smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@H]1CCN(CCn2ccc([N+](=O)[O-])n2)[C@H]1c1cccc(F)c1 ZINC000246287805 432117331 /nfs/dbraw/zinc/11/73/31/432117331.db2.gz XOHXFHQNNPHPAQ-BLLLJJGKSA-N 0 3 318.352 3.014 10 5 DGBEHN CC(C)N1CC[C@H](Nc2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000264944205 204291374 /nfs/dbraw/zinc/29/13/74/204291374.db2.gz SVFHILOJBOGVGM-LBPRGKRZSA-N 0 3 300.362 3.038 10 5 DGBEHN O=[N+]([O-])c1cccc([C@@H](NC[C@@H]2CCOC2)c2ccccc2)c1 ZINC000490156776 245383935 /nfs/dbraw/zinc/38/39/35/245383935.db2.gz KIBFBDJDVDTQIV-KSSFIOAISA-N 0 3 312.369 3.310 10 5 DGBEHN C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@@]2(O)CCCC[C@@H]2C1 ZINC000269055366 207205345 /nfs/dbraw/zinc/20/53/45/207205345.db2.gz SCHBZGAQHGMPPT-CPUCHLNUSA-N 0 3 304.390 3.283 10 5 DGBEHN Cc1cc(NC[C@H](C)c2ccncc2)c2cc([N+](=O)[O-])ccc2n1 ZINC000611930127 400464242 /nfs/dbraw/zinc/46/42/42/400464242.db2.gz VRMXXIBGRBZHPJ-LBPRGKRZSA-N 0 3 322.368 3.484 10 5 DGBEHN Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@H]2CN2CCCCC2)n1 ZINC000614517858 400910535 /nfs/dbraw/zinc/91/05/35/400910535.db2.gz CEAHPDCSLJCGLI-HNNXBMFYSA-N 0 3 318.421 3.061 10 5 DGBEHN C[C@@H](NCc1cc(F)ccc1[N+](=O)[O-])[C@@H]1COc2ccccc21 ZINC000185641150 165010838 /nfs/dbraw/zinc/01/08/38/165010838.db2.gz DUFMAMKFMTVUFP-ABAIWWIYSA-N 0 3 316.332 3.388 10 5 DGBEHN C[C@@H](N[C@@H](C)C1CCCC1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000172170453 432201804 /nfs/dbraw/zinc/20/18/04/432201804.db2.gz IVIAYVPJVGRVIU-NWDGAFQWSA-N 0 3 305.378 3.090 10 5 DGBEHN Cc1nccn1C[C@H]1CCCN1[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000247193049 432211947 /nfs/dbraw/zinc/21/19/47/432211947.db2.gz WQJBPLXMJGRTAZ-CXAGYDPISA-N 0 3 314.389 3.325 10 5 DGBEHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@@]2(O)CCCC[C@H]2C1 ZINC000248170119 278310696 /nfs/dbraw/zinc/31/06/96/278310696.db2.gz UPDIYJGJABLBEB-KMFMINBZSA-N 0 3 304.390 3.283 10 5 DGBEHN CN(Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H]1CCCO1 ZINC000128065523 431987413 /nfs/dbraw/zinc/98/74/13/431987413.db2.gz DDMOPZAHKQCAPB-OAHLLOKOSA-N 0 3 316.357 3.466 10 5 DGBEHN CC[C@H](N[C@H]1Cc2ccccc2[C@@H]1O)c1cccc([N+](=O)[O-])c1 ZINC000178360377 432725030 /nfs/dbraw/zinc/72/50/30/432725030.db2.gz OKJYLEMKMRPUHJ-BZSNNMDCSA-N 0 3 312.369 3.294 10 5 DGBEHN COC[C@H](Cc1ccccc1)NCc1ccc(C)c([N+](=O)[O-])c1 ZINC000531096487 435070409 /nfs/dbraw/zinc/07/04/09/435070409.db2.gz RXLYSCYNARJICZ-KRWDZBQOSA-N 0 3 314.385 3.251 10 5 DGBEHN C[C@@H](CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)N(C)C ZINC000491053593 435698385 /nfs/dbraw/zinc/69/83/85/435698385.db2.gz OITPCFMKZYJOLU-KBXCAEBGSA-N 0 3 313.401 3.224 10 5 DGBEHN CCOC[C@H](NCc1cc(Cl)ccc1[N+](=O)[O-])C(C)C ZINC000233777740 1202602897 /nfs/dbraw/zinc/60/28/97/1202602897.db2.gz ISSBRVMRYJZDDE-ZDUSSCGKSA-N 0 3 300.786 3.399 10 5 DGBEHN CCCN(Cc1ccc(OC)c([N+](=O)[O-])c1)C[C@H]1CCCCO1 ZINC000106867095 432022811 /nfs/dbraw/zinc/02/28/11/432022811.db2.gz KYSBPFUFFGZZIQ-OAHLLOKOSA-N 0 3 322.405 3.385 10 5 DGBEHN CCCN(Cc1ccc(OC)c([N+](=O)[O-])c1)C[C@@H]1CCCCO1 ZINC000106867093 432023459 /nfs/dbraw/zinc/02/34/59/432023459.db2.gz KYSBPFUFFGZZIQ-HNNXBMFYSA-N 0 3 322.405 3.385 10 5 DGBEHN C[C@H]1CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H](C)C1 ZINC000246590969 432146704 /nfs/dbraw/zinc/14/67/04/432146704.db2.gz GROMNASWMZYMFM-STQMWFEESA-N 0 3 320.389 3.329 10 5 DGBEHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC(n2ccnc2)CC1 ZINC000109796586 194286354 /nfs/dbraw/zinc/28/63/54/194286354.db2.gz AZKQGLYXYAAEHG-ZDUSSCGKSA-N 0 3 300.362 3.189 10 5 DGBEHN C[C@H]1C[C@H](CN(Cc2ccccc2[N+](=O)[O-])C2CC2)CCO1 ZINC000611518053 400414010 /nfs/dbraw/zinc/41/40/10/400414010.db2.gz FDITVEIGXRUBFP-UONOGXRCSA-N 0 3 304.390 3.374 10 5 DGBEHN C/C(=C\c1cccc([N+](=O)[O-])c1)CNCCO[C@@H]1CC1(F)F ZINC000594972073 401215071 /nfs/dbraw/zinc/21/50/71/401215071.db2.gz XTVIVAHSKVSRKZ-DPQIITEBSA-N 0 3 312.316 3.012 10 5 DGBEHN Cc1cc(NC[C@H]2CCCN2C)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000359913036 