	310.397	4.569	5	20	DJBD	
Cc1cc([C@@H](C)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cs1	453143238	DOPJURWKWNSSLB-QWHCGFSZSA-N	304.415	4.685	5	20	DJBD	
O=[N+]([O-])c1cc(F)ccc1Oc1cncc(-c2ccccc2)c1	589601509	SXLKSDICQIRWRH-UHFFFAOYSA-N	310.284	4.588	5	20	DJBD	
Cc1ccccc1C1(N[C@@H](C)c2cccc([N+](=O)[O-])c2C)CC1	592391813	MPNVBBJIBRGFQH-HNNXBMFYSA-N	310.397	4.552	5	20	DJBD	
CSc1ccc(Cl)cc1NCc1ccc(C)c([N+](=O)[O-])c1	864026741	APBBCBFHLDBHSH-UHFFFAOYSA-N	322.817	4.891	5	20	DJBD	
O=[N+]([O-])c1ccc(/C=C\c2nc3cc(Cl)ccc3o2)s1	541076131	RKXCPUNMTVUYHD-DJWKRKHSSA-N	306.730	4.621	5	20	DJBD	
Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccc(C(C)C)cc1	603501335	IFPBXDAGYCBRHD-UHFFFAOYSA-N	312.369	4.587	5	20	DJBD	
O=[N+]([O-])c1ccsc1Oc1ccc(-c2cscn2)cc1	611413368	MDGQCISUHVMBEF-UHFFFAOYSA-N	304.352	4.572	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)cc1Oc1nc(C(F)(F)F)cs1	301723192	KRXLDWNNNJBDSI-UHFFFAOYSA-N	324.667	4.516	5	20	DJBD	
COc1ccc(N[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1Cl	776797536	TUZPFDRVWWIMJO-NSHDSACASA-N	320.776	4.738	5	20	DJBD	
Cc1c([N+](=O)[O-])ccc(F)c1NCc1ccc(C(F)F)cc1	799971703	RZLRGXNEJUOGRI-UHFFFAOYSA-N	310.275	4.592	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1NC(=O)c1oc2c(C)cccc2c1C	52979789	IQBJSYXQLZDFJQ-UHFFFAOYSA-N	324.336	4.519	5	20	DJBD	
C[C@@H](NCc1ccccc1[N+](=O)[O-])c1ccc2ccccc2c1	194757750	XGGHFPMCHPPWFV-CQSZACIVSA-N	306.365	4.599	5	20	DJBD	
O=[N+]([O-])c1cccc(Cl)c1CNc1cccc(C(F)F)c1	386221043	JVOZPJXUIRYZHB-UHFFFAOYSA-N	312.703	4.798	5	20	DJBD	
C[C@@H](CCc1ccccc1[N+](=O)[O-])Nc1cccc2ccncc12	537523177	GWYIRLRYNVILQG-AWEZNQCLSA-N	321.380	4.576	5	20	DJBD	
O=[N+]([O-])c1ccc(SCc2nc3ccccc3s2)c(F)c1	618965396	ZJGBREBDTNMDAI-UHFFFAOYSA-N	320.370	4.636	5	20	DJBD	
CSc1ccc([C@@H](C)Nc2ccc([N+](=O)[O-])cc2F)cc1	47873357	HAKGPAMCBRBMAL-SNVBAGLBSA-N	306.362	4.629	5	20	DJBD	
CC[C@H](NCc1cccc(C(F)F)c1)c1cccc([N+](=O)[O-])c1	275785216	WODHSBVCSMIYIG-INIZCTEOSA-N	320.339	4.773	5	20	DJBD	
O=[N+]([O-])c1c(F)cccc1N[C@H]1CCSc2ccc(F)cc21	302462656	RVAZGFIIFHNBCA-LBPRGKRZSA-N	322.336	4.522	5	20	DJBD	
Cc1ccnc(Oc2ccc(Cl)c3ccccc23)c1[N+](=O)[O-]	303735582	WLGKRSQYVWPFDZ-UHFFFAOYSA-N	314.728	4.897	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](c1cccs1)C1CC1	531944247	NDMXRIKZSRHPSR-SJKOYZFVSA-N	316.426	4.767	5	20	DJBD	
Cc1c([C@H](C)NCCc2ccc(Cl)s2)cccc1[N+](=O)[O-]	539093224	JVJIPAAMBYNZJB-NSHDSACASA-N	324.833	4.511	5	20	DJBD	
c1ccc2c(CN3CC[C@@]4(CCOC4)C3)c3ccccc3cc2c1	769534752	XFZBTKBVTHKHIO-JOCHJYFZSA-N	317.432	4.605	5	20	DJBD	
CC(C)c1ccccc1NCc1ccc(Cl)cc1[N+](=O)[O-]	50443098	PDVCJQRLSUEHNK-UHFFFAOYSA-N	304.777	4.984	5	20	DJBD	
Cc1cc([C@H](C)NCc2ccc(Cl)cc2[N+](=O)[O-])c(C)s1	50443774	LCNVYDYKIJGKNF-JTQLQIEISA-N	324.833	4.777	5	20	DJBD	
O=[N+]([O-])c1ccc2c(c1)[C@@H](N[C@H](c1ccccc1)C1CC1)CCC2	447533162	ZJDBCXZGGXAZEQ-VQTJNVASSA-N	322.408	4.713	5	20	DJBD	
Cc1cc([C@@H](C)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cs1	453143224	DOPJURWKWNSSLB-CHWSQXEVSA-N	304.415	4.685	5	20	DJBD	
C/C(=C\c1cccc([N+](=O)[O-])c1)CN(C)[C@H](C)c1cccs1	470176645	XRJGWFYNMRGVOG-JWAFFJSPSA-N	316.426	4.753	5	20	DJBD	
Cc1cc(Oc2ccc3ncccc3c2[N+](=O)[O-])ccc1Cl	480374087	GNBHZDZJVBZYOX-UHFFFAOYSA-N	314.728	4.897	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2ccc3oc4ccccc4c3c2)cn1	603475416	KZPQALRZBWVWLB-UHFFFAOYSA-N	306.277	4.682	5	20	DJBD	
Cc1ccccc1[C@@H](NCc1c(F)cccc1[N+](=O)[O-])C(C)C	611394095	GNFZCKJXGJMMHU-SFHVURJKSA-N	316.376	4.529	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)cc1Oc1nc2ccccc2s1	301126305	QDERECHILHHRFV-UHFFFAOYSA-N	306.730	4.650	5	20	DJBD	
C[C@H](N[C@H](C)c1ccc(C2CC2)cc1)c1ccc([N+](=O)[O-])cc1	417352241	FPEYSSPLXDOZRC-KGLIPLIRSA-N	310.397	4.884	5	20	DJBD	
C[C@@H](c1ccccc1[N+](=O)[O-])N(C)Cc1cc2ccccc2o1	472292795	MANRCKFHTPFJQZ-ZDUSSCGKSA-N	310.353	4.534	5	20	DJBD	
Cc1cc(C)cc([C@H](C)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1	531719733	IDYMKYKRUSMIGM-HOTGVXAUSA-N	312.413	4.932	5	20	DJBD	
O=[N+]([O-])c1ccc(/C=C\c2nc(C3CCCCCC3)no2)cc1	904677658	CLIXQOXHAFFXJO-XFXZXTDPSA-N	313.357	4.586	5	20	DJBD	
O=C(OCc1nc2ccccc2c2ccccc12)c1ccsc1	17275479	YUGQGVUTFOREAH-UHFFFAOYSA-N	319.385	4.807	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H](C)c2cc(F)ccc2F)cc1[N+](=O)[O-]	78968600	LORSCBFNXIDBTM-VXGBXAGGSA-N	320.339	4.593	5	20	DJBD	
C[C@H](N[C@H](C)c1ccc(F)c(Cl)c1)c1cccc([N+](=O)[O-])c1	79723966	XWNOUPUPUHXJIZ-WDEREUQCSA-N	322.767	4.799	5	20	DJBD	
CC(C)[C@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1	378920255	YBEKBNSJFSNCGS-KRWDZBQOSA-N	318.804	4.735	5	20	DJBD	
Cc1ccccc1[C@@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)C(C)C	467863676	MAIQEBKHUUHRIY-BEFAXECRSA-N	312.413	4.951	5	20	DJBD	
O=[N+]([O-])c1cccc2nc(/C=C/C=C/c3ccccc3)ccc12	476965899	XSPBKCSNFJEPCB-LUZURFALSA-N	302.333	4.870	5	20	DJBD	
CC(C)c1ccc(NC(=O)c2ccc([N+](=O)[O-])o2)c(C(C)C)c1	27139141	HRDSSHOMZCMZJN-UHFFFAOYSA-N	316.357	4.687	5	20	DJBD	
O=[N+]([O-])c1ccccc1N[C@@H]1CCSc2ccc(Cl)cc21	35046777	UJZXNNGWLHVWAL-GFCCVEGCSA-N	320.801	4.897	5	20	DJBD	
Cc1cccc([C@H](C)Nc2ccc([N+](=O)[O-])c3cnccc23)c1C	303729103	UJPOGJOUEPNBBX-AWEZNQCLSA-N	321.380	4.933	5	20	DJBD	
Cc1ccc(CNCc2ccc(C(C)C)c([N+](=O)[O-])c2)c(C)c1	513085661	FETHCDNJJATDFR-UHFFFAOYSA-N	312.413	4.625	5	20	DJBD	
Cc1ccccc1[C@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])C1CC1	537290851	LTXRNXVKFFJKSW-IFXJQAMLSA-N	310.397	4.705	5	20	DJBD	
CCCOc1ccccc1NC/C=C\c1ccccc1[N+](=O)[O-]	609634117	CIPRJRIRGNYRID-CLFYSBASSA-N	312.369	4.509	5	20	DJBD	
Cc1ccc(CN(Cc2ccc([N+](=O)[O-])c(F)c2)C(C)C)s1	788477735	FIXSUUOUDYNVIP-UHFFFAOYSA-N	322.405	4.514	5	20	DJBD	
C[C@H](Sc1ccc([N+](=O)[O-])cc1F)c1nc2ccccc2o1	187581542	RGWXQRPBTNOANK-VIFPVBQESA-N	318.329	4.728	5	20	DJBD	
O=[N+]([O-])c1ccc(/C=C\Sc2nc3ccccc3s2)o1	209873492	AQPZYWANLJNCHY-FPLPWBNLSA-N	304.352	4.561	5	20	DJBD	
COc1cc(CSc2cccc([N+](=O)[O-])c2)ccc1SC	509082060	LIJPXGFKOBHXGN-UHFFFAOYSA-N	321.423	4.618	5	20	DJBD	
CCc1oc2ccccc2c1CN(C)Cc1ccccc1[N+](=O)[O-]	611766640	UGYKBMWUJOHYAJ-UHFFFAOYSA-N	324.380	4.535	5	20	DJBD	
CCc1ccc([C@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)s1	41631848	FLZXDVPXPPRQEJ-NEPJUHHUSA-N	304.415	4.631	5	20	DJBD	
O=[N+]([O-])c1ccc(-c2csc(CCc3ccccc3)n2)cc1	59932670	JCLNTTXTOQUROC-UHFFFAOYSA-N	310.378	4.504	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)c(Oc2ccc3cn[nH]c3c2)c(Cl)c1	302265029	FFSNEPDUQITBQF-UHFFFAOYSA-N	324.123	4.570	5	20	DJBD	
Cc1ccc2c(c1)[C@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)CCC2	426288318	IQROXICVPKTBQN-IFXJQAMLSA-N	310.397	4.631	5	20	DJBD	
O=[N+]([O-])c1ccc(N[C@@H]2CC[C@H]3CCC[C@H]3C2)c2ccncc12	462904419	UQOOPYLPDBIUIQ-HZSPNIEDSA-N	311.385	4.524	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1ccc(C2CCC2)cc1	485629069	FPBLBOIXOWQACH-UHFFFAOYSA-N	324.380	4.731	5	20	DJBD	
Cc1c([C@@H](C)Nc2cccc(OC(F)F)c2)cccc1[N+](=O)[O-]	538497818	QSGCPNKBFILCLC-LLVKDONJSA-N	322.311	4.678	5	20	DJBD	
O=[N+]([O-])c1ccccc1N1CCC[C@@H]1c1ccccc1Cl	603870479	QARPRSPWDXFMOV-CQSZACIVSA-N	302.761	4.590	5	20	DJBD	
O=[N+]([O-])c1ccc(NCc2cc3ccccc3s2)c(F)c1	920486617	KBQGIVYWQXRCGO-UHFFFAOYSA-N	302.330	4.561	5	20	DJBD	
O=[N+]([O-])c1ccc(SCc2coc(-c3ccccc3)n2)cc1	46835527	LQVHDNVECPTVLL-UHFFFAOYSA-N	312.350	4.542	5	20	DJBD	
CCCC(CCC)S[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-]	64048223	FHUABNCDAKCJSZ-GFCCVEGCSA-N	324.446	4.624	5	20	DJBD	
CCC[C@@H](Nc1cccc(COC)c1)c1cccc([N+](=O)[O-])c1	192704029	LIKJXAGLUAUHSG-GOSISDBHSA-N	314.385	4.695	5	20	DJBD	
CCC[C@H](NCc1cc(C)cs1)c1cccc([N+](=O)[O-])c1	379263513	IQPAWQMLXUGELF-INIZCTEOSA-N	304.415	4.596	5	20	DJBD	
CCC(CC)n1ccc(CSCc2cccc([N+](=O)[O-])c2)n1	433641575	GRWINDIGVYSKGC-UHFFFAOYSA-N	319.430	4.586	5	20	DJBD	
Cc1cc2cc(CN[C@H](C)c3ccc(C)c([N+](=O)[O-])c3)ccc2[nH]1	556914297	FZXATFNUQRLOQW-CQSZACIVSA-N	323.396	4.544	5	20	DJBD	
Cc1cccc(C2(NCc3cccc([N+](=O)[O-])c3C)CCCC2)c1	729266439	CXJOVNFJTDWLTE-UHFFFAOYSA-N	324.424	4.771	5	20	DJBD	
Clc1c2ccccc2c(CNCc2ccon2)c2ccccc12	747622119	KJKRYXAZVRNROL-UHFFFAOYSA-N	322.795	4.924	5	20	DJBD	
CC(=O)c1ccc(S[C@H](C)c2ccc(F)cc2)c([N+](=O)[O-])c1	63282297	VAPGAHMADYPUFQ-LLVKDONJSA-N	319.357	4.790	5	20	DJBD	
O=[N+]([O-])c1cccc(CNc2ccc(-c3ccccc3)cc2)c1	302816546	WNXUDXRIDCEZMC-UHFFFAOYSA-N	304.349	4.874	5	20	DJBD	
CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1cscc1C	872065737	ANNZTSFGMBCQHK-LLVKDONJSA-N	322.455	4.537	5	20	DJBD	
C[C@@H]1C[C@@H]1c1ccc(CNc2ccc([N+](=O)[O-])cc2Cl)o1	36971042	RGNHHCDQFGPTGZ-SKDRFNHKSA-N	306.749	4.577	5	20	DJBD	
Cc1c(CN[C@@H]2CC[C@@H](C)c3ccccc32)cccc1[N+](=O)[O-]	323044579	DEWYKUSOVHKDIZ-FZKQIMNGSA-N	310.397	4.631	5	20	DJBD	
CC[C@H](NCc1c(F)cccc1Cl)c1cccc([N+](=O)[O-])c1	532463850	QJBSRXGWKYIMHR-INIZCTEOSA-N	322.767	4.628	5	20	DJBD	
C[C@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(Cl)cc1	582735116	CUQKMOBMGQNZAZ-MEDUHNTESA-N	316.788	4.586	5	20	DJBD	
CC(C)Oc1cccc([C@H](C)Nc2ccc([N+](=O)[O-])s2)c1	604409209	AKJVZPHEAXFGCU-NSHDSACASA-N	306.387	4.617	5	20	DJBD	
Cc1c([C@H](C)NCc2cccc(Cl)c2F)cccc1[N+](=O)[O-]	1319766863	PIABOSRIWXWORE-NSHDSACASA-N	322.767	4.547	5	20	DJBD	
C[C@H](Nc1ccc2nc(C3CC3)oc2c1)c1ccc([N+](=O)[O-])cc1	182895949	LCUJUBHRYRZMEZ-NSHDSACASA-N	323.352	4.787	5	20	DJBD	
C[C@H](Sc1cccc([N+](=O)[O-])c1)c1nc2ccccc2o1	509090426	SGGWDQXLOXJBNX-JTQLQIEISA-N	300.339	4.589	5	20	DJBD	
Cc1cc([C@@H](C)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)ccc1F	611336105	JCDGYDOCWKJTHV-KGLIPLIRSA-N	316.376	4.763	5	20	DJBD	