286386946 /nfs/dbraw/zinc/38/69/46/286386946.db2.gz PTRFFXTXWMUKSS-SNVBAGLBSA-N 0 3 317.311 3.428 10 5 DGBEHN CC(=O)c1cc([N+](=O)[O-])ccc1NC1CC(N2CCCCC2)C1 ZINC000367819439 271080856 /nfs/dbraw/zinc/08/08/56/271080856.db2.gz RJULXOUNOJGMOO-UHFFFAOYSA-N 0 3 317.389 3.226 10 5 DGBEHN O=[N+]([O-])C1[C@H](O)c2cc(Cl)ccc2O[C@@H]1c1ccccc1 ZINC000196489257 275032684 /nfs/dbraw/zinc/03/26/84/275032684.db2.gz QPNVLFYMEAMXSZ-RRFJBIMHSA-N 0 3 305.717 3.152 10 5 DGBEHN O=[N+]([O-])c1cccc(OCCN2CCC[C@@H]2c2ccco2)c1 ZINC000116292266 431499778 /nfs/dbraw/zinc/49/97/78/431499778.db2.gz QZPKNKXOZYAEOE-OAHLLOKOSA-N 0 3 302.330 3.404 10 5 DGBEHN CC(=O)c1ccc(NC[C@@H]2CCCN2CC(C)C)c([N+](=O)[O-])c1 ZINC000301844385 433753114 /nfs/dbraw/zinc/75/31/14/433753114.db2.gz LNNCALLMSTVWRD-HNNXBMFYSA-N 0 3 319.405 3.330 10 5 DGBEHN Cc1ccc([C@H](C)N[C@@H](CO)CC2CCCC2)cc1[N+](=O)[O-] ZINC000511025834 294398859 /nfs/dbraw/zinc/39/88/59/294398859.db2.gz GEMIXPVGZVGQEY-XJKSGUPXSA-N 0 3 306.406 3.495 10 5 DGBEHN Cc1cc(CCN[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)on1 ZINC000556920270 435039121 /nfs/dbraw/zinc/03/91/21/435039121.db2.gz GJLJIQSCFCLIPH-INIZCTEOSA-N 0 3 315.373 3.446 10 5 DGBEHN CCO[C@H]1C[C@@H](NCc2csc([N+](=O)[O-])c2)C12CCCC2 ZINC000583030556 324305178 /nfs/dbraw/zinc/30/51/78/324305178.db2.gz QRMYEBLAWISQRU-OLZOCXBDSA-N 0 3 310.419 3.484 10 5 DGBEHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@@H](C)C1CCCC1 ZINC000184647948 534339794 /nfs/dbraw/zinc/33/97/94/534339794.db2.gz KCCLEUYCWHGBSH-LBPRGKRZSA-N 0 3 305.378 3.010 10 5 DGBEHN C[C@@H]1[C@@H](C(F)(F)F)CCN1CCc1ccc([N+](=O)[O-])cc1 ZINC000470952178 244197273 /nfs/dbraw/zinc/19/72/73/244197273.db2.gz BFMJJXWEQPFQGV-MFKMUULPSA-N 0 3 302.296 3.410 10 5 DGBEHN Cc1nccn1CCCN(C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000127286315 284333265 /nfs/dbraw/zinc/33/32/65/284333265.db2.gz LGYDJMMZENMQHC-CYBMUJFWSA-N 0 3 302.378 3.183 10 5 DGBEHN CC(C)[C@@H](C)N[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000015415244 182001182 /nfs/dbraw/zinc/00/11/82/182001182.db2.gz UKPKGAKNZBGCSU-MNOVXSKESA-N 0 3 304.350 3.340 10 5 DGBEHN COc1ccc(CN(C)CCc2ncc(C)s2)cc1[N+](=O)[O-] ZINC000157512313 197193115 /nfs/dbraw/zinc/19/31/15/197193115.db2.gz WWOCTIQMGNQFCK-UHFFFAOYSA-N 0 3 321.402 3.043 10 5 DGBEHN COc1cccc(CCN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)n1 ZINC000361929571 286746171 /nfs/dbraw/zinc/74/61/71/286746171.db2.gz NWUOBSZRWASDRE-ZDUSSCGKSA-N 0 3 315.373 3.200 10 5 DGBEHN Cc1c(CN2CC[C@@]3(O)CCCC[C@H]3C2)cccc1[N+](=O)[O-] ZINC000248056082 432264827 /nfs/dbraw/zinc/26/48/27/432264827.db2.gz XMIUFFWVESUOHI-RDJZCZTQSA-N 0 3 304.390 3.030 10 5 DGBEHN COc1cc(F)c([N+](=O)[O-])c(NCCN2CCCCCC2)c1 ZINC000301527991 433594792 /nfs/dbraw/zinc/59/47/92/433594792.db2.gz OFHQTUQIPOLMAR-UHFFFAOYSA-N 0 3 311.357 3.030 10 5 DGBEHN CCN1CCc2c(cccc2Nc2ccc([N+](=O)[O-])c(C)n2)C1 ZINC000301687485 433679102 /nfs/dbraw/zinc/67/91/02/433679102.db2.gz IPZRJBRGVRYUJD-UHFFFAOYSA-N 0 3 312.373 3.420 10 5 DGBEHN CN(CCSc1ccc([N+](=O)[O-])nc1)Cc1ccccc1 ZINC000450492841 434226689 /nfs/dbraw/zinc/22/66/89/434226689.db2.gz XFXZYRUEZSTPPA-UHFFFAOYSA-N 0 3 303.387 3.214 10 5 DGBEHN C[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])nc2)CN1Cc1ccccc1 ZINC000398001425 434450468 /nfs/dbraw/zinc/45/04/68/434450468.db2.gz WLPJQIABSYNJLH-XJKSGUPXSA-N 0 3 312.373 3.065 10 5 DGBEHN C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])nc2)CN1Cc1ccccc1 ZINC000398001423 434452621 /nfs/dbraw/zinc/45/26/21/434452621.db2.gz WLPJQIABSYNJLH-CJNGLKHVSA-N 0 3 312.373 3.065 10 5 DGBEHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](CO)CC1CCCC1 ZINC000554722109 434943384 /nfs/dbraw/zinc/94/33/84/434943384.db2.gz HBRLJEKPPRKBJB-UKRRQHHQSA-N 0 3 306.406 3.495 10 5 DGBEHN CC(C)(O)CCN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000480712943 435391068 /nfs/dbraw/zinc/39/10/68/435391068.db2.gz LBKPGVYVQVCCMB-QGZVFWFLSA-N 0 3 314.385 3.435 10 5 DGBEHN CCOC[C@@H](NCc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC000233735185 1202602931 /nfs/dbraw/zinc/60/29/31/1202602931.db2.gz VSCFSWHMKUAXIC-CYBMUJFWSA-N 0 3 300.786 3.399 10 5 DGBEHN CCOC[C@H](NCc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC000233778775 1202602985 /nfs/dbraw/zinc/60/29/85/1202602985.db2.gz VSCFSWHMKUAXIC-ZDUSSCGKSA-N 0 3 300.786 3.399 10 5 DGBEHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@H](C2(C)OCCO2)C1 ZINC000183880835 186227066 /nfs/dbraw/zinc/22/70/66/186227066.db2.gz PJOPRMTZLNENAP-ZFWWWQNUSA-N 0 3 320.389 3.131 10 5 DGBEHN O=[N+]([O-])c1cc(CN2CC[C@H]3[C@H](CCCN3C3CC3)C2)cs1 ZINC000134880360 432087652 /nfs/dbraw/zinc/08/76/52/432087652.db2.gz CGSGRTWAFHLXHU-HIFRSBDPSA-N 0 3 321.446 3.105 10 5 DGBEHN CCS[C@@H]1CCCCN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000246318840 432118184 /nfs/dbraw/zinc/11/81/84/432118184.db2.gz RLXFTLXNVFLJTD-HZPDHXFCSA-N 0 3 324.446 3.236 10 5 DGBEHN Cc1cnc(CCN(C)Cc2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000093807187 193310269 /nfs/dbraw/zinc/31/02/69/193310269.db2.gz AWMHZLNYAURQHE-UHFFFAOYSA-N 0 3 305.403 3.343 10 5 DGBEHN C[C@H](c1ccccc1)N1CC[C@H](Nc2ccc([N+](=O)[O-])nc2)C1 ZINC000609796760 400192033 /nfs/dbraw/zinc/19/20/33/400192033.db2.gz NSJGJZQWTLPZMV-CJNGLKHVSA-N 0 3 312.373 3.237 10 5 DGBEHN CC(C)c1ccc([C@H](C)NCCn2cc([N+](=O)[O-])cn2)cc1 ZINC000174809934 400863289 /nfs/dbraw/zinc/86/32/89/400863289.db2.gz LQJFXLCHUFPNER-ZDUSSCGKSA-N 0 3 302.378 3.266 10 5 DGBEHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC(c2cc[nH]n2)CC1 ZINC000195505622 165371904 /nfs/dbraw/zinc/37/19/04/165371904.db2.gz AEGVBPWELOKLRZ-LBPRGKRZSA-N 0 3 300.362 3.259 10 5 DGBEHN Cc1cc(NCCC2(C)OCCO2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302145234 230121978 /nfs/dbraw/zinc/12/19/78/230121978.db2.gz HGHSGXGLFTWDFG-UHFFFAOYSA-N 0 3 317.345 3.016 10 5 DGBEHN O=[N+]([O-])c1cc(CNC[C@@H]2CSCCS2)ccc1Cl ZINC000125224504 275033150 /nfs/dbraw/zinc/03/31/50/275033150.db2.gz HYDUKBRRSXLCNG-SNVBAGLBSA-N 0 3 318.851 3.186 10 5 DGBEHN CC[C@H](N[C@@H](C)CC(=O)N(CC)CC)c1cccc([N+](=O)[O-])c1 ZINC000090918445 431897648 /nfs/dbraw/zinc/89/76/48/431897648.db2.gz CDERMUJSMAMJEX-BBRMVZONSA-N 0 3 321.421 3.283 10 5 DGBEHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCN2CCCC[C@@H]2C1 ZINC000182878785 281019700 /nfs/dbraw/zinc/01/97/00/281019700.db2.gz DADLMKPODSRQBQ-GDBMZVCRSA-N 0 3 303.406 3.134 10 5 DGBEHN Cc1cc([N+](=O)[O-])ccc1CN1CC[C@@]2(O)CCCC[C@@H]2C1 ZINC000183361436 432286568 /nfs/dbraw/zinc/28/65/68/432286568.db2.gz WNZQKYDUOOSPFD-WBVHZDCISA-N 0 3 304.390 3.030 10 5 DGBEHN CCN1CCC[C@@H](Nc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000194381012 432546279 /nfs/dbraw/zinc/54/62/79/432546279.db2.gz FAIPFCRKTWRLCU-GFCCVEGCSA-N 0 3 300.362 3.039 10 5 DGBEHN Cc1ccc([C@@H](C)NCCN2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000156615375 432601875 /nfs/dbraw/zinc/60/18/75/432601875.db2.gz ZQBHXCBOFSCMSY-LSDHHAIUSA-N 0 3 305.422 3.428 10 5 DGBEHN C[C@H]1CC[C@](CO)(N(C)Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000188031882 432700033 /nfs/dbraw/zinc/70/00/33/432700033.db2.gz NURSXPGDEXKWLL-NHYWBVRUSA-N 0 3 312.797 3.231 10 5 DGBEHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000160649472 432734691 /nfs/dbraw/zinc/73/46/91/432734691.db2.gz UPDIYJGJABLBEB-FRFSOERESA-N 0 3 304.390 3.283 10 5 DGBEHN CC(C)c1noc(CCCN[C@H](C)c2ccc([N+](=O)[O-])cc2)n1 ZINC000160815431 432743721 /nfs/dbraw/zinc/74/37/21/432743721.db2.gz FXKWDAZCJMICMN-GFCCVEGCSA-N 0 3 318.377 3.385 10 5 DGBEHN C[C@@H]1CCN(CCn2cc([N+](=O)[O-])cn2)[C@H]1c1cccc(F)c1 ZINC000245411669 432828696 /nfs/dbraw/zinc/82/86/96/432828696.db2.gz XYOTUOBRPSZROO-MLGOLLRUSA-N 0 3 318.352 3.014 10 5 DGBEHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCN2CCCC[C@H]2C1 ZINC000245515131 432839444 /nfs/dbraw/zinc/83/94/44/432839444.db2.gz DADLMKPODSRQBQ-ZBFHGGJFSA-N 0 3 303.406 3.134 10 5 DGBEHN O=[N+]([O-])c1cc(CN2CCN(C3CCCCC3)CC2)cs1 ZINC000163010923 432840942 /nfs/dbraw/zinc/84/09/42/432840942.db2.gz