CC(C)(CO)CCCNCc1c2ccccc2cc2ccccc12	742372631	QNXQEYYOLKMIIO-UHFFFAOYSA-N	321.464	4.881	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccccc2C(C)C)c1C	887608724	MUXPCSFKOINPHU-UHFFFAOYSA-N	312.369	4.587	5	20	DJBD	
O=[N+]([O-])c1cccc(SCc2cc(Cl)nc(Cl)c2)c1	1256626518	KXGLVZXMOSDKDB-UHFFFAOYSA-N	315.181	4.589	5	20	DJBD	
O=[N+]([O-])c1ccc(/C=C/c2cnc(C3CCCCC3)s2)nc1	531249133	POFVITKYSQPONL-VQHVLOKHSA-N	315.398	4.664	5	20	DJBD	
C[C@H](Nc1ccc([N+](=O)[O-])s1)c1c(F)cccc1Cl	610588609	TXEBWCHECOZQIG-ZETCQYMHSA-N	300.742	4.622	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)Nc1ccc(OC(F)F)cc1	776802521	PAIDGTPWBKPWJY-NSHDSACASA-N	322.311	4.678	5	20	DJBD	
Cc1ccc(CNc2ccc(-c3ccccn3)cc2)cc1[N+](=O)[O-]	864013061	JYOAGBNIQORYNK-UHFFFAOYSA-N	319.364	4.577	5	20	DJBD	
Cc1cc(NCc2cccc([N+](=O)[O-])c2C)c2cccnc2c1C	864015731	UFAOFVFCWXIJJC-UHFFFAOYSA-N	321.380	4.680	5	20	DJBD	
O=[N+]([O-])c1ccccc1CSC1=Nc2ccccc2CS1	52463287	QIFOKWMUHMMFJV-UHFFFAOYSA-N	316.407	4.763	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H](c2ccccc2)C(C)C)cc1[N+](=O)[O-]	319840296	OFXJWIGUJWZIAN-DNVCBOLYSA-N	312.413	4.951	5	20	DJBD	
CC(C)[C@@H](Nc1ncc([N+](=O)[O-])s1)c1ccccc1Cl	443511490	TXAKVOLNMZJTSZ-GFCCVEGCSA-N	311.794	4.514	5	20	DJBD	
O=C(CCC1CC1)OCc1nc2ccccc2c2ccccc12	734610696	NHMFGKQINWLEPL-UHFFFAOYSA-N	305.377	4.621	5	20	DJBD	
O=C(Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-])[C@H]1CC=CCC1	920330300	XJBCLATWFMXXDD-HNNXBMFYSA-N	323.348	4.524	5	20	DJBD	
CCc1ccc([N+](=O)[O-])cc1NC(=O)c1sccc1C(C)C	464714062	RCIPBDPEXNXSNC-UHFFFAOYSA-N	318.398	4.594	5	20	DJBD	
CC[C@H](C)n1ncc(N[C@H](C)c2cccc([N+](=O)[O-])c2C)c1C	477929363	RIMOHAFVURLCSA-WCQYABFASA-N	316.405	4.552	5	20	DJBD	
CC(C)[C@@H](CC1CCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1F	609693666	BTLYLCJQEFBDRZ-CQSZACIVSA-N	322.380	4.525	5	20	DJBD	
CC(=O)c1ccc2cc(OCc3cccc([N+](=O)[O-])c3)ccc2c1	482722205	VKDRHVXKCPHQQF-UHFFFAOYSA-N	321.332	4.530	5	20	DJBD	
CC[C@H](Nc1ccc([N+](=O)[O-])cc1)c1ccccc1OC(F)F	513135232	ICDMEASYRZSDMZ-AWEZNQCLSA-N	322.311	4.759	5	20	DJBD	
Cc1cc([C@@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc(C)c1F	536807228	RQOZZYHECDKSNL-ZIAGYGMSSA-N	316.376	4.763	5	20	DJBD	
O=[N+]([O-])c1ccc(Nc2ccc3nc(C(F)F)sc3c2)cc1	553387569	HIYYYFWYAOQCBR-UHFFFAOYSA-N	321.308	4.886	5	20	DJBD	
Cc1c(CN[C@@H](c2ccccc2)C2CCCC2)cccc1[N+](=O)[O-]	731845591	FMSJDHFZXIBTMI-FQEVSTJZSA-N	324.424	4.924	5	20	DJBD	
CCCCCC[C@H](C)C(=O)Nc1c(F)ccc([N+](=O)[O-])c1C	800147393	NECIELFEKHKHRF-NSHDSACASA-N	310.369	4.587	5	20	DJBD	
C[C@H](NC1(C)CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1	1320669195	DCFXFTKXWOVZLM-NSHDSACASA-N	302.399	4.526	5	20	DJBD	
O=[N+]([O-])c1ccc(NC(=S)Nc2cccc3ccccc23)cc1	5338628	GJDRSYLDJPWOMT-UHFFFAOYSA-N	323.377	4.557	5	20	DJBD	
C[C@@H](SCc1cccc([N+](=O)[O-])c1)c1nc2ccccc2o1	183257733	IQEOSOJKFCZPAG-LLVKDONJSA-N	314.366	4.730	5	20	DJBD	
CC(C)[C@@H](NCc1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1	393370761	LZRTWUIDSUODQA-QGZVFWFLSA-N	318.804	4.735	5	20	DJBD	
Cc1cnc(Oc2cccc(Oc3ccccc3)c2)c([N+](=O)[O-])c1	463053667	NWXCEGAWHOCJCC-UHFFFAOYSA-N	322.320	4.883	5	20	DJBD	
Cc1ccc2c(c1)CC[C@H]2Nc1ccc2cc([N+](=O)[O-])ccc2n1	511714509	VPCNWKWQONJIJX-GOSISDBHSA-N	319.364	4.551	5	20	DJBD	
CC(C)c1ccsc1C(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1	727711492	ICCXCMLRLMIZNU-UHFFFAOYSA-N	324.789	4.685	5	20	DJBD	
O=C(Nc1cccc([N+](=O)[O-])c1Cl)C1CCCCCCC1	813245799	KJUOQVVEGFVSQC-UHFFFAOYSA-N	310.781	4.547	5	20	DJBD	
O=[N+]([O-])c1cccc(-c2nnc([C@H](F)CC3CCCCC3)o2)c1	1345542630	GEVMHISCPBQFQT-CQSZACIVSA-N	319.336	4.626	5	20	DJBD	
O=[N+]([O-])c1ccc(N[C@H]2CCSc3ccc(F)cc32)c(F)c1	301094917	QPSAWCGYXIPIJR-ZDUSSCGKSA-N	322.336	4.522	5	20	DJBD	
C[C@H](SCc1cccc(F)c1F)c1ccccc1[N+](=O)[O-]	437295173	TZQGSRBHGAZBQI-JTQLQIEISA-N	309.337	4.867	5	20	DJBD	
Cc1ccc([C@H](C)NCc2cc(F)cc(Cl)c2)cc1[N+](=O)[O-]	485694059	LTLHDNBXLDTIAG-NSHDSACASA-N	322.767	4.547	5	20	DJBD	
C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@@H]1c1ccc(Cl)cc1	511590591	CTZXSKVIWZUDAR-MLGOLLRUSA-N	316.788	4.756	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1c(F)cccc1Cl	531949656	QNLXBXAUTAIQOQ-LLVKDONJSA-N	322.767	4.547	5	20	DJBD	
Cc1c([C@@H](C)N[C@H](C)c2cccc(F)c2F)cccc1[N+](=O)[O-]	90963322	YPBKXSFCTRJLQH-VXGBXAGGSA-N	320.339	4.593	5	20	DJBD	
O=[N+]([O-])c1ccc(NCc2coc3ccccc23)c2ccncc12	358201438	ZOAPGPWNAIJLRA-UHFFFAOYSA-N	319.320	4.501	5	20	DJBD	
CC(C)N(CC1CC1)C(=O)c1cc2ccccc2c2cccnc12	611835910	JDAPIUIRRIMTKD-UHFFFAOYSA-N	318.420	4.649	5	20	DJBD	
CC[C@@H](C)Oc1ccc(N[C@@H](C)c2ccccc2[N+](=O)[O-])cc1	743473380	WGRBQRZAZOWFOY-KGLIPLIRSA-N	314.385	4.945	5	20	DJBD	
CC[C@@H](Nc1ccc(C(C)=O)cc1[N+](=O)[O-])c1ccc(C)cc1	7981003	NCGCGMVFNCXGTP-MRXNPFEDSA-N	312.369	4.669	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)SCc1c(C)noc1C	180682210	KRTCJIQITXYYSX-LBPRGKRZSA-N	306.387	4.502	5	20	DJBD	
Cc1ccc(N[C@@H](C)c2cccc([N+](=O)[O-])c2)c2cccnc12	320255616	YKUBTOPGMUAHIT-ZDUSSCGKSA-N	307.353	4.625	5	20	DJBD	
Cc1cnc(Oc2ccc(C3CC3)cc2Cl)c([N+](=O)[O-])c1	432177323	IPIAZRUEZGSEAW-UHFFFAOYSA-N	304.733	4.621	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1CCCc2ccccc21	532442735	URIJFDGNIZUSGY-LIRRHRJNSA-N	310.397	4.631	5	20	DJBD	
O=[N+]([O-])c1ccc(C(F)(F)F)c(CSCc2ccco2)c1	558809301	USLGYALESZDKNQ-UHFFFAOYSA-N	317.288	4.640	5	20	DJBD	
CC(C)c1ccc(CNC(C)(C)c2ccccc2)cc1[N+](=O)[O-]	604533006	PIPSKFQCMGXADG-UHFFFAOYSA-N	312.413	4.743	5	20	DJBD	
O=C(c1c2ccccc2cc2ccccc12)N1CC[C@H](C2CC2)C1	1323175662	BYVNWTHAMCQNFD-SFHVURJKSA-N	315.416	4.865	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H](C)c2cc(F)ccc2F)cc1[N+](=O)[O-]	78968606	LORSCBFNXIDBTM-NWDGAFQWSA-N	320.339	4.593	5	20	DJBD	
C/C(=C/c1ccc(-c2cccc([N+](=O)[O-])c2)s1)c1cnccn1	126559944	CBYDAAVXEMEZFU-XFXZXTDPSA-N	323.377	4.674	5	20	DJBD	
O=[N+]([O-])c1ccc(N[C@@H](c2ccc(Cl)cc2)C2CCC2)nc1	303150787	CPKYASFZKUAPIZ-MRXNPFEDSA-N	317.776	4.597	5	20	DJBD	
O=[N+]([O-])c1cccc(-c2nc3cc(Cl)ccc3n2C2CC2)c1	513854992	YALQEOJBYRLGDY-UHFFFAOYSA-N	313.744	4.600	5	20	DJBD	
CSc1ccc(COc2ccc([N+](=O)[O-])cc2Cl)cc1	619569940	OEDHFLVQFCWTQO-UHFFFAOYSA-N	309.774	4.549	5	20	DJBD	
CC[C@]1(C)CCN(C(=O)c2cc3ccccc3c3cccnc23)C1	468259872	IRQMTGYQDBOYET-OAQYLSRUSA-N	318.420	4.650	5	20	DJBD	
Cc1cc(N[C@@H](c2ccc(Cl)cc2)C(C)C)ncc1[N+](=O)[O-]	470869434	CWLAFQCBQOXKQT-MRXNPFEDSA-N	319.792	4.761	5	20	DJBD	
CCC[C@H](NCc1cc(F)cc(F)c1)c1cccc([N+](=O)[O-])c1	480241741	OFMMBZCQWDEZFO-KRWDZBQOSA-N	320.339	4.504	5	20	DJBD	
CC[C@H](Sc1ncccc1[N+](=O)[O-])c1ccc(Cl)cc1	494133199	ORMGLWGFBDFOPY-ZDUSSCGKSA-N	308.790	4.887	5	20	DJBD	
CC[C@@](C)(NCc1cc(Cl)ccc1[N+](=O)[O-])c1ccccc1	775390195	JRYQFTQOUJIXIX-QGZVFWFLSA-N	318.804	4.663	5	20	DJBD	
O=C(C[C@H]1C=CCC1)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-]	920329690	NSHOFXLMAILMEF-AWEZNQCLSA-N	323.348	4.524	5	20	DJBD	
C[C@H](N[C@H]1CCc2sc(Cl)cc21)c1cccc([N+](=O)[O-])c1	123378291	RTBBNFICGOYAPM-ZANVPECISA-N	322.817	4.648	5	20	DJBD	
CC(=O)c1ccc2cc(OCc3ccc([N+](=O)[O-])cc3)ccc2c1	482713083	DEMIRXAYDAKNMZ-UHFFFAOYSA-N	321.332	4.530	5	20	DJBD	
Cc1ccc2c(c1)CC[C@H]2N[C@@H](C)c1cccc([N+](=O)[O-])c1C	536825188	FNAMVLXVVSUIPP-KBXCAEBGSA-N	310.397	4.550	5	20	DJBD	
CCC[C@@H](NCc1cc2ccccc2o1)c1cccc([N+](=O)[O-])c1	539089777	HYQXMZJDURPTEN-GOSISDBHSA-N	324.380	4.972	5	20	DJBD	
CCCC[C@@H](CC)C(=O)Nc1cc([N+](=O)[O-])c(Cl)cc1C	741934912	QNWCMCAIGNVJPV-LLVKDONJSA-N	312.797	4.712	5	20	DJBD	
O=[N+]([O-])c1c(F)cccc1NCc1ccc(-c2ccccc2)o1	919963522	XUXCSQFJETZROZ-UHFFFAOYSA-N	312.300	4.606	5	20	DJBD	
c1ccc2c(CNC[C@@H]3CCCCO3)c3ccccc3cc2c1	920414139	MPMCBEVRZOAQJP-SFHVURJKSA-N	305.421	4.652	5	20	DJBD	
Cc1ccc(NCc2ccc(Cl)cc2[N+](=O)[O-])c(Cl)c1	50443314	UYODUYRXQJLDRG-UHFFFAOYSA-N	311.168	4.822	5	20	DJBD	
CCC[C@H](NCc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F	181676131	ARCKPBADWLRBON-INIZCTEOSA-N	320.339	4.504	5	20	DJBD	
CCC[C@H](NCc1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1	314044030	FMKVGZXDKNKERW-KRWDZBQOSA-N	318.804	4.879	5	20	DJBD	
Cc1ccc([C@H](C)Nc2ccc3cc([N+](=O)[O-])ccc3n2)cc1	320462941	ZRVDJEWDOAFWEW-ZDUSSCGKSA-N	307.353	4.625	5	20	DJBD	
Cc1c([C@@H](C)Nc2ccc3ccn(C)c3c2)cccc1[N+](=O)[O-]	443093403	MCKGCHIFPFQJDL-CYBMUJFWSA-N	309.369	4.568	5	20	DJBD	
O=Cc1cc([N+](=O)[O-])ccc1Oc1ccc(-c2ccccc2)cc1	98179813	LKCSOPYJOGYBNE-UHFFFAOYSA-N	319.316	4.867	5	20	DJBD	
C[C@@H](N[C@@H]1CC(C)(C)Cc2occc21)c1cccc([N+](=O)[O-])c1	155792690	FSDKQQBHXHJECM-MLGOLLRUSA-N	314.385	4.552	5	20	DJBD	
Clc1c2ccccc2c(CNCc2cc[nH]n2)c2ccccc12	174365914	JLCATWHMXCHZPE-UHFFFAOYSA-N	321.811	4.659	5	20	DJBD	
O=[N+]([O-])c1cc(CNc2ccccc2OC2CCCC2)cs1	237979592	VOLYMBBZWQEZCW-UHFFFAOYSA-N	318.398	4.590	5	20	DJBD	
Cc1cc([N+](=O)[O-])ccc1NCCCCCCCCCC(=O)O	1777427548	RLYRUROHYITYGX-UHFFFAOYSA-N	322.405	4.521	5	20	DJBD	
CC(C)(C)[C@H](NCc1ccccc1[N+](=O)[O-])c1ccc(F)cc1	42800678	IZALXHKNZLNXSV-QGZVFWFLSA-N	316.376	4.611	5	20	DJBD	
CC[C@@H](N[C@H](C)c1ccc(F)cc1F)c1cccc([N+](=O)[O-])c1	121495133	JCMHALXWYPBMSG-PIGZYNQJSA-N	320.339	4.675	5	20	DJBD	
Cc1oc2ccccc2c1CN[C@@H](C)c1ccc([N+](=O)[O-])cc1	185047177	WVIIALUZEQKQBB-LBPRGKRZSA-N	310.353	4.500	5	20	DJBD	
O=[N+]([O-])c1cccc(CNc2ccccc2Cc2ccccc2)c1	302833720	PYRFKPRFSXYJDO-UHFFFAOYSA-N	318.376	4.798	5	20	DJBD	
Cc1cc(CNc2ccc([N+](=O)[O-])cc2)c2[nH]c(C)c(C)c2c1	480334302	NPFRDIKSKHUDBO-UHFFFAOYSA-N	309.369	4.613	5	20	DJBD	
CSc1cccc(N[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1	540709340	LOLRHZSICZSZGR-LBPRGKRZSA-N	302.399	4.798	5	20	DJBD	
O=[N+]([O-])c1ccc(/C=C/c2nc3cc(Cl)ccc3o2)s1	541076132	RKXCPUNMTVUYHD-GORDUTHDSA-N	306.730	4.621	5	20	DJBD	
Cc1c(CN[C@@H](C)c2cccc(C3CC3)c2)cccc1[N+](=O)[O-]	556179795	XNWYIJJZMSNDMK-AWEZNQCLSA-N	310.397	4.631	5	20	DJBD	
Cc1cc([N+](=O)[O-])cnc1N[C@H](C)c1oc2ccccc2c1C	301194381	NLUYNTHUUWIFSO-GFCCVEGCSA-N	311.341	4.526	5	20	DJBD	
Cc1c(CNc2ccc(SC(F)F)cc2)cccc1[N+](=O)[O-]	742256142	BPMZHMPRXWOAKG-UHFFFAOYSA-N	324.352	4.830	5	20	DJBD	
C[C@@H](c1cccc([N+](=O)[O-])c1)c1nc(C2CCCCCC2)no1	904685333	JARSGCYODJPYPU-LBPRGKRZSA-N	315.373	4.567	5	20	DJBD	
Cc1c(CN[C@H](C)c2ccc3ccccc3c2)cccc1[N+](=O)[O-]	326361616	HCENABZWMFLCQG-OAHLLOKOSA-N	320.392	4.907	5	20	DJBD	
Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)[C@H](C)CC1CCCC1	736159748	ZTLDCGCQHBDKSW-LLVKDONJSA-N	324.808	4.712	5	20	DJBD	
CCN(Cc1cccc([N+](=O)[O-])c1)[C@@H](C)c1cc2ccccc2o1	64349242	QNXSOTXYSOBLQC-AWEZNQCLSA-N	324.380	4.924	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@@H]2CCCc3sccc32)cc1[N+](=O)[O-]	102196723	NZIUHXNDNJKDLD-IUODEOHRSA-N	316.426	4.693	5	20	DJBD	
Cc1ccc([C@H](C)NC2CC(c3ccccc3)C2)cc1[N+](=O)[O-]	467448694	MPLQOIFUPCNGOW-NNGSBXSVSA-N	310.397	4.500	5	20	DJBD	
CC[C@@H](N[C@@H](c1cccs1)C1CC1)c1cccc([N+](=O)[O-])c1	480238162	ASJVMWZJCMGWLD-NVXWUHKLSA-N	316.426	4.848	5	20	DJBD	
Cc1c(CSCc2nc(C3CC3)cs2)cccc1[N+](=O)[O-]	564248207	XWMJEEFOEPJKFS-UHFFFAOYSA-N	320.439	4.671	5	20	DJBD	
Cc1ccc(CN[C@H](C)c2cc3ccccc3o2)cc1[N+](=O)[O-]	72727138	LFDQBXZNENUWIH-CYBMUJFWSA-N	310.353	4.500	5	20	DJBD	
CCc1ccc([C@H](C)NCc2c(Cl)cccc2[N+](=O)[O-])cc1	319978856	XGLCTHSNYCDYFG-LBPRGKRZSA-N	318.804	4.661	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(OCc2ccccc2C(F)(F)F)c1	619849175	VUPJRAKUGFXTFV-UHFFFAOYSA-N	311.259	4.501	5	20	DJBD	
C/C=C\c1ccc(NCc2c(F)cc([N+](=O)[O-])cc2F)cc1	580360021	SMYOZWGUFZFCAJ-IHWYPQMZSA-N	304.296	4.518	5	20	DJBD	
O=[N+]([O-])c1ccc(CN2CCC[C@@H]2c2cccc(Cl)c2)cc1	603855262	LLDWYIKPRIXBLP-QGZVFWFLSA-N	316.788	4.585	5	20	DJBD	
O=[N+]([O-])c1cccc(CN2CCC[C@@H]2c2ccccc2Cl)c1	603857068	PRNQFPJDEGOMOA-QGZVFWFLSA-N	316.788	4.585	5	20	DJBD	
CCc1ccc(Oc2ccc([N+](=O)[O-])cc2Cl)c([N+](=O)[O-])c1	734484088	WKELCOHIZDEHOV-UHFFFAOYSA-N	322.704	4.511	5	20	DJBD	
CC(C)[C@@H](NCc1cc(Cl)ccc1[N+](=O)[O-])c1ccccc1	746652319	GWPSDXSTTRSCOU-QGZVFWFLSA-N	318.804	4.735	5	20	DJBD	
C[C@H](N[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccccc1	433149357	ISLOWJWATIUGKT-SCLBCKFNSA-N	310.397	4.668	5	20	DJBD	
C/C(=C\c1cccc([N+](=O)[O-])c1)CN(C)[C@@H](C)c1cccs1	470176651	XRJGWFYNMRGVOG-UELRPHRMSA-N	316.426	4.753	5	20	DJBD	
Cc1cccc2c1[C@@H](C)C[C@@H]2NCc1cccc([N+](=O)[O-])c1C	478499970	TUHNAXQGPJYQFZ-GUYCJALGSA-N	310.397	4.550	5	20	DJBD	
CCc1noc(C)c1CS[C@@H](C)c1cc([N+](=O)[O-])ccc1C	486081222	XUXYAUGQELUTDG-LBPRGKRZSA-N	320.414	4.756	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[C@@H]1c1cccc(F)c1	611516417	SYWPLXHGVBLCFM-FZKQIMNGSA-N	314.360	4.550	5	20	DJBD	
CC(C)c1cccc(NC(=O)c2cccc(Cl)c2[N+](=O)[O-])c1	175019634	OFBLCYDJGNSJDL-UHFFFAOYSA-N	318.760	4.624	5	20	DJBD	
O=[N+]([O-])c1ccc2c(c1)[C@@H](NCc1coc3ccccc13)CCC2	340451549	OELURDZEVNZMTR-SFHVURJKSA-N	322.364	4.508	5	20	DJBD	
Cc1cnc(N[C@H](C)c2oc3ccccc3c2C)c([N+](=O)[O-])c1	463047068	CCPSMDDZHHZRGN-GFCCVEGCSA-N	311.341	4.526	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1CCc2c(C)cccc21	540179570	XLMKWJBCDVFVKB-LIRRHRJNSA-N	310.397	4.550	5	20	DJBD	
C[C@@H](NC1CC=CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1	610832593	NCGRBOHKNISFLG-GFCCVEGCSA-N	314.410	4.693	5	20	DJBD	
O=[N+]([O-])c1ccc(-c2nnc(-c3cccc4ccccc34)o2)s1	1322345951	NDILOQSYAHOPKU-UHFFFAOYSA-N	323.333	4.527	5	20	DJBD	
O=[N+]([O-])c1c(Sc2cc(F)ccc2F)ccc2ncccc12	480397570	RDQYBDXEVGQAKA-UHFFFAOYSA-N	318.304	4.572	5	20	DJBD	
CC[C@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1	1320209442	UJLFFODGKZSTOI-PXAZEXFGSA-N	302.349	4.536	5	20	DJBD	
Cc1ccc(C[C@H](C)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1	315330307	VSNAZPNLNLHCHZ-JSGCOSHPSA-N	318.442	4.555	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](c1ccccc1)C(C)C	485799933	KKIHFMNSRDBPSH-KXBFYZLASA-N	312.413	4.951	5	20	DJBD	
CC(C)(C)Oc1cc(F)ccc1NCc1ccccc1[N+](=O)[O-]	498407866	BBXZSDPCCIDKOT-UHFFFAOYSA-N	318.348	4.523	5	20	DJBD	
O=[N+]([O-])c1ccc(/C=C/c2nc3ccccc3o2)cc1Cl	763176199	SHBFCZUTUDDEBF-SOFGYWHQSA-N	300.701	4.560	5	20	DJBD	
Cc1ccc(NCc2cccc([N+](=O)[O-])c2C)cc1OC(C)C	864027144	TVKKQDDEXYWEHX-UHFFFAOYSA-N	314.385	4.611	5	20	DJBD	
C[C@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)c1csc(Cl)c1	903287002	LSLVADASFIQLTK-ZJUUUORDSA-N	310.806	4.722	5	20	DJBD	
C[C@H](NCc1c(F)cccc1[N+](=O)[O-])c1cccc2ccccc12	181664916	BWDRXRGNQDMYIR-ZDUSSCGKSA-N	324.355	4.738	5	20	DJBD	
CCC[C@@H](Nc1cccc(OC)c1)c1cccc([N+](=O)[O-])c1	314010597	GGLUNVYLAOQJNU-QGZVFWFLSA-N	300.358	4.557	5	20	DJBD	
C[C@H](Nc1ccc([N+](=O)[O-])cc1)c1ccccc1C(F)(F)F	315179379	JBYPUBDXLQWWRL-JTQLQIEISA-N	310.275	4.787	5	20	DJBD	
C[C@H](SCc1ccc([N+](=O)[O-])cc1)c1c(F)cccc1F	604434593	LUKBWAMHVHUROF-JTQLQIEISA-N	309.337	4.867	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@@H]1c1cccc(F)c1	611516418	SYWPLXHGVBLCFM-SCLBCKFNSA-N	314.360	4.550	5	20	DJBD	
C[C@@H](Sc1ncc([N+](=O)[O-])cc1Cl)c1cccs1	737423690	VUMHQLRPYGBJCR-SSDOTTSWSA-N	300.792	4.558	5	20	DJBD	
Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)CCCCC(C)(C)C	808810086	XTTVDTPVPHGXMQ-UHFFFAOYSA-N	310.369	4.587	5	20	DJBD	
Cc1nc([C@@H](C)NCc2c3ccccc3cc3ccccc23)no1	1325734221	RAAWKIMYTFXDEV-CYBMUJFWSA-N	317.392	4.535	5	20	DJBD	
CCC[C@@H](NCc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F	181676154	ARCKPBADWLRBON-MRXNPFEDSA-N	320.339	4.504	5	20	DJBD	
CSc1ccccc1[C@H](C)N[C@H](C)c1cccc([N+](=O)[O-])c1	194866930	WNUVVEUWJKOVDB-OLZOCXBDSA-N	316.426	4.729	5	20	DJBD	
Cc1cnc([C@H](Nc2ccc([N+](=O)[O-])cc2Cl)C2CC2)s1	301370083	SBSCEUXMZMSEQC-CYBMUJFWSA-N	323.805	4.576	5	20	DJBD	
CCC[C@H](NCc1cc(F)ccc1F)c1cccc([N+](=O)[O-])c1	320418419	JCNSLCNAJXYDLX-KRWDZBQOSA-N	320.339	4.504	5	20	DJBD	
Cc1ccccc1[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)C(C)C	531711647	LBONXRCWBDHRQT-KXBFYZLASA-N	312.413	4.951	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)SCc1cc(C2CC2)no1	596403910	AHYSJBDSPPBJFU-NSHDSACASA-N	318.398	4.763	5	20	DJBD	
C[C@H](Nc1ccc2nc(C3CC3)oc2c1)c1cccc([N+](=O)[O-])c1	182895996	HUQCTGBQHFEBFL-NSHDSACASA-N	323.352	4.787	5	20	DJBD	
Cc1ccc(C)c([C@@H](C)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1	319687774	BHXZNLPWWJRSEO-JKSUJKDBSA-N	312.413	4.932	5	20	DJBD	
CC(=O)c1ccc(N[C@@H](c2ccccc2C)C2CC2)c([N+](=O)[O-])c1	488275330	YNNFQXBPMAHALH-LJQANCHMSA-N	324.380	4.669	5	20	DJBD	
CCC[C@@H](NCc1c(F)cc([N+](=O)[O-])cc1F)c1ccccc1	509036470	YKBXSGBSRAMVNY-QGZVFWFLSA-N	320.339	4.504	5	20	DJBD	
Cc1c([C@@H](C)Nc2ccccc2OC(F)F)cccc1[N+](=O)[O-]	562034725	SFNSQEXZBQOHSN-LLVKDONJSA-N	322.311	4.678	5	20	DJBD	
C[C@H](SCCOc1ccc([N+](=O)[O-])cc1)c1cccs1	737406956	SQXNFDCZOHTZJF-NSHDSACASA-N	309.412	4.530	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)cc1CN1CCC[C@H]1c1cccs1	746654670	QAYUMLLSZIYKBX-AWEZNQCLSA-N	322.817	4.647	5	20	DJBD	
COC(=O)[C@](C)(F)c1c(F)cc2c(ccc3ccccc32)c1F	98178039	KGNLZSMOKWUTPM-GOSISDBHSA-N	318.294	4.629	5	20	DJBD	
C[C@@H](NCc1ccc(-c2ccccc2)o1)c1cccc([N+](=O)[O-])c1	194061483	MXCHMJACGXCPEW-CQSZACIVSA-N	322.364	4.706	5	20	DJBD	
C[C@@H](Nc1cccc(C(F)(F)F)c1)c1ccccc1[N+](=O)[O-]	314286823	CAFJSYTXQZBFHZ-SNVBAGLBSA-N	310.275	4.787	5	20	DJBD	
CC[C@H](N[C@H]1C[C@H](c2ccccc2)C1)c1cccc([N+](=O)[O-])c1	436288122	FLNVLZMEFYDJPI-LNLFQRSKSA-N	310.397	4.582	5	20	DJBD	
O=[N+]([O-])c1cnc(Oc2ccc(OC3CCCCC3)cc2)s1	443524130	SBLZBMWRTCHLOK-UHFFFAOYSA-N	320.370	4.555	5	20	DJBD	
Cc1cccc(-c2ccc(CNc3ccc([N+](=O)[O-])cn3)cc2)c1	522759093	FISDRFRDJBOADD-UHFFFAOYSA-N	319.364	4.577	5	20	DJBD	
O=[N+]([O-])c1ccccc1CN(C1CC1)[C@H]1CCCc2ccccc21	552116205	HHNZKDWQSFLXTK-FQEVSTJZSA-N	322.408	4.637	5	20	DJBD	
CC(=O)c1cc(N[C@H](C)c2cccc(C)c2C)ccc1[N+](=O)[O-]	557602793	QVIXXVBPYTUYBJ-CYBMUJFWSA-N	312.369	4.587	5	20	DJBD	
COc1cc(C)c(N[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1F	775565196	FSSXJOPCMSIUMO-LBPRGKRZSA-N	318.348	4.532	5	20	DJBD	
CSc1ccc([C@H](C)Nc2ccc([N+](=O)[O-])cc2F)cc1	47873356	HAKGPAMCBRBMAL-JTQLQIEISA-N	306.362	4.629	5	20	DJBD	
C[C@H](SCc1ccc([N+](=O)[O-])cc1)c1ncc(C(C)(C)C)o1	131318107	FABWIVQAPCJPIU-NSHDSACASA-N	320.414	4.875	5	20	DJBD	
CCC[C@@H](NCc1ccc(F)c(F)c1)c1cccc([N+](=O)[O-])c1	320369217	IQLQKKXHOLPWGX-QGZVFWFLSA-N	320.339	4.504	5	20	DJBD	
O=[N+]([O-])c1cccc(F)c1COc1cccc(Cl)c1Cl	504529590	GOQLGZHTAYCZQZ-UHFFFAOYSA-N	316.115	4.620	5	20	DJBD	
Cc1cccc2c1CC[C@@H]2Nc1ccc([N+](=O)[O-])c2cnccc12	609193005	WPHSATRLPHBXJS-KRWDZBQOSA-N	319.364	4.551	5	20	DJBD	
O=[N+]([O-])c1sccc1NCc1ccccc1OC1CCCC1	63263154	PQQJHGQYEGNIGC-UHFFFAOYSA-N	318.398	4.590	5	20	DJBD	
C[C@H](N[C@H](C)c1c(F)cccc1Cl)c1ccccc1[N+](=O)[O-]	531443638	GGPZYFKMKOPHNV-WDEREUQCSA-N	322.767	4.799	5	20	DJBD	
CC[C@@H](NCc1cc2cc(C)ccc2o1)c1cccc([N+](=O)[O-])c1	561534058	LBIKNNCLFCHSFX-GOSISDBHSA-N	324.380	4.890	5	20	DJBD	
CC(C)c1ccc(CN[C@@H](c2ccccc2)C2CC2)cc1[N+](=O)[O-]	588330048	ZTQBSZWOISUESU-FQEVSTJZSA-N	324.424	4.959	5	20	DJBD	
Cc1cccc2c1CC[C@@H]2Nc1ccc2cc([N+](=O)[O-])ccc2n1	609192789	GOVLHQAJNKWTMN-SFHVURJKSA-N	319.364	4.551	5	20	DJBD	
COc1ccc2cc(NCc3ccc(C)c([N+](=O)[O-])c3)ccc2c1	796457707	GGKJLKBANCYSSN-UHFFFAOYSA-N	322.364	4.677	5	20	DJBD	
Cc1c([C@@H](C)N[C@@H](C)c2ccc(F)cc2F)cccc1[N+](=O)[O-]	153560744	JZKOEJXREWULGI-NEPJUHHUSA-N	320.339	4.593	5	20	DJBD	
O=[N+]([O-])c1ccc(/C(=C\c2ccccc2F)c2ccncc2)cc1	591673533	KGGLSZQFZJEHSD-QGOAFFKASA-N	320.323	4.718	5	20	DJBD	
CCC[C@H](CCO)CNCc1c2ccccc2cc2ccccc12	742709688	NCFUMVZLYCNPBI-QGZVFWFLSA-N	321.464	4.881	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)cc1CN1CCC[C@@H]1c1cccs1	746654674	QAYUMLLSZIYKBX-CQSZACIVSA-N	322.817	4.647	5	20	DJBD	