AQVTVEXWGKYYOU-UHFFFAOYSA-N 0 3 309.435 3.107 10 5 DGBEHN CC[C@H](C)N[C@@H](CNc1ccc([N+](=O)[O-])nc1)c1ccco1 ZINC000450527626 434244328 /nfs/dbraw/zinc/24/43/28/434244328.db2.gz HYACTPQRXYVWRW-AAEUAGOBSA-N 0 3 304.350 3.124 10 5 DGBEHN Cc1cc(CCN[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)on1 ZINC000556920280 314788574 /nfs/dbraw/zinc/78/85/74/314788574.db2.gz GJLJIQSCFCLIPH-MRXNPFEDSA-N 0 3 315.373 3.446 10 5 DGBEHN C[C@@H](CNc1ncc(Cl)cc1[N+](=O)[O-])N1CCCC[C@H]1C ZINC000434950188 534096518 /nfs/dbraw/zinc/09/65/18/534096518.db2.gz GZQWPPMEEBPVJU-MNOVXSKESA-N 0 3 312.801 3.318 10 5 DGBEHN Cc1cc([N+](=O)[O-])ccc1CN1CCC([C@@H]2CCCO2)CC1 ZINC000188281368 200221470 /nfs/dbraw/zinc/22/14/70/200221470.db2.gz WFOAVNZIGACFBH-KRWDZBQOSA-N 0 3 304.390 3.294 10 5 DGBEHN O=[N+]([O-])c1ccc(CN(C[C@@H]2CCCO2)[C@@H]2CCSC2)cc1 ZINC000123567707 285112005 /nfs/dbraw/zinc/11/20/05/285112005.db2.gz RXPPQZKSTOLVQV-CVEARBPZSA-N 0 3 322.430 3.081 10 5 DGBEHN C[C@@H](c1ccc(Cl)cc1)N(C)CCn1cc([N+](=O)[O-])cn1 ZINC000157597781 197200498 /nfs/dbraw/zinc/20/04/98/197200498.db2.gz CHWAOEJOEVMUAQ-NSHDSACASA-N 0 3 308.769 3.138 10 5 DGBEHN OC[C@H](O)CNCc1ccc2ccc3cccc4ccc1c2c34 ZINC000584614596 400086164 /nfs/dbraw/zinc/08/61/64/400086164.db2.gz RRROFOSTWMHDMA-QGZVFWFLSA-N 0 3 305.377 3.027 10 5 DGBEHN O=[N+]([O-])C1CN(Cc2ccccc2)C[C@@H]1c1cccc(F)c1 ZINC000114031919 400385234 /nfs/dbraw/zinc/38/52/34/400385234.db2.gz REGUWZVPUVLAMT-IAGOWNOFSA-N 0 3 300.333 3.070 10 5 DGBEHN O=[N+]([O-])[C@@]12CN(Cc3ccccc3)C[C@@H]1c1ccccc1CC2 ZINC000225911413 400959662 /nfs/dbraw/zinc/95/96/62/400959662.db2.gz YZFQDGILOOBLOO-MOPGFXCFSA-N 0 3 308.381 3.248 10 5 DGBEHN CCC[C@H](NCC[C@H](C)[S@](C)=O)c1cccc([N+](=O)[O-])c1 ZINC000252728625 165702309 /nfs/dbraw/zinc/70/23/09/165702309.db2.gz CBYWVXPHEJIRPC-QOKQMOMRSA-N 0 3 312.435 3.183 10 5 DGBEHN Cc1c(CN[C@@H]2CCCC[C@@H]2n2cccn2)cccc1[N+](=O)[O-] ZINC000128348645 431992073 /nfs/dbraw/zinc/99/20/73/431992073.db2.gz CWXQCZYHCFUXGY-WBVHZDCISA-N 0 3 314.389 3.373 10 5 DGBEHN CCC[C@H](NCC[C@@H](C)[S@](C)=O)c1cccc([N+](=O)[O-])c1 ZINC000252728626 432386814 /nfs/dbraw/zinc/38/68/14/432386814.db2.gz CBYWVXPHEJIRPC-RKFVTTHHSA-N 0 3 312.435 3.183 10 5 DGBEHN C[C@H](NCCCNC(=O)OC(C)(C)C)c1ccccc1[N+](=O)[O-] 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319.405 3.070 10 5 DGBEHN Cc1cc([N+](=O)[O-])ccc1CN(C)CCC(=O)OC(C)(C)C ZINC000183371819 323335217 /nfs/dbraw/zinc/33/52/17/323335217.db2.gz VXAATCKZXZTSNE-UHFFFAOYSA-N 0 3 308.378 3.067 10 5 DGBEHN COc1cccc([C@@H]2Sc3ccccc3[C@H](O)C2[N+](=O)[O-])c1 ZINC000584654257 337377740 /nfs/dbraw/zinc/37/77/40/337377740.db2.gz TXHRISINDABPOV-PMPSAXMXSA-N 0 3 317.366 3.221 10 5 DGBEHN O=[N+]([O-])C1CN(Cc2ccccc2)C[C@H]1c1cccc(F)c1 ZINC000299805511 563939000 /nfs/dbraw/zinc/93/90/00/563939000.db2.gz REGUWZVPUVLAMT-IRXDYDNUSA-N 0 3 300.333 3.070 10 5 DGBEHN O=[N+]([O-])c1cnccc1NC1CCN(Cc2ccccc2)CC1 ZINC000145008503 186036305 /nfs/dbraw/zinc/03/63/05/186036305.db2.gz GSGSNBADMHSRPA-UHFFFAOYSA-N 0 3 312.373 3.066 10 5 DGBEHN CC[C@@H](NC[C@H]1CC2(CCC2)C(=O)O1)c1cccc([N+](=O)[O-])c1 ZINC000192161647 200829715 /nfs/dbraw/zinc/82/97/15/200829715.db2.gz YKEYCPABGCNNNC-HUUCEWRRSA-N 0 3 318.373 3.121 10 5 DGBEHN O=[N+]([O-])c1ccccc1-c1ccc(CNCC2(CCO)CC2)o1 ZINC000189996632 432109765 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432565281 /nfs/dbraw/zinc/56/52/81/432565281.db2.gz DXRLCTQIOQEZLM-UHFFFAOYSA-N 0 3 316.357 3.107 10 5 DGBEHN CC(C)c1noc(CCCN[C@@H](C)c2ccc([N+](=O)[O-])cc2)n1 ZINC000160815302 432743823 /nfs/dbraw/zinc/74/38/23/432743823.db2.gz FXKWDAZCJMICMN-LBPRGKRZSA-N 0 3 318.377 3.385 10 5 DGBEHN CCOc1ccc([C@@H](C)N[C@@H]2CCCN(CC)C2)cc1[N+](=O)[O-] ZINC000245510926 432839217 /nfs/dbraw/zinc/83/92/17/432839217.db2.gz XENAUHCLDYZCAB-UKRRQHHQSA-N 0 3 321.421 3.128 10 5 DGBEHN CC1=CCN(CCNc2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC000450438113 434179888 /nfs/dbraw/zinc/17/98/88/434179888.db2.gz KSCWWLBUWVJWGZ-UHFFFAOYSA-N 0 3 312.373 3.207 10 5 DGBEHN O=[N+]([O-])c1ccc2c(c1)[C@@H](NCCOCC1CCC1)CCC2 