COc1ccc2cc(N[C@@H](C)c3cccc([N+](=O)[O-])c3)ccc2c1	797023585	WNMYBFWWMSOCQE-ZDUSSCGKSA-N	322.364	4.930	5	20	DJBD	
C[C@H](Nc1ccc([N+](=O)[O-])cc1F)c1ccc(Cl)c(F)c1	213767344	MEDRQVVCEMXHKI-QMMMGPOBSA-N	312.703	4.700	5	20	DJBD	
CC(C)[C@@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1	319770424	XEOIGLRCYHPCOU-FZKQIMNGSA-N	316.376	4.782	5	20	DJBD	
Cc1cccc(C)c1[C@@H](C)NCc1ccc([N+](=O)[O-])cc1Cl	545518777	WIZAMTYCVJCLAC-CYBMUJFWSA-N	318.804	4.716	5	20	DJBD	
CO[C@H](CS[C@@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1	583765646	AVWUNZOGBXLBDD-SUMWQHHRSA-N	317.410	4.777	5	20	DJBD	
O=[N+]([O-])c1cccc(CN2CCC[C@H]2c2cccc(Cl)c2)c1	603855529	YWYPXJBWMMFHPY-KRWDZBQOSA-N	316.788	4.585	5	20	DJBD	
COc1ccc2cc(N[C@H](C)c3ccccc3[N+](=O)[O-])ccc2c1	795325865	PVOWAXBCLDLPTQ-CYBMUJFWSA-N	322.364	4.930	5	20	DJBD	
c1ccc2c(CNCCC3CCOCC3)c3ccccc3cc2c1	1318837856	FOVQFARAMDOMJI-UHFFFAOYSA-N	319.448	4.899	5	20	DJBD	
C[C@H](NCc1ccc(C(C)(F)F)cc1)c1cccc([N+](=O)[O-])c1	293624910	GAFUDWFPOYTZFQ-LBPRGKRZSA-N	320.339	4.557	5	20	DJBD	
CC[C@H](Nc1ccc([N+](=O)[O-])c2cnccc12)c1cccs1	301089616	LAHCXUMLBIAOLQ-ZDUSSCGKSA-N	313.382	4.768	5	20	DJBD	
Cc1ccc2c(c1)[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)CCC2	426292694	OYWSIKYOLAGXKY-IFXJQAMLSA-N	310.397	4.631	5	20	DJBD	
Cc1oc2ccccc2c1CN[C@@H](C)c1cccc([N+](=O)[O-])c1C	468019324	GRQBMOOQZXDUNU-ZDUSSCGKSA-N	324.380	4.809	5	20	DJBD	
Cc1cccc(C)c1[C@@H](C)NCc1ccc(Cl)cc1[N+](=O)[O-]	546225946	TVFVLDUFSBSQHZ-CYBMUJFWSA-N	318.804	4.716	5	20	DJBD	
C[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1	19995576	QRMVPIIJCUGLII-RYUDHWBXSA-N	304.777	4.660	5	20	DJBD	
O=[N+]([O-])c1cc(C(F)(F)F)ccc1Oc1cccc(F)c1F	72098618	YENRKJJEZZNPQR-UHFFFAOYSA-N	319.185	4.684	5	20	DJBD	
CC[C@H](N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccccc1F	494020883	PQXJEUVHHJTOJV-GUYCJALGSA-N	316.376	4.844	5	20	DJBD	
CC(C)(C)c1ccc(-c2nnc(C3CCCC3)o2)cc1[N+](=O)[O-]	1345889785	OZIKMRGWIZCYHZ-UHFFFAOYSA-N	315.373	4.600	5	20	DJBD	
CCSc1cccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)c1	185473129	LXORAQMBZBWPJD-ZDUSSCGKSA-N	316.426	4.558	5	20	DJBD	
CC(C)Oc1ccc([N+](=O)[O-])cc1CSCCC(F)(F)F	478755054	RCXZTAOFYSLWLT-UHFFFAOYSA-N	323.336	4.568	5	20	DJBD	
O=[N+]([O-])c1ccc2nc(/C=C\c3scnc3C3CC3)ccc2c1	556056885	KGXIBZFKFQLOJZ-YVMONPNESA-N	323.377	4.647	5	20	DJBD	
C[C@@H]1C[C@@H](NCc2c3ccccc3cc3ccccc23)CCO1	769710750	PFFZYFYUZQEAMG-QAPCUYQASA-N	305.421	4.650	5	20	DJBD	
CC(C)N(Cc1cccc(Cl)c1)Cc1ccccc1[N+](=O)[O-]	59038132	JHVLLGXWSWQCTJ-UHFFFAOYSA-N	318.804	4.659	5	20	DJBD	
O=[N+]([O-])c1ccccc1CNc1ccc(-c2ccco2)cc1F	486796697	KQANJCLCDHSSGE-UHFFFAOYSA-N	312.300	4.606	5	20	DJBD	
C[C@H]1C[C@H](NCc2c3ccccc3cc3ccccc23)CCN1C	742374737	DXTCSOSZQZOAJM-QFBILLFUSA-N	318.464	4.565	5	20	DJBD	
CCC(CC)(CC)S[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-]	762969394	KFHMEXTYLQXSPA-LBPRGKRZSA-N	324.446	4.624	5	20	DJBD	
O=[N+]([O-])c1ccc(NC2CC(c3ccccc3)C2)c2ccncc12	476470100	OOFCXNZMTKBIIH-UHFFFAOYSA-N	319.364	4.501	5	20	DJBD	
O=[N+]([O-])c1cc(C(F)(F)F)ccc1Oc1cc(F)ccc1F	511458763	CWJKSAPVYQTYJS-UHFFFAOYSA-N	319.185	4.684	5	20	DJBD	
Cc1c([C@@H](C)Nc2ccc(OC(C)C)cc2)cccc1[N+](=O)[O-]	776812067	UBYLHWWHUKRBJD-CQSZACIVSA-N	314.385	4.864	5	20	DJBD	
CSc1cccc(NCc2ccc([N+](=O)[O-])c(Cl)c2)c1C	783652009	HNCRJHGOCZBIJG-UHFFFAOYSA-N	322.817	4.891	5	20	DJBD	
C[C@H](N[C@@H](C)c1cc2ccccc2o1)c1cccc([N+](=O)[O-])c1	152772674	MCRDJNBKYCRYFC-STQMWFEESA-N	310.353	4.753	5	20	DJBD	
Cc1c([C@@H](C)N[C@H](CC(F)(F)F)C(C)C)cccc1[N+](=O)[O-]	437092438	MCMNNGTTXSAMRG-DGCLKSJQSA-N	318.339	4.531	5	20	DJBD	
O=[N+]([O-])c1ccc(N[C@@H]2CC3(CCC3)Oc3ccccc32)s1	757792033	UZOWJWFQCGXFFQ-GFCCVEGCSA-N	316.382	4.515	5	20	DJBD	
Cc1c(CSc2ccnc3ccccc23)cccc1[N+](=O)[O-]	110657690	PYDSBFKMJKEWMK-UHFFFAOYSA-N	310.378	4.744	5	20	DJBD	
CCC(CC)N(CC(C)C)C(=O)Nc1cccc([N+](=O)[O-])c1C	483861940	QALPEYJBEMQKAG-UHFFFAOYSA-N	321.421	4.582	5	20	DJBD	
CCC[C@H](NCc1c(Cl)cccc1[N+](=O)[O-])c1ccccc1	494793221	JMJBPCZEXFYGEP-INIZCTEOSA-N	318.804	4.879	5	20	DJBD	
CO[C@@H](CSCc1cccc([N+](=O)[O-])c1C)c1ccccc1	573110144	VGSHOVGYQOJSCD-KRWDZBQOSA-N	317.410	4.524	5	20	DJBD	
O=[N+]([O-])c1ccccc1Oc1cccc(Oc2ccccn2)c1	602094340	SLAGFHCKOWYXHF-UHFFFAOYSA-N	308.293	4.574	5	20	DJBD	
CC(C)c1ccc(C(C)(C)NCc2ccccc2[N+](=O)[O-])cc1	609358283	YBFNIAFPDIHNCS-UHFFFAOYSA-N	312.413	4.743	5	20	DJBD	
C[C@@H](c1cc2ccccc2o1)N(C)Cc1cccc([N+](=O)[O-])c1	603459909	KMNLKIAJEGLDSF-ZDUSSCGKSA-N	310.353	4.534	5	20	DJBD	
C[C@@H](N[C@H]1CCc2ccc(Cl)cc21)c1ccc([N+](=O)[O-])cc1	858582075	MLFWIPWOZNGORA-DIFFPNOSSA-N	316.788	4.586	5	20	DJBD	
CCc1cc(NCc2ccc(Cl)cc2[N+](=O)[O-])ccc1F	864027558	GQWQDOXPJXPQRA-UHFFFAOYSA-N	308.740	4.562	5	20	DJBD	
C[C@@H](NCc1ccccc1[N+](=O)[O-])c1cc2ccccc2s1	184365716	PAWIRIJDFLDCQS-GFCCVEGCSA-N	312.394	4.660	5	20	DJBD	
CC(C)(C)OCc1cccc(CNc2ccccc2[N+](=O)[O-])c1	303182782	TXXWYOZTCIULAL-UHFFFAOYSA-N	314.385	4.522	5	20	DJBD	
Cc1cc(Cl)cc(CN[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1	569438134	ZURJZYMYMPKLDW-CYBMUJFWSA-N	318.804	4.716	5	20	DJBD	
CSc1ccc(N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1	20552947	MOXJNPSKPWQLSO-LBPRGKRZSA-N	302.399	4.798	5	20	DJBD	
CC(=O)c1cc(N[C@H](c2ccccc2)C(C)C)ccc1[N+](=O)[O-]	518801639	WQJKPKJAGXSCOY-SFHVURJKSA-N	312.369	4.607	5	20	DJBD	
CC[C@H](NC1(c2ccccc2)CCC1)c1cccc([N+](=O)[O-])c1	539668546	UPPAXASORXMLEC-SFHVURJKSA-N	310.397	4.715	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1CN1CCC[C@@H]1c1ccccc1	609705298	RVBSADQWDXVMRD-MRXNPFEDSA-N	316.788	4.585	5	20	DJBD	
Cc1cc(N[C@H](C)c2ccc(OC(F)F)cc2)ccc1[N+](=O)[O-]	321628557	VIJCBNBTZWIRHY-LLVKDONJSA-N	322.311	4.678	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)c1	321698763	ZQXMBMWHRFSAAE-HOTGVXAUSA-N	312.413	4.932	5	20	DJBD	
CCc1ccc([C@H](C)NCc2cc([N+](=O)[O-])ccc2Cl)s1	773041619	ROEFTCPGLGJKBA-JTQLQIEISA-N	324.833	4.723	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H](c1ccccc1)C1CC1	120383829	XIXSJSBINOLDHH-AUUYWEPGSA-N	310.397	4.705	5	20	DJBD	
O=[N+]([O-])c1ccc(CSc2nc(-c3ccccc3)co2)cc1	436244495	RYHDXDMMPZLDIL-UHFFFAOYSA-N	312.350	4.542	5	20	DJBD	
Cc1noc(CS[C@H](C)c2ccccc2Cl)c1[N+](=O)[O-]	596024723	XDFXDMSKDDFRNS-SECBINFHSA-N	312.778	4.539	5	20	DJBD	
O=[N+]([O-])c1cc(/C=C\c2nc(-c3ccccc3)cs2)cs1	603894493	ZJWMGOOLEYFMNO-SREVYHEPSA-N	314.391	4.950	5	20	DJBD	
Cc1ccc(NC(=O)c2cc3ccccc3c3cccnc23)cc1	642517950	LHEIVBUOVRDZAZ-UHFFFAOYSA-N	312.372	4.949	5	20	DJBD	
C[C@@]1(CNCc2c3ccccc3cc3ccccc23)CCOC1	733327229	BZNYETLHEHFMAR-NRFANRHFSA-N	305.421	4.509	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)c(CN2CCC[C@H]2c2ccsc2)c1	735491301	HWXBSIQGXVPQRT-HNNXBMFYSA-N	322.817	4.647	5	20	DJBD	
Cc1c(CN(C2CC2)[C@@H]2CCc3ccccc32)cccc1[N+](=O)[O-]	744195908	UCXCUAVUDGIHRG-HXUWFJFHSA-N	322.408	4.555	5	20	DJBD	
Cc1nc2cc(N[C@H](C)c3ccccc3[N+](=O)[O-])ccc2s1	781103557	TXRIIKQZKMPJSE-SNVBAGLBSA-N	313.382	4.686	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)Nc1ccc2scnc2c1	582880922	FZUQDMINUKWLPN-LLVKDONJSA-N	313.382	4.686	5	20	DJBD	
CC[C@@H](Nc1cccc(OC(F)F)c1)c1cccc([N+](=O)[O-])c1	319761481	DNBUCSFGBGXIDA-OAHLLOKOSA-N	322.311	4.759	5	20	DJBD	
CC[C@H](N[C@@H](c1cccs1)C1CC1)c1cccc([N+](=O)[O-])c1	480238161	ASJVMWZJCMGWLD-DOTOQJQBSA-N	316.426	4.848	5	20	DJBD	
O=[N+]([O-])c1ccc(-c2nc(-c3cccc(F)c3)cs2)cc1	603951898	PCKXWMDGMVINLX-UHFFFAOYSA-N	300.314	4.524	5	20	DJBD	
O=[N+]([O-])c1ccccc1/C=C/CN1CCC[C@H]1c1cccs1	506112055	GJLYNYHLMXJHEP-SEJWUHKESA-N	314.410	4.507	5	20	DJBD	
CC(C)(C)Nc1ccccc1NCc1ccc(F)cc1[N+](=O)[O-]	853061374	ZRNWEDGBCFJDIM-UHFFFAOYSA-N	317.364	4.556	5	20	DJBD	
Cc1ccc(C)c2c(C)c(C(=O)Nc3cccc([N+](=O)[O-])c3)oc12	65890214	BKQBVGKOFHOPCB-UHFFFAOYSA-N	324.336	4.519	5	20	DJBD	
Cc1ccc([C@H](C)N[C@@H](C)c2c(F)cccc2F)cc1[N+](=O)[O-]	79723067	KGPAQHMSYXIRCE-RYUDHWBXSA-N	320.339	4.593	5	20	DJBD	
CCC[C@@H](NCc1cscc1C)c1cccc([N+](=O)[O-])c1	94877592	OCYODCOXWZGPCN-MRXNPFEDSA-N	304.415	4.596	5	20	DJBD	
CC[C@@H](N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccc(F)cc1	531205110	WRUIZTWMXOJKTK-SUMWQHHRSA-N	316.376	4.844	5	20	DJBD	
O=[N+]([O-])c1cccc(-c2noc(-c3cccc4ccsc34)n2)c1	569388398	TXLHKSBYITYLGN-UHFFFAOYSA-N	323.333	4.527	5	20	DJBD	
CSCc1ccc(N[C@H]2CCc3c2cccc3[N+](=O)[O-])cc1	573933438	GFIKMYLKUKTAIH-INIZCTEOSA-N	314.410	4.557	5	20	DJBD	
Cc1ccc2c(c1)[C@H](Nc1ccc([N+](=O)[O-])c3cnccc13)CC2	609288151	BSSVBXSSJBYJFH-GOSISDBHSA-N	319.364	4.551	5	20	DJBD	
Cc1cccc(NC(=O)Nc2cccc([N+](=O)[O-])c2Cl)c1C	809917436	HUTGEMCKIVFWPU-UHFFFAOYSA-N	319.748	4.509	5	20	DJBD	
CCOc1ccc(NCc2ccc(Cl)cc2[N+](=O)[O-])c(C)c1	864006780	RCPWHHUMFVYTBP-UHFFFAOYSA-N	320.776	4.567	5	20	DJBD	
O=C(c1c2ccccc2cc2ccccc12)N1CC[C@@H](C2CC2)C1	1323175661	BYVNWTHAMCQNFD-GOSISDBHSA-N	315.416	4.865	5	20	DJBD	
CC[C@H](Nc1ccc(SC)cc1)c1cccc([N+](=O)[O-])c1	37010407	GSLSRLSKKAKUIT-INIZCTEOSA-N	302.399	4.880	5	20	DJBD	
O=[N+]([O-])c1cc(F)ccc1N[C@H]1CCSc2ccc(F)cc21	216291270	HQUBREUERVTXPC-LBPRGKRZSA-N	322.336	4.522	5	20	DJBD	
C[C@@H](NC/C=C\c1ccccc1[N+](=O)[O-])c1cc2ccccc2o1	442986910	BQLZDDFOPRYHKB-DEBLGDTFSA-N	322.364	4.705	5	20	DJBD	
Cc1ccc(CN[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1Cl	443995654	RKBBKOHDZJPIIZ-CYBMUJFWSA-N	318.804	4.716	5	20	DJBD	
Cc1cc2cc(Nc3ccc([N+](=O)[O-])c4cnccc34)ccc2[nH]1	513103198	RUSMNAFKOFBDAK-UHFFFAOYSA-N	318.336	4.676	5	20	DJBD	
Cc1cc([C@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc(C)c1F	536807226	RQOZZYHECDKSNL-KGLIPLIRSA-N	316.376	4.763	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H]1CCc2c(C)cccc21	540179567	XLMKWJBCDVFVKB-AUUYWEPGSA-N	310.397	4.550	5	20	DJBD	