ZINC000570010567 435579698 /nfs/dbraw/zinc/57/96/98/435579698.db2.gz RWMUDDDXBSAVKP-KRWDZBQOSA-N 0 3 304.390 3.379 10 5 DGBEHN C[C@H]1CN(c2ccc([N+](=O)[O-])cc2)CCN1Cc1ccccc1 ZINC000067175863 1195603041 /nfs/dbraw/zinc/60/30/41/1195603041.db2.gz KVVHLVWUCHNLKS-HNNXBMFYSA-N 0 3 311.385 3.306 10 5 DGBEHN Cc1nccn1C[C@H]1CCCN1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000180124464 199120631 /nfs/dbraw/zinc/12/06/31/199120631.db2.gz MMXDQGIUVROZHV-MRXNPFEDSA-N 0 3 314.389 3.073 10 5 DGBEHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCSC2(CCOCC2)C1 ZINC000186844502 200020656 /nfs/dbraw/zinc/02/06/56/200020656.db2.gz XBNHCOIHGJJJHF-ZDUSSCGKSA-N 0 3 322.430 3.254 10 5 DGBEHN O=[N+]([O-])c1cccc([C@H](NC[C@H]2CCOC2)c2ccccc2)c1 ZINC000490156777 245384254 /nfs/dbraw/zinc/38/42/54/245384254.db2.gz KIBFBDJDVDTQIV-RDTXWAMCSA-N 0 3 312.369 3.310 10 5 DGBEHN O=[N+]([O-])c1cc(CN2CC[C@H]3[C@@H](CCCN3C3CC3)C2)cs1 ZINC000246423666 432129129 /nfs/dbraw/zinc/12/91/29/432129129.db2.gz CGSGRTWAFHLXHU-ZFWWWQNUSA-N 0 3 321.446 3.105 10 5 DGBEHN O=[N+]([O-])C1CN(Cc2ccccc2)C[C@H]1c1ccccc1F ZINC000299805334 285075198 /nfs/dbraw/zinc/07/51/98/285075198.db2.gz JGEJNSUYFKBRNM-RDJZCZTQSA-N 0 3 300.333 3.070 10 5 DGBEHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC([C@H](C)O)CC1 ZINC000470171305 533406387 /nfs/dbraw/zinc/40/63/87/533406387.db2.gz 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431986088 /nfs/dbraw/zinc/98/60/88/431986088.db2.gz DDMOPZAHKQCAPB-HNNXBMFYSA-N 0 3 316.357 3.466 10 5 DGBEHN Cc1c(CN2CC[C@]3(O)CCCC[C@@H]3C2)cccc1[N+](=O)[O-] ZINC000128406215 431993675 /nfs/dbraw/zinc/99/36/75/431993675.db2.gz XMIUFFWVESUOHI-NVXWUHKLSA-N 0 3 304.390 3.030 10 5 DGBEHN CCN1CCC[C@H](Nc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000194380997 432546985 /nfs/dbraw/zinc/54/69/85/432546985.db2.gz FAIPFCRKTWRLCU-LBPRGKRZSA-N 0 3 300.362 3.039 10 5 DGBEHN Cc1c([C@H](C)NCCN2CCCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000156621563 432602980 /nfs/dbraw/zinc/60/29/80/432602980.db2.gz NYUMCVGJQVBYQU-ZFWWWQNUSA-N 0 3 305.422 3.428 10 5 DGBEHN Cc1ccc([C@H](C)NCCN2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000156615550 432603238 /nfs/dbraw/zinc/60/32/38/432603238.db2.gz ZQBHXCBOFSCMSY-GJZGRUSLSA-N 0 3 305.422 3.428 10 5 DGBEHN C[C@@H](NCCCNC(=O)OC(C)(C)C)c1ccccc1[N+](=O)[O-] ZINC000219171282 432662780 /nfs/dbraw/zinc/66/27/80/432662780.db2.gz HWPTVWCEABTNTR-GFCCVEGCSA-N 0 3 323.393 3.160 10 5 DGBEHN O=[N+]([O-])c1ccc2c(c1)[C@H](NCCOCC1CCC1)CCC2 ZINC000570010568 435580375 /nfs/dbraw/zinc/58/03/75/435580375.db2.gz RWMUDDDXBSAVKP-QGZVFWFLSA-N 0 3 304.390 3.379 10 5 DGBEHN CCO[C@@H]1C[C@H](NCc2csc([N+](=O)[O-])c2)C12CCCC2 ZINC000583030557 324304790 /nfs/dbraw/zinc/30/47/90/324304790.db2.gz QRMYEBLAWISQRU-QWHCGFSZSA-N 0 3 310.419 3.484 10 5 DGBEHN C[C@H](NCc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CCCC1 ZINC000184637791 533941162 /nfs/dbraw/zinc/94/11/62/533941162.db2.gz VYWGSIYGAXMRQL-NSHDSACASA-N 0 3 316.361 3.313 10 5 DGBEHN CC(CO)(CO)NCc1cc2cccc3ccc4cccc1c4c32 ZINC000005302065 181227844 /nfs/dbraw/zinc/22/78/44/181227844.db2.gz OSEYMSIUTZBMOP-UHFFFAOYSA-N 0 3 319.404 3.417 10 5 DGBEHN Cc1nccn1CCCN(C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000127286045 284333378 /nfs/dbraw/zinc/33/33/78/284333378.db2.gz LGYDJMMZENMQHC-ZDUSSCGKSA-N 0 3 302.378 3.183 10 5 DGBEHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC(n2ccnc2)CC1 ZINC000109796589 194286892 /nfs/dbraw/zinc/28/68/92/194286892.db2.gz AZKQGLYXYAAEHG-CYBMUJFWSA-N 0 3 300.362 3.189 10 5 DGBEHN COc1cc(CNCCC2=CCCC2)c([N+](=O)[O-])cc1OC ZINC000120158589 195107761 /nfs/dbraw/zinc/10/77/61/195107761.db2.gz ZMCQGDYVDIKITN-UHFFFAOYSA-N 0 3 306.362 3.202 10 5 DGBEHN Cc1c([C@@H](C)NCCN2CCCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000247063975 432197967 /nfs/dbraw/zinc/19/79/67/432197967.db2.gz NYUMCVGJQVBYQU-UKRRQHHQSA-N 0 3 305.422 3.428 10 5 DGBEHN Cc1cc([N+](=O)[O-])ccc1CNC[C@](C)(O)C1CCCCC1 ZINC000191672191 432290320 /nfs/dbraw/zinc/29/03/20/432290320.db2.gz