Cc1ccc(/C=C(\Cl)c2nc3cc([N+](=O)[O-])ccc3o2)cc1	751518698	YPPWNGPZNMOHEI-JYRVWZFOSA-N	314.728	4.781	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1NCc1ccc(Cl)s1	35230959	JEJZPDUIRDFQBW-UHFFFAOYSA-N	303.170	4.575	5	20	DJBD	
Oc1nc(Cc2cccc(Cl)c2)nc2cc3ccccc3cc12	614115961	SWTLIQCPOYBXTR-UHFFFAOYSA-N	320.779	4.733	5	20	DJBD	
O=[N+]([O-])c1ccc(/C=C\c2nc3ccccc3o2)cc1Cl	763176202	SHBFCZUTUDDEBF-VURMDHGXSA-N	300.701	4.560	5	20	DJBD	
CC[C@@H](NCc1cc(F)ccc1[N+](=O)[O-])c1cccc(Cl)c1	774875166	KMNRRPNKXQXJHT-OAHLLOKOSA-N	322.767	4.628	5	20	DJBD	
C[C@H](N[C@@H](c1ccccc1)C1CCC1)c1ccccc1[N+](=O)[O-]	72608730	DXUOQEWIRHCKKS-LIRRHRJNSA-N	310.397	4.787	5	20	DJBD	
Cc1cc([C@H](C)NCc2c(Cl)cccc2[N+](=O)[O-])c(C)s1	107904539	JBNIXUNSNLZQDC-JTQLQIEISA-N	324.833	4.777	5	20	DJBD	
C[C@H](SCc1ccc([N+](=O)[O-])cc1)c1nc2ccccc2o1	182386944	UBXICJTZUQIGFU-NSHDSACASA-N	314.366	4.730	5	20	DJBD	
C[C@H](SCc1ccccc1[N+](=O)[O-])c1nc2ccccc2o1	183434171	SUCOBOADKVLTOT-NSHDSACASA-N	314.366	4.730	5	20	DJBD	
COCc1cc([N+](=O)[O-])ccc1N[C@@H](C)c1c(C)cccc1C	302243095	YVVHCQZKIAYPFY-AWEZNQCLSA-N	314.385	4.531	5	20	DJBD	
C[C@@H](SCc1ccccc1[N+](=O)[O-])c1cc(F)ccc1F	517939420	MKFPERYMVCQDOK-SNVBAGLBSA-N	309.337	4.867	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)SCc1cc(C2CC2)no1	596403908	AHYSJBDSPPBJFU-LLVKDONJSA-N	318.398	4.763	5	20	DJBD	
C[C@H](Nc1cccc2ccsc12)c1ccc(N)c([N+](=O)[O-])c1	815614669	YBSAFBBHRBKHGN-JTQLQIEISA-N	313.382	4.565	5	20	DJBD	
CC[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1	79723729	XMDOEPDYJWKGCB-SJCJKPOMSA-N	302.349	4.536	5	20	DJBD	
CCN(Cc1c[nH]c2ccccc12)[C@@H](C)c1cccc([N+](=O)[O-])c1	442882704	SBXYLNXGRKUUDJ-AWEZNQCLSA-N	323.396	4.659	5	20	DJBD	
CC(C)n1ncc2cc(N[C@@H](C)c3ccc([N+](=O)[O-])cc3)ccc21	611482980	OWWFKPRLIVVPDT-ZDUSSCGKSA-N	324.384	4.699	5	20	DJBD	
CC(C)Oc1ccc(N[C@@H](C)c2cccc([N+](=O)[O-])c2)c(F)c1	777290209	IEBMUNWEYDLIPZ-LBPRGKRZSA-N	318.348	4.694	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H](C)c2cc(C)c(C)o2)cc1[N+](=O)[O-]	502467976	ZSSGLBRALSPPTC-CHWSQXEVSA-N	302.374	4.525	5	20	DJBD	
C[C@H](c1cccs1)N(C)Cc1ccc([N+](=O)[O-])cc1Cl	541064124	DMLFDGLXZIHLLT-SNVBAGLBSA-N	310.806	4.503	5	20	DJBD	
CC(C)c1cnc(SCc2cccc([N+](=O)[O-])c2)n1C(C)C	610033995	IJOHMYOVEKKEAZ-UHFFFAOYSA-N	319.430	4.788	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)SCc1ccc(Cl)cn1	1320017808	ZDSAUBYFDURBDP-NSHDSACASA-N	322.817	4.946	5	20	DJBD	
Cc1ccc([C@H](C)NCc2ccc(F)cc2Cl)cc1[N+](=O)[O-]	136290826	BXYJMRFMQNDVES-NSHDSACASA-N	322.767	4.547	5	20	DJBD	
O=[N+]([O-])c1cccc2c1ccn2Cc1cccc(C(F)(F)F)c1	322621200	PAVLSGRYGVGASC-UHFFFAOYSA-N	320.270	4.617	5	20	DJBD	
C/C(=C/c1cccc([N+](=O)[O-])c1)CN(C)[C@H](C)c1cccs1	470176650	XRJGWFYNMRGVOG-QLKUMGTLSA-N	316.426	4.753	5	20	DJBD	
Cc1ccc2c(c1)CC[C@@H]2N[C@H](C)c1cc([N+](=O)[O-])ccc1C	539042162	VWDQSIKVVRPIQH-KUHUBIRLSA-N	310.397	4.550	5	20	DJBD	
Cc1c([C@@H](C)NCc2coc3ccccc23)cccc1[N+](=O)[O-]	571349330	KSCUOVLLASPVDN-CYBMUJFWSA-N	310.353	4.500	5	20	DJBD	
C[C@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(Cl)cc1	582735119	CUQKMOBMGQNZAZ-ZBEGNZNMSA-N	316.788	4.586	5	20	DJBD	
CC(C)(C)CC(=O)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-]	920331429	ZGQATBUWRZEZRV-UHFFFAOYSA-N	313.353	4.603	5	20	DJBD	
Cc1cc([C@H](C)NCc2cc(Cl)ccc2[N+](=O)[O-])c(C)s1	93632824	SMTFYQNSXRTHKK-JTQLQIEISA-N	324.833	4.777	5	20	DJBD	
O=[N+]([O-])c1ccc(OCc2ccc(Cl)s2)c(Cl)c1	104580255	NCYRYBZMRSUYFI-UHFFFAOYSA-N	304.154	4.542	5	20	DJBD	
C[C@@H]1C[C@H]1[C@@H](Nc1ncc([N+](=O)[O-])s1)c1ccc(Cl)cc1	443523514	PITPPKWEPVJREV-DYLAAIIWSA-N	323.805	4.514	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H](C)c1c(F)cccc1F	492727979	LZROMRSMSPZYOA-VXGBXAGGSA-N	320.339	4.593	5	20	DJBD	
CC(C)[C@@H](NCc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1	533230132	JAYHCMWPWAMWIT-QGZVFWFLSA-N	318.804	4.735	5	20	DJBD	
CCCOc1ccc(N[C@@H](C)c2ccccc2[N+](=O)[O-])c(C)c1	742703373	JGFHAMHVHVBGKF-AWEZNQCLSA-N	314.385	4.865	5	20	DJBD	
O=[N+]([O-])c1ccc2oc(CSc3ccccc3Cl)nc2c1	434800833	CKSDXDFQJJLEMV-UHFFFAOYSA-N	320.757	4.682	5	20	DJBD	
CC(=O)c1cc(N[C@H](C)c2cc(C)cc(C)c2)ccc1[N+](=O)[O-]	553407920	FIHQOUZWVDZUPP-CYBMUJFWSA-N	312.369	4.587	5	20	DJBD	
Cc1c(CNc2ccc(CC(F)(F)F)cc2)cccc1[N+](=O)[O-]	172918621	QCTLRAGRTODHEY-UHFFFAOYSA-N	324.302	4.620	5	20	DJBD	
CC[C@@H](N[C@H](C)c1cccc(F)c1F)c1cccc([N+](=O)[O-])c1	179560091	SJSBXILCTQLOJJ-BDJLRTHQSA-N	320.339	4.675	5	20	DJBD	
Cc1ccc2cccc(N[C@@H](C)c3cccc([N+](=O)[O-])c3)c2n1	320437970	BRSKMGCVWAMZSA-ZDUSSCGKSA-N	307.353	4.625	5	20	DJBD	
O=[N+]([O-])c1ccc(SC(c2ccccc2)c2ccccc2)cn1	550709356	ACGPCFWAVNKSON-UHFFFAOYSA-N	322.389	4.872	5	20	DJBD	
CC(C)(NCc1ccc(C(F)F)cc1)c1ccc([N+](=O)[O-])cc1	578060853	HCWZDJXTURVMLL-UHFFFAOYSA-N	320.339	4.557	5	20	DJBD	
C[C@@H](N[C@H](C)c1ccc(Cl)c(F)c1)c1ccc([N+](=O)[O-])cc1	1254111253	SDIDRQLAALRRSP-GHMZBOCLSA-N	322.767	4.799	5	20	DJBD	
C[C@H](N[C@@H](C)c1cccc(Cl)c1)c1ccc([N+](=O)[O-])cc1	37177051	MQCQQVGDODLKPI-RYUDHWBXSA-N	304.777	4.660	5	20	DJBD	
Cc1c([C@@H](C)N[C@@H]2CCCc3ccccc32)cccc1[N+](=O)[O-]	531677928	XYJCASMELPHVIK-RDTXWAMCSA-N	310.397	4.631	5	20	DJBD	
COc1ccc([C@H](C)Nc2ccc([N+](=O)[O-])cc2Cl)cc1F	7903675	ZFTXWZVMLBQIGG-VIFPVBQESA-N	324.739	4.569	5	20	DJBD	
Cc1cc(S[C@@H](C)c2ccc(Cl)cc2)ncc1[N+](=O)[O-]	470866631	NHKLNHYGPHDZMM-JTQLQIEISA-N	308.790	4.805	5	20	DJBD	
C[C@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])c1cc2ccccc2o1	573020657	RRFLRSBZPQAMGS-LRDDRELGSA-N	322.364	4.679	5	20	DJBD	
Cc1ccc([C@@H](C)NCc2cc3c(C)cccc3[nH]2)cc1[N+](=O)[O-]	594940685	QTWYNMIEXWVPFP-CQSZACIVSA-N	323.396	4.544	5	20	DJBD	
C[C@@H](NCc1ccccc1[N+](=O)[O-])c1cccc2ccccc12	194783006	MXOLDDFDSRUFOP-CQSZACIVSA-N	306.365	4.599	5	20	DJBD	
CC(C)[C@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(F)cc1	390483853	MEPYYFZTZORCON-UGSOOPFHSA-N	316.376	4.782	5	20	DJBD	
Cc1cccc([C@H]2CCCN2Cc2cccc([N+](=O)[O-])c2C)c1	604013570	YKAMJRAWSSBEOW-LJQANCHMSA-N	310.397	4.549	5	20	DJBD	
COc1cc(C)c(N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1F	775565891	SAXCDPVQWJLLML-GFCCVEGCSA-N	318.348	4.532	5	20	DJBD	
CC(C)c1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1	492927567	IPDWVVCSZMHWLV-UHFFFAOYSA-N	324.336	4.717	5	20	DJBD	
COc1cccc(N[C@@H](C)c2cc3ccccc3o2)c1[N+](=O)[O-]	302620896	FHOSOLLHARHOIV-NSHDSACASA-N	312.325	4.523	5	20	DJBD	
O=C(c1cc2ccccc2c2cccnc12)N1[C@H]2CCC[C@H]1CC2	366617484	DLWDUWDMKLBXJH-HOTGVXAUSA-N	316.404	4.545	5	20	DJBD	
CC[C@H](Nc1ncc(C)cc1[N+](=O)[O-])c1ccc(Cl)s1	426905091	NIEDBWLSBUOQEY-VIFPVBQESA-N	311.794	4.576	5	20	DJBD	
C/C(=C\c1cccc([N+](=O)[O-])c1)CNC1CC(c2ccccc2)C1	466415906	WQGMPECMNMEBBD-XNTDXEJSSA-N	322.408	4.534	5	20	DJBD	
CC[C@@H](Nc1ccc([N+](=O)[O-])cc1)c1ccccc1OC(F)F	513135233	ICDMEASYRZSDMZ-CQSZACIVSA-N	322.311	4.759	5	20	DJBD	
CSc1cc(Cl)ccc1NCc1ccc([N+](=O)[O-])cc1	600858045	ZTTGMXGZGQHXGD-UHFFFAOYSA-N	308.790	4.582	5	20	DJBD	
O=[N+]([O-])c1ccc2nc(Oc3ccc(F)c(Cl)c3)sc2c1	111195302	NZEAZEGRPFIFAB-UHFFFAOYSA-N	324.720	4.789	5	20	DJBD	
Cc1cc([C@@H](C)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)o1	124889157	LQYFDMCECOWTBS-QWHCGFSZSA-N	302.374	4.525	5	20	DJBD	
C[C@@H](Sc1ncc(C(C)(C)C)o1)c1ccccc1[N+](=O)[O-]	474412567	MCRIYKQNMJXYSC-SNVBAGLBSA-N	306.387	4.734	5	20	DJBD	
CCC[C@H](CC)S[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C	477060278	CQIZXWOQXUKBNA-OLZOCXBDSA-N	324.446	4.542	5	20	DJBD	
CC(C)c1ccc(CNC(C)(C)c2ccccc2[N+](=O)[O-])cc1	492148913	CAMFFONRPXIDFS-UHFFFAOYSA-N	312.413	4.743	5	20	DJBD	
Cc1ccc(C[C@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2C)s1	531713032	YHVBFPYCLCOKTP-SMDDNHRTSA-N	318.442	4.555	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)Nc1cccc2ccncc12	538628230	PISOTHNHWGBAJN-ZDUSSCGKSA-N	307.353	4.625	5	20	DJBD	
CCC[C@H](N[C@H](CC)CC(F)(F)F)c1cccc([N+](=O)[O-])c1	546165330	DZTACNIHEOJEJJ-OCCSQVGLSA-N	318.339	4.757	5	20	DJBD	
O=[N+]([O-])c1ccccc1N1CCC[C@H]1c1ccccc1Cl	603870478	QARPRSPWDXFMOV-AWEZNQCLSA-N	302.761	4.590	5	20	DJBD	
Cc1ccc([C@H](C)N[C@H](C)c2cc3ccccc3[nH]2)cc1[N+](=O)[O-]	775630361	HOSUNGZTQNLLJG-UONOGXRCSA-N	323.396	4.796	5	20	DJBD	
O=[N+]([O-])c1cc(CNc2ccc(OC3CCCC3)cc2)cs1	237979858	FUTARJKHBAFZKR-UHFFFAOYSA-N	318.398	4.590	5	20	DJBD	
C[C@@H](Nc1ccc([N+](=O)[O-])cc1)c1nc(C(C)(C)C)cs1	301197019	OIAPFLUHEFBNHW-SNVBAGLBSA-N	305.403	4.522	5	20	DJBD	
Cc1ccc([C@@H]2CCCCCN2Cc2ccccc2[N+](=O)[O-])o1	303784273	TUSUZLDALUHAJJ-KRWDZBQOSA-N	314.385	4.614	5	20	DJBD	
CSc1ccc([C@@H](C)N[C@@H](C)c2ccccc2[N+](=O)[O-])cc1	315381507	DLPMSQMQAHNZJF-OLZOCXBDSA-N	316.426	4.729	5	20	DJBD	
Cc1cc2cc(C(=O)Nc3cc([N+](=O)[O-])ccc3C)oc2cc1C	463247251	MCRQHTMLCCXDCG-UHFFFAOYSA-N	324.336	4.519	5	20	DJBD	
Cc1ccccc1[C@H](NCc1ccccc1[N+](=O)[O-])C(C)(C)C	540458915	SKFWGQVSKWQTME-SFHVURJKSA-N	312.413	4.780	5	20	DJBD	
Cc1ccc(NCc2cc(Cl)ccc2[N+](=O)[O-])cc1Cl	93632383	AYJIYTIRODHGEC-UHFFFAOYSA-N	311.168	4.822	5	20	DJBD	
Cc1ccccc1[C@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)C1CC1	532510979	BFVFHSIOPRKZKE-AUUYWEPGSA-N	310.397	4.705	5	20	DJBD	
O=[N+]([O-])c1ccccc1CNc1ccccc1CCC(F)(F)F	89118894	IHYFVABVNOAXOA-UHFFFAOYSA-N	324.302	4.702	5	20	DJBD	
CCOCc1cccc(N[C@H](CC)c2cccc([N+](=O)[O-])c2)c1	182952763	FUQATBPNSYJHCA-GOSISDBHSA-N	314.385	4.695	5	20	DJBD	
O=[N+]([O-])c1ccc2c(c1)[C@H](Nc1cccc3ccncc13)CCC2	577932652	MAILUMNPAPANPR-GOSISDBHSA-N	319.364	4.633	5	20	DJBD	
CC(C)c1ccccc1OC(=O)c1cc(Cl)ccc1[N+](=O)[O-]	897904722	AMPZYYYNFZLXEH-UHFFFAOYSA-N	319.744	4.591	5	20	DJBD	
C[C@@H](N[C@H](C)c1ccc(F)cc1Cl)c1cccc([N+](=O)[O-])c1	119703603	ZITNNFPTOKCDJM-GHMZBOCLSA-N	322.767	4.799	5	20	DJBD	
O=[N+]([O-])c1cccc(CNc2ccccc2OC2CCCC2)c1	237993356	UKXPOINGNPIFLD-UHFFFAOYSA-N	312.369	4.528	5	20	DJBD	
Cc1cc([C@H](C)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)ccc1F	611336104	JCDGYDOCWKJTHV-KBPBESRZSA-N	316.376	4.763	5	20	DJBD	
Cc1cc(N[C@@H]2CCSc3ccc(F)cc32)ccc1[N+](=O)[O-]	195663388	LHJXRDFIJODZJT-CQSZACIVSA-N	318.373	4.691	5	20	DJBD	
C[C@H](Nc1ccc([N+](=O)[O-])cc1F)c1nc(C(C)(C)C)cs1	301173346	FJVRLPYXWIXRFR-VIFPVBQESA-N	323.393	4.661	5	20	DJBD	
CCN(Cc1ccc([N+](=O)[O-])cc1)[C@@H](C)c1cc2ccccc2o1	64348702	RDRSQASEWVUBLE-AWEZNQCLSA-N	324.380	4.924	5	20	DJBD	
CC[C@H](C)[C@@H](C)NC(=O)c1cc2ccccc2c2cccnc12	195646055	RQSRBLPHBPFJAK-UONOGXRCSA-N	306.409	4.552	5	20	DJBD	
Cc1c([C@H](C)N[C@H](CC(F)(F)F)C(C)C)cccc1[N+](=O)[O-]	437092441	MCMNNGTTXSAMRG-WCQYABFASA-N	318.339	4.531	5	20	DJBD	
CC[C@H](C)n1ncc(N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1C	477915185	IGYVJJDOCAJKOE-STQMWFEESA-N	316.405	4.552	5	20	DJBD	
Cc1c([C@@H](C)N[C@H](c2cccs2)C2CC2)cccc1[N+](=O)[O-]	480241485	PBMWJKICRMFFNW-PXAZEXFGSA-N	316.426	4.767	5	20	DJBD	
Cc1cccnc1COc1ccc(-c2ccccc2)cc1[N+](=O)[O-]	536738953	AVTJGZTVBUTZAB-UHFFFAOYSA-N	320.348	4.544	5	20	DJBD	
CCN(Cc1ccc(Cl)s1)Cc1cccc([N+](=O)[O-])c1C	603837647	XQNNMRTURLOQJL-UHFFFAOYSA-N	324.833	4.640	5	20	DJBD	
COc1cc(C)c(N[C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1F	775565520	LOZXUVVWEVHTFZ-LBPRGKRZSA-N	318.348	4.532	5	20	DJBD	
Cc1ccc(N[C@H]2CCSc3ccc(F)cc32)c([N+](=O)[O-])c1	1262673074	YEKUDWAMSYGHDU-ZDUSSCGKSA-N	318.373	4.691	5	20	DJBD	
C[C@@H](Nc1ccc(Br)cc1)c1ccccc1[N+](=O)[O-]	20526047	SZTQACHBOIAUEY-SNVBAGLBSA-N	321.174	4.530	5	20	DJBD	
Cc1cc(NCc2cccc([N+](=O)[O-])c2)ccc1C(F)(F)F	462186164	FYHKAQQFRGPTEQ-UHFFFAOYSA-N	310.275	4.534	5	20	DJBD	
Cc1cccc([C@@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2C)c1C	531711317	OROCDDDYXIRKPD-CVEARBPZSA-N	312.413	4.932	5	20	DJBD	
O=[N+]([O-])c1cccc(COc2ccccc2-c2ccccc2)c1	14738194	YYOBEBJVPXUBOZ-UHFFFAOYSA-N	305.333	4.841	5	20	DJBD	
CSc1cccc(N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1	21027750	LPOHLKDLGXRVTL-LBPRGKRZSA-N	302.399	4.798	5	20	DJBD	
Cc1cc([C@@H](C)NCc2ccc(Cl)cc2[N+](=O)[O-])c(C)s1	50443773	LCNVYDYKIJGKNF-SNVBAGLBSA-N	324.833	4.777	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)c(CN[C@H](c2cccs2)C2CC2)c1	748815980	MLYLMHIBIIUYRR-HNNXBMFYSA-N	322.817	4.551	5	20	DJBD	
O=[N+]([O-])c1cccnc1Oc1cccc(Oc2ccccc2)c1	7185839	NSFWXWHBZCBXFZ-UHFFFAOYSA-N	308.293	4.574	5	20	DJBD	
C[C@@H](NCc1ccc2ccccc2c1)c1cccc([N+](=O)[O-])c1	79723803	CCJXJQCDJWOYGZ-CQSZACIVSA-N	306.365	4.599	5	20	DJBD	
Cc1ccc([C@@H](C)NCc2ccc(Cl)cc2F)cc1[N+](=O)[O-]	187581940	WRLFFBOPIJQGJI-LLVKDONJSA-N	322.767	4.547	5	20	DJBD	
O=[N+]([O-])c1ccccc1CNc1ccc(Oc2ccccc2)cc1	323900621	YUAGYUKIHQCPNL-UHFFFAOYSA-N	320.348	4.999	5	20	DJBD	
C[C@H](Nc1ccccc1C(C)(F)F)c1ccc([N+](=O)[O-])cc1	453290436	LYRMOMIVQNXFMG-NSHDSACASA-N	306.312	4.880	5	20	DJBD	
Cc1cc(C)cc([C@H](C)N[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1	492849871	DTCJHRQQDRXFFI-HOTGVXAUSA-N	312.413	4.932	5	20	DJBD	
c1ccc2c(c1)nc(CSC[C@@H]1CCCO1)c1ccccc12	562337589	VAVYFKJKUSVHPD-AWEZNQCLSA-N	309.434	4.800	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H](C)c1ccccc1Cl	487947920	NJDZENKIXOEGSK-CHWSQXEVSA-N	318.804	4.968	5	20	DJBD	
Cc1cccc(C)c1[C@@H](C)NCc1c(Cl)cccc1[N+](=O)[O-]	494660021	DJGFOTZQGXWKIC-CYBMUJFWSA-N	318.804	4.716	5	20	DJBD	
COc1ccc(CSCCCCC(F)(F)F)cc1[N+](=O)[O-]	507633762	LESKKNMLBFAZTM-UHFFFAOYSA-N	323.336	4.569	5	20	DJBD	
C[C@@H](NCc1ccc(C2CCC2)cc1)c1cccc([N+](=O)[O-])c1	555524262	NKDQATAZZYJSPR-CQSZACIVSA-N	310.397	4.713	5	20	DJBD	
CC[C@H](N[C@@H](C)CCCC(F)(F)F)c1cccc([N+](=O)[O-])c1	480179881	MAPFGYRCWROJLD-FZMZJTMJSA-N	318.339	4.757	5	20	DJBD	
CC[C@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(F)cc1F	540339602	PISBYKZQECHDER-ZBEGNZNMSA-N	320.339	4.675	5	20	DJBD	
C/C=C/c1ccc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1	565976069	PBPIPJLNDIKUCT-DUXPYHPUSA-N	316.744	4.534	5	20	DJBD	
O=[N+]([O-])c1ccc(SCc2ccc3ccccc3n2)c(F)c1	613526342	IGWFVUMJIYFJCI-UHFFFAOYSA-N	314.341	4.574	5	20	DJBD	
O=[N+]([O-])c1cccc(/C=C\c2nc3cc(Cl)ccc3o2)c1	33466994	PGRJHOBCZITYQK-DAXSKMNVSA-N	300.701	4.560	5	20	DJBD	
CC[C@@H](Nc1ccc([N+](=O)[O-])cc1Cl)c1nc(C)cs1	301198656	OMZRJVZDNVSTEG-LLVKDONJSA-N	311.794	4.576	5	20	DJBD	
O=[N+]([O-])c1ccccc1CNc1ccc(-c2ccccc2)cc1	319624583	OQLZDPHWGLHPDH-UHFFFAOYSA-N	304.349	4.874	5	20	DJBD	
CC(C)(C)Oc1ccc(CNc2ccc([N+](=O)[O-])cc2F)cc1	604439521	YXNOMNUGAZZYSR-UHFFFAOYSA-N	318.348	4.523	5	20	DJBD	
CCCCOc1ccccc1NCc1cc(F)ccc1[N+](=O)[O-]	742261889	QLBUMCJKQMJFFM-UHFFFAOYSA-N	318.348	4.525	5	20	DJBD	
O=[N+]([O-])c1ccc(N2CCC[C@H]2c2cccc(Cl)c2)cc1	1317895062	DVRHNPYUIZCYLP-INIZCTEOSA-N	302.761	4.590	5	20	DJBD	
COCCCC[C@H](Nc1ccccc1[N+](=O)[O-])c1ccccc1	480557760	XEDRTCDSBSSIHO-INIZCTEOSA-N	314.385	4.565	5	20	DJBD	
C[C@@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1cccc(C2CC2)c1	550620378	ZWQWLNIWSXNHNG-ZIAGYGMSSA-N	310.397	4.884	5	20	DJBD	
O=[N+]([O-])c1ccc2sc(-c3nc(-c4ccccc4)no3)cc2c1	609473748	BUEZYFWISPZBGA-UHFFFAOYSA-N	323.333	4.527	5	20	DJBD	
Cc1ccc(/C=C(/c2ccncc2)c2ccc([N+](=O)[O-])cc2)cc1	215736807	FWSINPIBLDXZBX-XSFVSMFZSA-N	316.360	4.887	5	20	DJBD	
Cc1cc(C)cc([C@@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2C)c1	482658328	PUAVSTCDXIFXLZ-CVEARBPZSA-N	312.413	4.932	5	20	DJBD	
O=[N+]([O-])c1cccc(F)c1COc1c(Cl)cccc1Cl	504536111	LDJIXNXZDIXJML-UHFFFAOYSA-N	316.115	4.620	5	20	DJBD	
Cc1ccc2c(c1)CC[C@@H]2N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1	537941191	KRBGUPVJONHBIH-KDOFPFPSSA-N	310.397	4.550	5	20	DJBD	
Cc1cnc(CS[C@@H](C)c2cc([N+](=O)[O-])ccc2C)s1	778623925	SPDWEMQJXAPRAO-NSHDSACASA-N	308.428	4.663	5	20	DJBD	
Cc1c(CN[C@H](C)c2cc3ccccc3o2)cccc1[N+](=O)[O-]	182635141	ZZPDNGBUSGMOLN-CYBMUJFWSA-N	310.353	4.500	5	20	DJBD	
O=[N+]([O-])c1cccc(SCc2ncc(-c3cccs3)o2)c1	509695488	FJGDRFDEYKLXDR-UHFFFAOYSA-N	318.379	4.604	5	20	DJBD	
O=[N+]([O-])c1c(F)cccc1NCc1cccc(Cl)c1Cl	693696068	KEKLQORQLPUQKD-UHFFFAOYSA-N	315.131	4.653	5	20	DJBD	
C[C@H](Nc1ccc([N+](=O)[O-])s1)c1ccc(Cl)c(F)c1	1116428773	JBQYCFTXNKAFAB-ZETCQYMHSA-N	300.742	4.622	5	20	DJBD	
CCC[C@@H](N[C@@H]1CCCc2occc21)c1cccc([N+](=O)[O-])c1	120788184	DCOKRVOFEUHVIG-IAGOWNOFSA-N	314.385	4.696	5	20	DJBD	
C[C@H](Sc1ccc2ccccc2n1)c1ccccc1[N+](=O)[O-]	463027827	IYEAYYUKYMXFLW-LBPRGKRZSA-N	310.378	4.996	5	20	DJBD	
Cc1cc(Cl)cc(CNC(C)(C)c2ccccc2[N+](=O)[O-])c1	563901169	IVELZQPKKWVIDA-UHFFFAOYSA-N	318.804	4.582	5	20	DJBD	
CC[C@@H](Nc1cc(C)c([N+](=O)[O-])cn1)c1ccc(Cl)s1	426901426	SGCYMDNGIAUPJY-SECBINFHSA-N	311.794	4.576	5	20	DJBD	
CCC[C@@H](NCc1cc(F)cc(F)c1)c1cccc([N+](=O)[O-])c1	480241742	OFMMBZCQWDEZFO-QGZVFWFLSA-N	320.339	4.504	5	20	DJBD	
Cc1cc([C@@H](C)N[C@H](C)c2cc([N+](=O)[O-])ccc2C)c(C)s1	531943717	IDKYCIJQCYMOMZ-CHWSQXEVSA-N	318.442	4.993	5	20	DJBD	
CC(C)(C)OCc1ccc(NCc2cccc([N+](=O)[O-])c2)cc1	610613345	ZMXOUSBGTKRNSP-UHFFFAOYSA-N	314.385	4.522	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H](C)c2cc([N+](=O)[O-])ccc2C)s1	765305405	OWCLRAFIPSWYJN-CHWSQXEVSA-N	304.415	4.685	5	20	DJBD	
Cc1ccc(CN[C@@H](c2ccc(F)cc2)C(C)C)cc1[N+](=O)[O-]	61558077	MHDONTIEBDGQCN-GOSISDBHSA-N	316.376	4.529	5	20	DJBD	
Cc1ccc(Cl)c(Oc2ccc3ncccc3c2[N+](=O)[O-])c1	480436740	WNKWTTDFCHQBMJ-UHFFFAOYSA-N	314.728	4.897	5	20	DJBD	
Cc1c(CNc2ccc3oc(C4CC4)nc3c2)cccc1[N+](=O)[O-]	864003562	KYWVERJZRZHWPN-UHFFFAOYSA-N	323.352	4.534	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)c(/C=C/c2nc3ccccc3o2)c1	39302466	YANPWAMARSNYMC-VMPITWQZSA-N	300.701	4.560	5	20	DJBD	
Cc1ccc([C@@H](C)NCc2cccc(C(F)F)c2)cc1[N+](=O)[O-]	275785064	WLTSXWPZBZPJIW-GFCCVEGCSA-N	320.339	4.692	5	20	DJBD	
Cc1cc(C)c([C@@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1C	321075740	QMTAISFRMFNCQB-JKSUJKDBSA-N	312.413	4.932	5	20	DJBD	
O=[N+]([O-])c1ccc2c(c1)[C@H](NCc1coc3ccccc13)CCC2	340451545	OELURDZEVNZMTR-GOSISDBHSA-N	322.364	4.508	5	20	DJBD	
O=[N+]([O-])c1ccc(Cl)c(CSC2=Nc3ccccc3C2)c1	740766546	SNYYRJCQKQHXRW-UHFFFAOYSA-N	318.785	4.768	5	20	DJBD	
O=C(CC1CCCCCC1)Nc1cccc([N+](=O)[O-])c1Cl	813246101	XSQMHFSHSRKAAZ-UHFFFAOYSA-N	310.781	4.547	5	20	DJBD	
Cc1ccc2c(c1)[C@H](N[C@H]1CCCc3ccc([N+](=O)[O-])cc31)CC2	618571736	UBYBWMCOQQQALF-VQTJNVASSA-N	322.408	4.558	5	20	DJBD	
COc1cc(C)c(N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1F	775565892	SAXCDPVQWJLLML-LBPRGKRZSA-N	318.348	4.532	5	20	DJBD	
Cc1cc(F)ccc1[C@H](C)NCc1cc([N+](=O)[O-])ccc1Cl	815596009	IDPSDKKMTPSSJV-NSHDSACASA-N	322.767	4.547	5	20	DJBD	
O=[N+]([O-])c1ccc2sc(/C=C/c3ccc(F)c(F)c3)nc2c1	7746251	PYQIUFAWCXWLCO-QHHAFSJGSA-N	318.304	4.653	5	20	DJBD	
CC[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F	160789594	RWDXQCCZRYWLAA-GTNSWQLSSA-N	320.339	4.675	5	20	DJBD	
CCC1(C(=O)OCc2nc3ccccc3c3ccccc23)CC1	750481271	KIBOIPREVWQHMV-UHFFFAOYSA-N	305.377	4.621	5	20	DJBD	
Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)[C@@H](C)CC1CCCCC1	1339921999	ZMGZLZLBPFCXKX-NSHDSACASA-N	322.380	4.587	5	20	DJBD	
CCCCn1c(SCc2cccc([N+](=O)[O-])c2)nc(C)c1C	71834525	HKEGSMFGGCZJKZ-UHFFFAOYSA-N	319.430	4.501	5	20	DJBD	
C[C@H](N[C@H](c1ccccc1)C1CCC1)c1ccccc1[N+](=O)[O-]	72608735	DXUOQEWIRHCKKS-IFXJQAMLSA-N	310.397	4.787	5	20	DJBD	
Cc1cc([C@@H](C)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)s1	195614581	KJRUKNSTIIGHQJ-QWHCGFSZSA-N	318.442	4.993	5	20	DJBD	
O=[N+]([O-])c1ccc(/C=C/c2nc3cc(Cl)ccc3o2)cc1	8321193	AKDKJEGPMWYAIE-FPYGCLRLSA-N	300.701	4.560	5	20	DJBD	