DVTXNVZQGOPXFH-KRWDZBQOSA-N 0 3 306.406 3.324 10 5 DGBEHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN[C@@H](C)[C@H]1CCCO1 ZINC000183154623 432263626 /nfs/dbraw/zinc/26/36/26/432263626.db2.gz XRUBNQBUGFODBY-SWLSCSKDSA-N 0 3 308.378 3.039 10 5 DGBEHN Cc1c(CN2CC[C@]3(O)CCCC[C@H]3C2)cccc1[N+](=O)[O-] ZINC000248056080 432266654 /nfs/dbraw/zinc/26/66/54/432266654.db2.gz XMIUFFWVESUOHI-DOTOQJQBSA-N 0 3 304.390 3.030 10 5 DGBEHN Cc1cc([N+](=O)[O-])ccc1CN1CC[C@@]2(O)CCCC[C@H]2C1 ZINC000248666317 432311803 /nfs/dbraw/zinc/31/18/03/432311803.db2.gz WNZQKYDUOOSPFD-RDJZCZTQSA-N 0 3 304.390 3.030 10 5 DGBEHN C[C@H](CNc1ncc(Cl)cc1[N+](=O)[O-])N1CCCC[C@H]1C ZINC000434950187 238258630 /nfs/dbraw/zinc/25/86/30/238258630.db2.gz GZQWPPMEEBPVJU-GHMZBOCLSA-N 0 3 312.801 3.318 10 5 DGBEHN O=[N+]([O-])c1cccc([C@H](O)CN2CC[C@@H](c3ccccc3)C2)c1 ZINC000246352592 432121680 /nfs/dbraw/zinc/12/16/80/432121680.db2.gz WFRXJXUIGRLSET-SJLPKXTDSA-N 0 3 312.369 3.118 10 5 DGBEHN CC(C)[C@H](C)N[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000016518490 182048416 /nfs/dbraw/zinc/04/84/16/182048416.db2.gz FEONYYWTCYKNIM-VHSXEESVSA-N 0 3 313.785 3.209 10 5 DGBEHN C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000269055363 207204926 /nfs/dbraw/zinc/20/49/26/207204926.db2.gz SCHBZGAQHGMPPT-CKEIUWERSA-N 0 3 304.390 3.283 10 5 DGBEHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@H](C)c1ccncc1 ZINC000610517781 400269263 /nfs/dbraw/zinc/26/92/63/400269263.db2.gz QUPFUKOCKUCAFZ-ZDUSSCGKSA-N 0 3 315.373 3.282 10 5 DGBEHN O=[N+]([O-])C1CN(Cc2ccccc2)C[C@H]1c1cccc(F)c1 ZINC000114031924 400385709 /nfs/dbraw/zinc/38/57/09/400385709.db2.gz REGUWZVPUVLAMT-DLBZAZTESA-N 0 3 300.333 3.070 10 5 DGBEHN CC[C@@H](NCCN1CC=C(C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000358216763 286000052 /nfs/dbraw/zinc/00/00/52/286000052.db2.gz ANRJTXQVHXGUFC-QGZVFWFLSA-N 0 3 303.406 3.288 10 5 DGBEHN C[C@H](CSc1ccc(Br)cc1[N+](=O)[O-])N(C)C ZINC000358850053 286169169 /nfs/dbraw/zinc/16/91/69/286169169.db2.gz FYKJYNLACSJNEI-MRVPVSSYSA-N 0 3 319.224 3.400 10 5 DGBEHN Cc1ccc([C@H](C)NC[C@H](O)CC2CCCC2)cc1[N+](=O)[O-] ZINC000191062682 432215346 /nfs/dbraw/zinc/21/53/46/432215346.db2.gz RFDLBQQXBCYRSP-XJKSGUPXSA-N 0 3 306.406 3.495 10 5 DGBEHN O=[N+]([O-])C1[C@@H](c2ccccc2)Oc2ccc(Cl)cc2[C@@H]1O ZINC000215977675 280353284 /nfs/dbraw/zinc/35/32/84/280353284.db2.gz QPNVLFYMEAMXSZ-QLFBSQMISA-N 0 3 305.717 3.152 10 5 DGBEHN CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H]1CCCO1 ZINC000128025502 431986367 /nfs/dbraw/zinc/98/63/67/431986367.db2.gz DRBXKLKRMWBATI-HNNXBMFYSA-N 0 3 316.357 3.466 10 5 DGBEHN Cc1cc([N+](=O)[O-])ccc1CN1CCC(c2cc[nH]n2)CC1 ZINC000183317388 432281634 /nfs/dbraw/zinc/28/16/34/432281634.db2.gz ZWBYWHYXDRCUSB-UHFFFAOYSA-N 0 3 300.362 3.006 10 5 DGBEHN Cc1cc([C@](C)(O)CNCc2ccc([N+](=O)[O-])cc2C)c(C)o1 ZINC000183482879 432296878 /nfs/dbraw/zinc/29/68/78/432296878.db2.gz JVJOOSPNNTTZNH-QGZVFWFLSA-N 0 3 318.373 3.110 10 5 DGBEHN O=[N+]([O-])c1ccc(CCNCc2c[nH]c(-c3ccccc3)n2)cc1 ZINC000176835263 432556540 /nfs/dbraw/zinc/55/65/40/432556540.db2.gz JDLGNDDJLJPBSL-UHFFFAOYSA-N 0 3 322.368 3.317 10 5 DGBEHN CCN1CCC[C@H](Nc2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000194380642 432546881 /nfs/dbraw/zinc/54/68/81/432546881.db2.gz USLJODVOBBXYOU-LBPRGKRZSA-N 0 3 300.362 3.039 10 5 DGBEHN CC(C)CN1CCC[C@@H]1CNc1ncc([N+](=O)[O-])cc1Cl ZINC000301776653 433720421 /nfs/dbraw/zinc/72/04/21/433720421.db2.gz OPMBIPVRAFSBAN-LLVKDONJSA-N 0 3 312.801 3.176 10 5 DGBEHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC2(C1)CCOCC2 ZINC000459625331 434634881 /nfs/dbraw/zinc/63/48/81/434634881.db2.gz UTXIVXSPKLNXAU-ZROIWOOFSA-N 0 3 302.374 3.111 10 5 DGBEHN C/C(=C\c1cccc([N+](=O)[O-])c1)CNCCOCC1CCC1 ZINC000574130483 434952775 /nfs/dbraw/zinc/95/27/75/434952775.db2.gz PWNNWOOERZVSRB-GXDHUFHOSA-N 0 3 304.390 3.404 10 5 DGBEHN O=[N+]([O-])c1ccn(CCN[C@H](c2ccc(Cl)cc2)C2CC2)n1 ZINC000176203241 312773879 /nfs/dbraw/zinc/77/38/79/312773879.db2.gz JQERAIBGPHHXCS-HNNXBMFYSA-N 