O=[N+]([O-])c1ccc(NC(c2cccs2)c2cccs2)cc1	37299669	VEPPMJAEFJFUKU-UHFFFAOYSA-N	316.407	4.919	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1cc2cccc(C)c2o1	86624906	VNKWRGSKVSNVOT-UHFFFAOYSA-N	324.336	4.519	5	20	DJBD	
COc1ccccc1[C@@H](C)SCc1ccccc1[N+](=O)[O-]	140636146	NKVHXEXRSMQWQS-GFCCVEGCSA-N	303.383	4.598	5	20	DJBD	
O=[N+]([O-])c1ccc(CN(Cc2ccoc2)C2CCCCC2)cc1	303860250	GKOURSDSDJHSEI-UHFFFAOYSA-N	314.385	4.523	5	20	DJBD	
O=[N+]([O-])c1ccc(CSCc2ccc3ncccc3c2)cc1	545314253	IINCLPVJMIFHMJ-UHFFFAOYSA-N	310.378	4.576	5	20	DJBD	
CCCCS[C@@H](C)c1nc(-c2ccc(C)c([N+](=O)[O-])c2)no1	546987833	ILDCBPVKYAXPJW-NSHDSACASA-N	321.402	4.548	5	20	DJBD	
Cc1ccnc(COc2ccc(-c3ccccc3)cc2[N+](=O)[O-])c1	616210711	NJAOJIIFCCWRTC-UHFFFAOYSA-N	320.348	4.544	5	20	DJBD	
O=[N+]([O-])c1ccc(CNCc2ccc(C3CCCC3)cc2)cc1	462796245	LVKIWPWBWNJXSB-UHFFFAOYSA-N	310.397	4.542	5	20	DJBD	
O=[N+]([O-])c1cccc(Cl)c1CN1CCC[C@H]1c1cccs1	494161574	HRFZFKLCDSDFIQ-AWEZNQCLSA-N	322.817	4.647	5	20	DJBD	
C[C@H](NC1(c2ccc(Cl)cc2)CC1)c1ccc([N+](=O)[O-])cc1	578659941	LCVXWJYGIFMWNW-LBPRGKRZSA-N	316.788	4.588	5	20	DJBD	
Cc1ccc2c(c1)[C@@H](Nc1ccc([N+](=O)[O-])c3cnccc13)CC2	609288154	BSSVBXSSJBYJFH-SFHVURJKSA-N	319.364	4.551	5	20	DJBD	
CN(C(=O)c1cc2ccccc2c2cccnc12)C1CCCCC1	643102848	PTJSIHXOUZZMMI-UHFFFAOYSA-N	318.420	4.793	5	20	DJBD	
CC(C)(C)SCCSc1ccc([N+](=O)[O-])c2cnccc12	784684792	MCFIYMQSRMWRMT-UHFFFAOYSA-N	322.455	4.767	5	20	DJBD	
CC1(C)CN(C(=O)c2cc3ccccc3c3cccnc23)C1(C)C	1116194445	PZMQBDNYDAXGIF-UHFFFAOYSA-N	318.420	4.649	5	20	DJBD	
CC(C)Oc1cccc([C@@H](C)Nc2sccc2[N+](=O)[O-])c1	301992564	NZVCZFBUACWTER-LLVKDONJSA-N	306.387	4.617	5	20	DJBD	
CCCOc1cc(C)ccc1N[C@H](C)c1ccccc1[N+](=O)[O-]	321119032	CITOSJYNXGIQSC-CQSZACIVSA-N	314.385	4.865	5	20	DJBD	
C[C@H](N[C@H](CC(F)F)c1ccccc1)c1ccc([N+](=O)[O-])cc1	421875020	JMOWZMCHBXNYLX-BLLLJJGKSA-N	320.339	4.642	5	20	DJBD	
O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@@H](c1ccccc1)C1CC1)CCC2	447533160	ZJDBCXZGGXAZEQ-UXHICEINSA-N	322.408	4.713	5	20	DJBD	
C[C@@H]1C[C@@H](NCc2cc([N+](=O)[O-])ccc2Cl)c2ccccc21	808706315	HAOAOANLFSJUDR-PIGZYNQJSA-N	316.788	4.586	5	20	DJBD	
O=[N+]([O-])c1cccc(-c2nnc(-c3ccc4sccc4c3)o2)c1	1322101226	WXAJFUPBTYGYPA-UHFFFAOYSA-N	323.333	4.527	5	20	DJBD	
O=C(c1cccc([N+](=O)[O-])c1)N(c1ccccc1)C1CCCCC1	1595025	YRUFDGYVFOXPKG-UHFFFAOYSA-N	324.380	4.574	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2ccc(Oc3ccccc3)cc2)nc1	14855489	BVXOKQHEKHOGOL-UHFFFAOYSA-N	308.293	4.574	5	20	DJBD	
CC[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1cc(F)ccc1F	90078073	CREIXQKSWLEQID-APPDUMDISA-N	320.339	4.675	5	20	DJBD	
Cc1c([C@H](C)NCc2ccc(Cl)cc2F)cccc1[N+](=O)[O-]	187577977	MBWJSQGHGSEZQZ-NSHDSACASA-N	322.767	4.547	5	20	DJBD	
O=[N+]([O-])c1ccc2sc(/C=C\c3cccc(F)c3F)nc2c1	209919948	HZIQEJZKFDRLSD-DAXSKMNVSA-N	318.304	4.653	5	20	DJBD	
Cc1cccc(NCc2cc([N+](=O)[O-])ccc2OC(C)C)c1C	462198364	HLMBMEAQYPJEAS-UHFFFAOYSA-N	314.385	4.611	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1CSc1nc2ccccc2o1	523793194	OVRHQZXTNGPKNS-UHFFFAOYSA-N	320.757	4.682	5	20	DJBD	
O=[N+]([O-])c1ccc(CN[C@H](c2cccs2)C2CC2)c(Cl)c1	544349642	IOORNSKQLKOWAJ-HNNXBMFYSA-N	322.817	4.551	5	20	DJBD	
O=[N+]([O-])c1ncccc1Sc1ccc(-c2ccccc2)cc1	603867234	FTFYDKIWKKAADF-UHFFFAOYSA-N	308.362	4.808	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1-c1ccc(CNC2CCCC2)o1	1116061963	AJRHGPRWDZJPNR-UHFFFAOYSA-N	320.776	4.540	5	20	DJBD	
O=[N+]([O-])c1ccc2sc(/C=C\c3ccccc3F)nc2c1	211812412	RIRBXCVJVACKBC-YVMONPNESA-N	300.314	4.514	5	20	DJBD	
Cc1c([C@@H](C)N[C@H](C)CCCC(F)(F)F)cccc1[N+](=O)[O-]	426060211	QXLYPGVRXULUFS-ZYHUDNBSSA-N	318.339	4.675	5	20	DJBD	
Cc1ccc(-c2nc(/C=C/c3ccc([N+](=O)[O-])cn3)cs2)cc1	439508983	DOAYDZSPDUMGSA-VOTSOKGWSA-N	323.377	4.592	5	20	DJBD	
CCSc1ccc([C@H](C)Nc2ccc([N+](=O)[O-])cc2)cc1	505609338	JSVGWMOINZDNSN-LBPRGKRZSA-N	302.399	4.880	5	20	DJBD	
CC[C@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F	178657668	UILBMRCLWQUUCA-GTNSWQLSSA-N	320.339	4.675	5	20	DJBD	
Cc1oc2ccccc2c1CN[C@H](C)c1ccc([N+](=O)[O-])cc1	185047195	WVIIALUZEQKQBB-GFCCVEGCSA-N	310.353	4.500	5	20	DJBD	
CCC[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccsc1	191223033	UONQJQPETJYWEN-WBMJQRKESA-N	304.415	4.848	5	20	DJBD	
CC(C)(NCc1ccc(C(F)F)cc1)c1ccccc1[N+](=O)[O-]	291677800	HIVAICLPZFGKFU-UHFFFAOYSA-N	320.339	4.557	5	20	DJBD	
Cc1ccc([C@H](C)NCc2ccc(C3CC3)cc2)cc1[N+](=O)[O-]	477850988	DXCXFZGVDXFCHG-AWEZNQCLSA-N	310.397	4.631	5	20	DJBD	
Cc1oc(C(C)C)cc1C(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1	808358365	ICOCEHSQUQYOAV-UHFFFAOYSA-N	322.748	4.525	5	20	DJBD	
CCOc1cc(Cl)ccc1NCc1ccc(C)c([N+](=O)[O-])c1	864023113	ZBXJVTHYTMREDS-UHFFFAOYSA-N	320.776	4.567	5	20	DJBD	
C[C@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(C2CC2)cc1	417352242	FPEYSSPLXDOZRC-UONOGXRCSA-N	310.397	4.884	5	20	DJBD	
Cc1ccc([C@@H](C)NC2(c3ccccc3C)CC2)cc1[N+](=O)[O-]	592391868	PUUCZWVDAWEKRY-OAHLLOKOSA-N	310.397	4.552	5	20	DJBD	
Cc1ccc(-c2csc(-c3ccsc3)n2)cc1[N+](=O)[O-]	8102584	MOXOSJKZSGIVBQ-UHFFFAOYSA-N	302.380	4.755	5	20	DJBD	
O=[N+]([O-])c1cccc(OCc2csc(C3CCCCC3)n2)c1	59008041	SEBJFTSKEXSKIC-UHFFFAOYSA-N	318.398	4.678	5	20	DJBD	
Cc1c([C@H](C)NCc2cc3ccccc3o2)cccc1[N+](=O)[O-]	178486660	AVEMNILFCLZGOT-ZDUSSCGKSA-N	310.353	4.500	5	20	DJBD	
Cc1c([C@H](C)NC2(c3ccccc3)CCC2)cccc1[N+](=O)[O-]	180347297	IIKOYDOJCFWLPP-HNNXBMFYSA-N	310.397	4.633	5	20	DJBD	
CC(C)c1ccc(C(=O)Nc2ccsc2Cl)cc1[N+](=O)[O-]	188141059	ONNMMIRDKCDPNA-UHFFFAOYSA-N	324.789	4.685	5	20	DJBD	
CCCOc1ccc(Cl)cc1NCc1cccc([N+](=O)[O-])c1	314764820	VYBWHSAMNNHCJM-UHFFFAOYSA-N	320.776	4.649	5	20	DJBD	
CC(C)Oc1cc(F)ccc1N[C@@H](C)c1cccc([N+](=O)[O-])c1	495415586	ROGBODCYQKIKRF-LBPRGKRZSA-N	318.348	4.694	5	20	DJBD	
C[C@@H](Nc1ccc(CC(F)(F)F)cc1)c1ccccc1[N+](=O)[O-]	610342119	ZJTVHMHUIVYMAX-LLVKDONJSA-N	324.302	4.873	5	20	DJBD	
CC(C)Nc1ccc([N+](=O)[O-])cc1N[C@H](C)c1ccccc1F	864039572	HBIIZWCHBJZMNF-GFCCVEGCSA-N	317.364	4.727	5	20	DJBD	
C[C@@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1	37177032	PFUZRNXFGFEABS-VXGBXAGGSA-N	304.777	4.660	5	20	DJBD	
CSc1ccccc1[C@@H](C)N[C@H](C)c1ccccc1[N+](=O)[O-]	409894127	BIVYROLSAFDUDA-CHWSQXEVSA-N	316.426	4.729	5	20	DJBD	
Cc1ccccc1[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)C1CC1	531717385	QUYKPWHFMZHZOX-AUUYWEPGSA-N	310.397	4.705	5	20	DJBD	
O=[N+]([O-])c1cccc(SCc2cc(-c3ccccc3)no2)c1	509089340	JIBWRYAIVCTZLJ-UHFFFAOYSA-N	312.350	4.542	5	20	DJBD	
Cc1c(CSCc2cccc(F)c2F)cccc1[N+](=O)[O-]	517285330	UDBDFCPUEUBXNU-UHFFFAOYSA-N	309.337	4.615	5	20	DJBD	
Cc1ccc2cccc(N[C@H](C)c3ccc([N+](=O)[O-])cc3)c2n1	320517016	FWZSMNMQRFAIKY-CYBMUJFWSA-N	307.353	4.625	5	20	DJBD	
Cc1c(NC(=O)Nc2ccc(C(C)C)cc2)cccc1[N+](=O)[O-]	502704058	VYASHJNMMXASRF-UHFFFAOYSA-N	313.357	4.671	5	20	DJBD	
CC(C)c1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1	7689903	ZKRPQMOWNVVMDN-UHFFFAOYSA-N	318.760	4.624	5	20	DJBD	
CCC[C@@H](NCc1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1	315093884	RXEDPHFRUXZDOC-QGZVFWFLSA-N	318.804	4.879	5	20	DJBD	
O=[N+]([O-])c1ccccc1CN(C1CC1)[C@@H]1CCCc2ccccc21	552116206	HHNZKDWQSFLXTK-HXUWFJFHSA-N	322.408	4.637	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1coc2ccccc12	572706803	OLQMNDFSYRCVSJ-CYBMUJFWSA-N	310.353	4.500	5	20	DJBD	
O=[N+]([O-])c1ncccc1Oc1ccc(Oc2ccccc2)cc1	603837045	YHBYMZQWTGNQFH-UHFFFAOYSA-N	308.293	4.574	5	20	DJBD	
O=[N+]([O-])c1cccc(-c2nc(-c3cccc(F)c3)cs2)c1	603950464	FYAIWFCHMQMZPW-UHFFFAOYSA-N	300.314	4.524	5	20	DJBD	
CSc1cccc(C)c1NCc1ccc(Cl)c([N+](=O)[O-])c1	769910985	GKSVPZAPLPBPLS-UHFFFAOYSA-N	322.817	4.891	5	20	DJBD	
Cc1oc(C(C)C)cc1C(=O)Nc1cccc([N+](=O)[O-])c1Cl	813246097	XPSUGVCMTSAUJH-UHFFFAOYSA-N	322.748	4.525	5	20	DJBD	
O=[N+]([O-])c1cccc(-c2nnc([C@@H](F)CC3CCCCC3)o2)c1	1345542629	GEVMHISCPBQFQT-AWEZNQCLSA-N	319.336	4.626	5	20	DJBD	
Cc1ccc([C@H](C)NCc2ccc(C(F)F)cc2)cc1[N+](=O)[O-]	183992526	LCQNTYOLCORTJR-LBPRGKRZSA-N	320.339	4.692	5	20	DJBD	
O=[N+]([O-])c1cccc(CSc2ccccc2Br)c1	247362193	ZVLTUPWZMCPYBF-UHFFFAOYSA-N	324.199	4.650	5	20	DJBD	
CC[C@@H](Nc1ccc([N+](=O)[O-])c2cnccc12)c1cccs1	301089611	LAHCXUMLBIAOLQ-CYBMUJFWSA-N	313.382	4.768	5	20	DJBD	
O=[N+]([O-])c1ccc(N[C@@H]2CC[C@H]3CCC[C@@H]3C2)c2ccncc12	462904421	UQOOPYLPDBIUIQ-MGPQQGTHSA-N	311.385	4.524	5	20	DJBD	
C[C@H](N[C@@H](c1ccccc1)C1CCC1)c1ccc([N+](=O)[O-])cc1	482448962	GXYLFTAHJIBTRK-LIRRHRJNSA-N	310.397	4.787	5	20	DJBD	
C[C@@H](c1cc2ccccc2o1)N(C)CCc1ccc([N+](=O)[O-])cc1	524425142	QRGSBECROUQNSP-AWEZNQCLSA-N	324.380	4.577	5	20	DJBD	
Cc1c([C@H](C)Nc2cccc3ccncc23)cccc1[N+](=O)[O-]	539727089	CFYOEMKGWBHYHQ-ZDUSSCGKSA-N	307.353	4.625	5	20	DJBD	
CC(C)Oc1ccc([C@@H](C)Nc2ccc([N+](=O)[O-])s2)cc1	604409276	MTMJJVOSJHFTGY-LLVKDONJSA-N	306.387	4.617	5	20	DJBD	
C[C@@H]1C[C@H]1c1ccc(CNc2ccc([N+](=O)[O-])cc2Cl)o1	36971046	RGNHHCDQFGPTGZ-BXKDBHETSA-N	306.749	4.577	5	20	DJBD	
O=[N+]([O-])c1cc(NCc2cccc(C(F)F)c2)ccc1Cl	131793860	CQCNVWKNMKUPLS-UHFFFAOYSA-N	312.703	4.798	5	20	DJBD	
COc1ccccc1SCc1c(Cl)cccc1[N+](=O)[O-]	488800797	FEAXGPLICWFECV-UHFFFAOYSA-N	309.774	4.549	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2ccc(Cl)c3ccccc23)cn1	555888902	DWQITJXTRLPCSA-UHFFFAOYSA-N	300.701	4.589	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1cccc(C(C)C)c1	597665847	GVXMWLQDEYSZRT-UHFFFAOYSA-N	312.369	4.587	5	20	DJBD	
O=[N+]([O-])c1cccc(SCc2ccc(Cl)nc2Cl)c1	313574355	VMQURMGUTJWYGS-UHFFFAOYSA-N	315.181	4.589	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2ncnc3sccc23)c2ccccc12	465052800	FCJXYXYCVCMVPD-UHFFFAOYSA-N	323.333	4.545	5	20	DJBD	
CC(C)Cc1nnc(-c2cc3ccccc3c3cccnc23)o1	1331874596	JIZPDXBBMGVAHH-UHFFFAOYSA-N	303.365	4.637	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1coc2ccccc12	572706804	OLQMNDFSYRCVSJ-ZDUSSCGKSA-N	310.353	4.500	5	20	DJBD	
Cc1ccc(-c2nc(O)c3cc4ccccc4cc3n2)cc1F	614115796	DNLJGHQVKKRWNH-UHFFFAOYSA-N	304.324	4.603	5	20	DJBD	
C[C@@H](NCc1ccccc1[N+](=O)[O-])c1ccc(-c2ccccc2)o1	89511935	YQNLQCQSDDMCIQ-CQSZACIVSA-N	322.364	4.706	5	20	DJBD	
CC[C@@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1cccc(F)c1	186842588	AXVMSVIXLWDSJS-SJKOYZFVSA-N	302.349	4.536	5	20	DJBD	
O=[N+]([O-])c1ccccc1-c1ccc(CNc2ccccc2)s1	462681109	VKWZHEHUESFMIJ-UHFFFAOYSA-N	310.378	4.935	5	20	DJBD	
CSc1ccc(Oc2nc3ccccc3cc2[N+](=O)[O-])cc1	473515493	YKDPIJXXEVBJRJ-UHFFFAOYSA-N	312.350	4.657	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H]1CCc2c(C)cccc21	540179569	XLMKWJBCDVFVKB-KUHUBIRLSA-N	310.397	4.550	5	20	DJBD	
C[C@@H](SCCCOc1ccc([N+](=O)[O-])cc1)c1cccs1	737404954	KGRFUFGXRKXZRH-GFCCVEGCSA-N	323.439	4.920	5	20	DJBD	
C[C@H](Nc1ccc(CC(F)(F)F)cc1)c1ccc([N+](=O)[O-])cc1	178658429	OHNTXQCNRIQRJD-NSHDSACASA-N	324.302	4.873	5	20	DJBD	
O=[N+]([O-])c1ccc(-c2ccc(CNC3CCCC3)o2)c(Cl)c1	237814322	JKBXEAAFZMYSOB-UHFFFAOYSA-N	320.776	4.540	5	20	DJBD	
CN(Cc1ccc2ccccc2c1)Cc1c(F)cccc1[N+](=O)[O-]	505591178	QZMJCTJGDIRPHG-UHFFFAOYSA-N	324.355	4.519	5	20	DJBD	
Cc1c(NCc2c3ccccc3cc3ccccc23)cnn1C	774822254	CQFOMJFEIHFKAR-UHFFFAOYSA-N	301.393	4.647	5	20	DJBD	
CC[C@@H](N[C@H](C)c1c(F)cccc1F)c1cccc([N+](=O)[O-])c1	119654051	RWCMGXXTFGTIQO-BDJLRTHQSA-N	320.339	4.675	5	20	DJBD	
CCC(=O)c1ccc(Oc2ccc([N+](=O)[O-])cc2Cl)c(F)c1	481808371	AGIATBWJPZHMEQ-UHFFFAOYSA-N	323.707	4.772	5	20	DJBD	
O=[N+]([O-])c1cccc(F)c1CSc1ccc2ccccc2n1	504508396	UMBDRPFACZLATG-UHFFFAOYSA-N	314.341	4.574	5	20	DJBD	
Cc1c([C@H](C)N[C@H]2CCCc3ccccc32)cccc1[N+](=O)[O-]	531677927	XYJCASMELPHVIK-KSSFIOAISA-N	310.397	4.631	5	20	DJBD	
O=[N+]([O-])c1ccc(CSCc2cnc3ccccc3c2)cc1	539708740	ACJBFCYWEUEKSY-UHFFFAOYSA-N	310.378	4.576	5	20	DJBD	
C[C@H]1OCC[C@@H]1SCc1nc2ccccc2c2ccccc12	549929804	SCOYNHZCXUONCX-YJYMSZOUSA-N	309.434	4.799	5	20	DJBD	
C[C@@H](N[C@H](C)c1ccc(F)c(Cl)c1)c1cccc([N+](=O)[O-])c1	79723969	XWNOUPUPUHXJIZ-GHMZBOCLSA-N	322.767	4.799	5	20	DJBD	
CC[C@H](C)CN(C)C(=O)c1cc2ccccc2c2cccnc12	171874132	NYOQFHVOPHIFFU-AWEZNQCLSA-N	306.409	4.506	5	20	DJBD	
CCSc1ccc([C@@H](C)Nc2ccc([N+](=O)[O-])cc2)cc1	505609335	JSVGWMOINZDNSN-GFCCVEGCSA-N	302.399	4.880	5	20	DJBD	
CSCc1cccc(N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1	537530081	KDYVUVUJYDFROR-LBPRGKRZSA-N	302.399	4.631	5	20	DJBD	
CSc1ccc(C)c(N[C@H](C)c2ccc([N+](=O)[O-])cc2)c1	539681711	RPEKJAGWRVWHSV-GFCCVEGCSA-N	302.399	4.798	5	20	DJBD	
C[C@@H](SCc1nc2ccc([N+](=O)[O-])cc2[nH]1)c1cccs1	788814188	YRDOJUXHEGVOJO-SECBINFHSA-N	319.411	4.527	5	20	DJBD	
O=[N+]([O-])c1cc(C(F)F)ccc1N1CCC[C@H]1c1ccsc1	853162394	AQSCZTGTYFXCFB-LBPRGKRZSA-N	324.352	4.935	5	20	DJBD	
CC[C@H](Nc1ccc(C(C)=O)cc1[N+](=O)[O-])c1ccc(C)cc1	7981001	NCGCGMVFNCXGTP-INIZCTEOSA-N	312.369	4.669	5	20	DJBD	
Cc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc2oc(C)c(C)c2c1	192524429	OMYOEPYFEQXLCI-UHFFFAOYSA-N	324.336	4.519	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H](c1ccccc1)C(C)C	485799922	KKIHFMNSRDBPSH-BEFAXECRSA-N	312.413	4.951	5	20	DJBD	
CC[C@@H](NCc1ccc(Cl)cc1[N+](=O)[O-])c1ccc(C)cc1	539262938	PIXDFRNVZKMSQJ-MRXNPFEDSA-N	318.804	4.798	5	20	DJBD	
C[C@@H](Nc1cccc(Br)c1)c1cccc([N+](=O)[O-])c1	20090414	MBRZFYUBLFQXTJ-SNVBAGLBSA-N	321.174	4.530	5	20	DJBD	
CCC[C@H](Nc1cccc(COC)c1)c1cccc([N+](=O)[O-])c1	192704011	LIKJXAGLUAUHSG-SFHVURJKSA-N	314.385	4.695	5	20	DJBD	
CC[C@@H](Nc1ncc(C)cc1[N+](=O)[O-])c1ccc(Cl)s1	426905090	NIEDBWLSBUOQEY-SECBINFHSA-N	311.794	4.576	5	20	DJBD	
O=[N+]([O-])c1cccc(Cl)c1CN1CCCC[C@H]1c1ccco1	492977455	STZYFELZTKEUBJ-HNNXBMFYSA-N	320.776	4.568	5	20	DJBD	
CSc1cccc(N[C@H](C)c2cc([N+](=O)[O-])ccc2C)c1	540709338	LOLRHZSICZSZGR-GFCCVEGCSA-N	302.399	4.798	5	20	DJBD	
C[C@H](N[C@H](C)c1ccc(Cl)cc1)c1ccccc1[N+](=O)[O-]	20526138	KSKWSUFMOWZJFS-NEPJUHHUSA-N	304.777	4.660	5	20	DJBD	
CCC(=O)c1ccc(Oc2ccc([N+](=O)[O-])c3cccnc23)cc1	301083997	PGOCAWXIQSMQTA-UHFFFAOYSA-N	322.320	4.528	5	20	DJBD	
Cc1ccc([N+](=O)[O-])c(Oc2ccc(C3CC3)cc2Cl)n1	432171662	GGKWBSLGBACRCA-UHFFFAOYSA-N	304.733	4.621	5	20	DJBD	
Cc1cc(Cl)ccc1CNC(C)(C)c1ccccc1[N+](=O)[O-]	492051982	XKMLOOBZLTYWCR-UHFFFAOYSA-N	318.804	4.582	5	20	DJBD	
Cc1ccc(N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1OC(F)F	537448608	COPAVLPTICQXCM-LLVKDONJSA-N	322.311	4.678	5	20	DJBD	
COc1ccc2cc(N[C@H](C)c3ccc([N+](=O)[O-])cc3)ccc2c1	795319368	YSTNRPUZYJKQAX-CYBMUJFWSA-N	322.364	4.930	5	20	DJBD	
CC[C@H](NCc1cccc([N+](=O)[O-])c1C)c1ccc(Cl)cc1	195669322	HFLJSKJTZZLHTC-INIZCTEOSA-N	318.804	4.798	5	20	DJBD	
CCCOc1ccccc1N[C@H](C)c1ccc([N+](=O)[O-])cc1	315760125	RBERTCNVQHQVFY-CYBMUJFWSA-N	300.358	4.557	5	20	DJBD	
C[C@H](N[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccccc1	433149358	ISLOWJWATIUGKT-UGSOOPFHSA-N	310.397	4.668	5	20	DJBD	
Cc1cccc([C@@H](C)NCc2c(Cl)cccc2[N+](=O)[O-])c1C	494793024	IUHMLCQJBGNKGB-CYBMUJFWSA-N	318.804	4.716	5	20	DJBD	
O=[N+]([O-])c1ccc(CN2CCC[C@H]2c2ccccc2Cl)cc1	603857533	XANBQXVZHZJOCO-KRWDZBQOSA-N	316.788	4.585	5	20	DJBD	
CCOc1cc(Cl)ccc1NCc1cccc([N+](=O)[O-])c1C	864018838	YWINZQHROLRMKB-UHFFFAOYSA-N	320.776	4.567	5	20	DJBD	
Cc1ccccc1CNc1ccc([N+](=O)[O-])c(C(F)(F)F)c1	75102965	LSUAICAGYLVTLW-UHFFFAOYSA-N	310.275	4.534	5	20	DJBD	
COc1ccc(CS[C@@H](C)c2ccccc2[N+](=O)[O-])cc1F	437284704	BWXMGQDPMOVNII-NSHDSACASA-N	321.373	4.737	5	20	DJBD	
CC(C)c1ccc(C(=O)N(C(C)C)C2CCCC2)cc1[N+](=O)[O-]	439141722	MDCPHKNLLFWPBT-UHFFFAOYSA-N	318.417	4.511	5	20	DJBD	
CCCCCN(C(=O)c1ccc([N+](=O)[O-])c(C)c1)[C@@H](C)CCC	516822583	OBCHXGYFSFEGRR-HNNXBMFYSA-N	320.433	4.724	5	20	DJBD	
C[C@@H](CSCc1ccc([N+](=O)[O-])cc1Cl)C(F)(F)F	543860994	ZXHXEEFATGMBFI-ZETCQYMHSA-N	313.728	4.680	5	20	DJBD	
c1ccc2c(CNC[C@H]3CCCCO3)c3ccccc3cc2c1	920414135	MPMCBEVRZOAQJP-GOSISDBHSA-N	305.421	4.652	5	20	DJBD	
COc1cc(N[C@@H](C)c2cc(C)sc2C)c(F)cc1[N+](=O)[O-]	301973825	VDGGSVQHUKYSCW-VIFPVBQESA-N	324.377	4.594	5	20	DJBD	
CC(C)(C)C[C@@H](NCc1cccc([N+](=O)[O-])c1)c1ccccc1	320096870	VMBFGWHWOFIPMG-GOSISDBHSA-N	312.413	4.862	5	20	DJBD	
Cc1ccc([C@@H](C)N[C@H](CC(F)(F)F)C(C)C)cc1[N+](=O)[O-]	437098964	YAZXBMRTBWPASX-DGCLKSJQSA-N	318.339	4.531	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)SCc1ccn(C(C)C)n1	486107246	XJUOVHJDBFDCFI-CYBMUJFWSA-N	319.430	4.675	5	20	DJBD	
CC(C)(C)c1ccc(-c2nc(C3CCCC3)no2)cc1[N+](=O)[O-]	505083833	NUYYDTGWURKCHL-UHFFFAOYSA-N	315.373	4.600	5	20	DJBD	
Cc1cc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2C)ccc1Cl	544606940	NGRVAQDRPLMHFA-ZDUSSCGKSA-N	318.804	4.716	5	20	DJBD	
COCc1ccc(S[C@@H](C)c2ccccc2[N+](=O)[O-])cc1	610480782	WGOVSERSQFVUEI-LBPRGKRZSA-N	303.383	4.595	5	20	DJBD	
CCOc1ccc(N[C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1F	776858747	ZHHCICBHQLYPPX-GFCCVEGCSA-N	318.348	4.614	5	20	DJBD	
C[C@H](N[C@@H](C)c1ccc(Cl)s1)c1ccc([N+](=O)[O-])cc1	36992055	URWOYAFYKXHHCG-UWVGGRQHSA-N	310.806	4.722	5	20	DJBD	
CC[C@@H](N[C@@H](C)c1cccc(F)c1F)c1cccc([N+](=O)[O-])c1	179560067	SJSBXILCTQLOJJ-MEDUHNTESA-N	320.339	4.675	5	20	DJBD	
Cc1cc([C@H](C)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)s1	195614583	KJRUKNSTIIGHQJ-STQMWFEESA-N	318.442	4.993	5	20	DJBD	
CC(C)[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1	390683023	VBIZNRKHOGCWBU-ACJLOTCBSA-N	316.376	4.782	5	20	DJBD	
C[C@@H](Sc1cccc2cccnc12)c1ccccc1[N+](=O)[O-]	463278211	MQTCMKUDAYLKGL-GFCCVEGCSA-N	310.378	4.996	5	20	DJBD	
C[C@H](c1ccccc1[N+](=O)[O-])N1CC(C)(C)[C@@H]1c1cccs1	561964949	WRHKQZPRXGGKMY-WBMJQRKESA-N	316.426	4.800	5	20	DJBD	
O=[N+]([O-])c1cc(Cl)ccc1CSCc1cc(C2CC2)no1	596401963	HTZUONKOFPNYEN-UHFFFAOYSA-N	324.789	4.547	5	20	DJBD	
CC[C@@H](N[C@@H]1CCc2ccc(C)cc21)c1cccc([N+](=O)[O-])c1	610831226	UTCYMGOCXCHZCI-RTBURBONSA-N	310.397	4.631	5	20	DJBD	
CCC[C@@H](NCc1cc(Cl)ccc1[N+](=O)[O-])c1ccccc1	774811408	OFTKRGNGVFBSPB-MRXNPFEDSA-N	318.804	4.879	5	20	DJBD	
C[C@@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1	19995580	QRMVPIIJCUGLII-VXGBXAGGSA-N	304.777	4.660	5	20	DJBD	
COc1ccc([N+](=O)[O-])cc1CNc1ccccc1C(C)(C)C	248153193	XNGWMCUMBVYKRN-UHFFFAOYSA-N	314.385	4.513	5	20	DJBD	
C[C@@H](SCc1cccc([N+](=O)[O-])c1)c1ccc(F)c(F)c1	498116939	JMKFVLUULZKTHG-SNVBAGLBSA-N	309.337	4.867	5	20	DJBD	
CC(=O)c1ccc(N[C@@H](c2ccccc2)C(C)C)c([N+](=O)[O-])c1	514485138	KCPJQQZJVCNAIP-GOSISDBHSA-N	312.369	4.607	5	20	DJBD	
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC(C)(C)c1cccs1	543501133	FMADCFLAKHEEKU-GFCCVEGCSA-N	304.415	4.551	5	20	DJBD	
O=[N+]([O-])c1ccc(Oc2cncc(-c3ccccc3)c2)c(F)c1	567741470	XAJDLTCQAUQEAF-UHFFFAOYSA-N	310.284	4.588	5	20	DJBD	
CC(C)n1ncc2cc(N[C@@H](C)c3cccc([N+](=O)[O-])c3)ccc21	611482760	CGGADMAXVIMVFK-ZDUSSCGKSA-N	324.384	4.699	5	20	DJBD	
CSc1ccc([C@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1	192756287	DJIBSZJAHXBMOK-STQMWFEESA-N	316.426	4.729	5	20	DJBD	
O=[N+]([O-])c1ccc(CSCc2nc3ccccc3s2)cc1	513816745	SUJQNNVVIFXPGS-UHFFFAOYSA-N	316.407	4.638	5	20	DJBD	
CSc1ccc([C@@H](C)Nc2cccc(F)c2[N+](=O)[O-])cc1	798415558	DVGWRBKELCXZBG-SNVBAGLBSA-N	306.362	4.629	5	20	DJBD	
O=[N+]([O-])c1ccc(SCc2cccc(Br)c2)cc1	42203497	TYROOQHDUMQICQ-UHFFFAOYSA-N	324.199	4.650	5	20	DJBD	
CCC[C@H](Nc1ccc2c(c1)CCN2)c1cccc([N+](=O)[O-])c1	423221744	XWRPGTMAWBFFRM-SFHVURJKSA-N	311.385	4.516	5	20	DJBD	
Cc1cc(Oc2ccc([N+](=O)[O-])c3ccccc23)nc(C2CC2)n1	465053777	OGJWNHMLCAUTIY-UHFFFAOYSA-N	321.336	4.516	5	20	DJBD	
Cc1cc(C)c2cc(CN[C@H](C)c3ccccc3[N+](=O)[O-])[nH]c2c1	479416885	BKXWCKHFJCDQAY-CQSZACIVSA-N	323.396	4.544	5	20	DJBD	
Cc1ccc([C@H](C)Nc2nc3ccc([N+](=O)[O-])cc3s2)cc1	731206731	RAHWXTAINFHYDN-NSHDSACASA-N	313.382	4.686	5	20	DJBD