0 3 320.780 3.186 10 5 DGBEHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCCN1CC=C(C)CC1 ZINC000545868642 314271053 /nfs/dbraw/zinc/27/10/53/314271053.db2.gz WIBDAKFAQSKMCM-HNNXBMFYSA-N 0 3 303.406 3.206 10 5 DGBEHN OC[C@@H](O)CNCc1ccc2ccc3cccc4ccc1c2c34 ZINC000584614595 400086179 /nfs/dbraw/zinc/08/61/79/400086179.db2.gz RRROFOSTWMHDMA-KRWDZBQOSA-N 0 3 305.377 3.027 10 5 DGBEHN O=[N+]([O-])c1ccccc1Nc1cnn(CCN2CCCCC2)c1 ZINC000092978342 400218644 /nfs/dbraw/zinc/21/86/44/400218644.db2.gz PEAMAFQUWYQSQH-UHFFFAOYSA-N 0 3 315.377 3.021 10 5 DGBEHN Cc1ccc([C@@H](C)NCCN2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000247250543 432214295 /nfs/dbraw/zinc/21/42/95/432214295.db2.gz ZQBHXCBOFSCMSY-HUUCEWRRSA-N 0 3 305.422 3.428 10 5 DGBEHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCCN(C2CC2)CC1 ZINC000182716129 432220984 /nfs/dbraw/zinc/22/09/84/432220984.db2.gz MXNCINUTUJKQKG-CQSZACIVSA-N 0 3 303.406 3.134 10 5 DGBEHN COc1ccc([C@@H](CNc2ccc([N+](=O)[O-])cc2)N(C)C)cc1 ZINC000068838133 431145403 /nfs/dbraw/zinc/14/54/03/431145403.db2.gz RWJSYDKYOIJLOU-QGZVFWFLSA-N 0 3 315.373 3.318 10 5 DGBEHN CC(C)c1noc(CCCN[C@@H](C)c2cccc([N+](=O)[O-])c2)n1 ZINC000173377149 432274447 /nfs/dbraw/zinc/27/44/47/432274447.db2.gz MCLIZKYERDPVRQ-LBPRGKRZSA-N 0 3 318.377 3.385 10 5 DGBEHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@]2(O)CCCC[C@H]2C1 ZINC000248170120 432275069 /nfs/dbraw/zinc/27/50/69/432275069.db2.gz UPDIYJGJABLBEB-UKPHBRMFSA-N 0 3 304.390 3.283 10 5 DGBEHN Cc1cc([C@@](C)(O)CNCc2ccc([N+](=O)[O-])cc2C)c(C)o1 ZINC000183482859 432297191 /nfs/dbraw/zinc/29/71/91/432297191.db2.gz JVJOOSPNNTTZNH-KRWDZBQOSA-N 0 3 318.373 3.110 10 5 DGBEHN Cc1c(CN2CC[C@@]3(O)CCCC[C@@H]3C2)cccc1[N+](=O)[O-] ZINC000128406449 431993953 /nfs/dbraw/zinc/99/39/53/431993953.db2.gz XMIUFFWVESUOHI-WBVHZDCISA-N 0 3 304.390 3.030 10 5 DGBEHN Cc1cc([N+](=O)[O-])ccc1CNC[C@](C)(O)c1ccc(F)cc1 ZINC000183634492 432311441 /nfs/dbraw/zinc/31/14/41/432311441.db2.gz DELSUSJCINLBFK-KRWDZBQOSA-N 0 3 318.348 3.040 10 5 DGBEHN CCOc1ccc([C@H](C)N[C@H]2CCCN(CC)C2)cc1[N+](=O)[O-] ZINC000153130499 432385231 /nfs/dbraw/zinc/38/52/31/432385231.db2.gz XENAUHCLDYZCAB-ZFWWWQNUSA-N 0 3 321.421 3.128 10 5 DGBEHN CCN1CCC[C@@H](Nc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000194381050 432546518 /nfs/dbraw/zinc/54/65/18/432546518.db2.gz KKIPFBOJVHBLKP-GFCCVEGCSA-N 0 3 300.362 3.039 10 5 DGBEHN Cc1cnc(CCN(C)CCc2ccc([N+](=O)[O-])cc2)s1 ZINC000157698398 432626277 /nfs/dbraw/zinc/62/62/77/432626277.db2.gz PNRGDCHEMUJVOM-UHFFFAOYSA-N 0 3 305.403 3.077 10 5 DGBEHN C[C@H]1CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@H](C)C1 ZINC000178959882 432792207 /nfs/dbraw/zinc/79/22/07/432792207.db2.gz GROMNASWMZYMFM-QWHCGFSZSA-N 0 3 320.389 3.329 10 5 DGBEHN CC[C@H](C)N[C@H](CNc1ccc([N+](=O)[O-])nc1)c1ccco1 ZINC000450527628 434247073 /nfs/dbraw/zinc/24/70/73/434247073.db2.gz HYACTPQRXYVWRW-WCQYABFASA-N 0 3 304.350 3.124 10 5 DGBEHN COC[C@H](NCCc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000539381180 435549490 /nfs/dbraw/zinc/54/94/90/435549490.db2.gz MEXAUKKQOOZYKZ-KRWDZBQOSA-N 0 3 318.348 3.254 10 5 DGBEHN CN(CCNc1cc(F)ccc1[N+](=O)[O-])Cc1ccccc1 ZINC000302789638 546437524 /nfs/dbraw/zinc/43/75/24/546437524.db2.gz FIWQFVCTPXOAED-UHFFFAOYSA-N 0 3 303.337 3.278 10 5 DGBEHN C[C@H](CNc1ncc(Cl)cc1[N+](=O)[O-])N1CCCC[C@@H]1C ZINC000434950190 238258598 /nfs/dbraw/zinc/25/85/98/238258598.db2.gz GZQWPPMEEBPVJU-WDEREUQCSA-N 0 3 312.801 3.318 10 5 DGBEHN C[C@@H]1CN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000246313534 432118620 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COc1ccc([C@H](CNc2ccc([N+](=O)[O-])cc2)N(C)C)cc1 ZINC000068838131 431143764 /nfs/dbraw/zinc/14/37/64/431143764.db2.gz RWJSYDKYOIJLOU-KRWDZBQOSA-N 0 3 315.373 3.318 10 5 DGBEHN Cc1cc([N+](=O)[O-])ccc1CN1CCC(c2ccnn2C)CC1 ZINC000183317282 432281599 /nfs/dbraw/zinc/28/15/99/432281599.db2.gz TWEUFKIFHILPDQ-UHFFFAOYSA-N 0 3 314.389 3.016 10 5 DGBEHN CC[C@H](NCCO[C@H]1CCCCO1)c1cccc([N+](=O)[O-])c1 ZINC000193091734 432448456 /nfs/dbraw/zinc/44/84/56/432448456.db2.gz MGLWXILUYGGEFA-HOTGVXAUSA-N 0 3 308.378 3.179 10 5 DGBEHN CC[C@@H](NCCO[C@H]1CCCCO1)c1cccc([N+](=O)[O-])c1 ZINC000193091747 432449321 /nfs/dbraw/zinc/44/93/21/432449321.db2.gz MGLWXILUYGGEFA-CVEARBPZSA-N 0 3 308.378 3.179 10 5 DGBEHN C[C@@H](CN[C@@H](C)c1ccccc1[N+](=O)[O-])NC(=O)OC(C)(C)C ZINC000227304019 432711533 /nfs/dbraw/zinc/71/15/33/432711533.db2.gz BNJOBSRYZZDCDW-RYUDHWBXSA-N 0 3 323.393 3.159 10 5 DGBEHN CC(=O)c1cc(NCCN2[C@@H](C)CCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000342217878 433542149 /nfs/dbraw/zinc/54/21/49/433542149.db2.gz FVGGXAKYBBIDCH-STQMWFEESA-N 0 3 319.405 3.472 10 5 DGBEHN CCN1CCC[C@@H](Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000180994267 323243296 /nfs/dbraw/zinc/24/32/96/323243296.db2.gz RUCNAYSKXBBIME-LLVKDONJSA-N 0 3 315.320 3.092 10 5 DGBEHN C[C@@H](N[C@H](CC(N)=O)C1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000182014137 323279679 /nfs/dbraw/zinc/27/96/79/323279679.db2.gz CHLMUYLDOUGAAO-MLGOLLRUSA-N 0 3 319.405 3.070 10 5 DGBEHN CN(Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)CC1(CO)CC1 ZINC000188958583 200327229 /nfs/dbraw/zinc/32/72/29/200327229.db2.gz ZRSKLTGSFNKYCQ-UHFFFAOYSA-N 0 3 316.357 3.059 10 5 DGBEHN Cc1nccc(CN2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000449503604 240250939 /nfs/dbraw/zinc/25/09/39/240250939.db2.gz UKFDTAIWQQABQH-OAHLLOKOSA-N 0 3 312.373 3.073 10 5 DGBEHN CC(C)[C@@H](C)N[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000015415250 182000971 /nfs/dbraw/zinc/00/09/71/182000971.db2.gz UKPKGAKNZBGCSU-GHMZBOCLSA-N 0 3 304.350 3.340 10 5 DGBEHN C[C@@H](NCCN(C)Cc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000343918248 254203039 /nfs/dbraw/zinc/20/30/39/254203039.db2.gz VPCFRRSKPITPCG-OAHLLOKOSA-N 0 3 313.401 3.377 10 5 DGBEHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC([C@H](C)O)CC1 ZINC000470171306 533383351 /nfs/dbraw/zinc/38/33/51/533383351.db2.gz IAIQUAAGSBTQDB-ZVHGMHCTSA-N 0 3 304.390 3.091 10 5 DGBEHN Cn1cc2c(n1)CCC[C@@H]2NC/C=C\c1ccccc1[N+](=O)[O-] ZINC000619749274 400898455 /nfs/dbraw/zinc/89/84/55/400898455.db2.gz IJASDERXLKILGC-PKYBCLHXSA-N 0 3 312.373 3.009 10 5 DGBEHN O=[N+]([O-])[C@@]12CN(Cc3ccccc3)C[C@H]1c1ccccc1CC2 ZINC000225911433 400960465 /nfs/dbraw/zinc/96/04/65/400960465.db2.gz YZFQDGILOOBLOO-OALUTQOASA-N 0 3 308.381 3.248 10 5 DGBEHN CC[C@H](NCCN1CC=C(C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000358216762 286000120 /nfs/dbraw/zinc/00/01/20/286000120.db2.gz ANRJTXQVHXGUFC-KRWDZBQOSA-N 0 3 303.406 3.288 10 5 DGBEHN O=[N+]([O-])c1ccc(CCN2CCC[C@@H](c3nccs3)C2)cc1 ZINC000195340135 165367768 /nfs/dbraw/zinc/36/77/68/165367768.db2.gz JQQLFQQHXJUXJP-CQSZACIVSA-N 0 3 317.414 3.473 10 5 DGBEHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC(c2cc[nH]n2)CC1 ZINC000195505624 165372306 /nfs/dbraw/zinc/37/23/06/165372306.db2.gz AEGVBPWELOKLRZ-GFCCVEGCSA-N 0 3 300.362 3.259 10 5 DGBEHN Cc1ccc([C@H](C)NC[C@@H](O)CC2CCCC2)cc1[N+](=O)[O-] ZINC000191062720 432216454 /nfs/dbraw/zinc/21/64/54/432216454.db2.gz RFDLBQQXBCYRSP-BBRMVZONSA-N 0 3 306.406 3.495 10 5 DGBEHN CCOc1cc(NCc2ccc3c(c2)CNC3)ccc1[N+](=O)[O-] ZINC000261898678 432457750 /nfs/dbraw/zinc/45/77/50/432457750.db2.gz OOBVUGHWKUTGJZ-UHFFFAOYSA-N 0 3 313.357 3.209 10 5 DGBEHN Cc1cc([N+](=O)[O-])ccc1CN1CCSC2(CCOCC2)C1 ZINC000186479510 432599255 /nfs/dbraw/zinc/59/92/55/432599255.db2.gz UHKIJYTTYNTRIC-UHFFFAOYSA-N 0 3 322.430 3.001 10 5 DGBEHN Cc1cc([N+](=O)[O-])ccc1CNCCc1nn(C)c2ccccc12 ZINC000187382906 432660784 /nfs/dbraw/zinc/66/07/84/432660784.db2.gz CZQJOVLJRXIFQS-UHFFFAOYSA-N 0 3 324.384 3.122 10 5 DGBEHN C[C@H](O)C[C@H](C)N[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000541226268 314001019 /nfs/dbraw/zinc/00/10/19/314001019.db2.gz XKMWCXBZQURHDZ-SUNYJGFJSA-N 0 3 314.385 3.433 10 5 DGBEHN Cc1ccc([C@@H](C)NCCN2CC=C(C)CC2)cc1[N+](=O)[O-] ZINC000547281247 314352915 /nfs/dbraw/zinc/35/29/15/314352915.db2.gz TZSFRJUMMPOINZ-OAHLLOKOSA-N 0 3 303.406 3.206 10 5 DGBEHN NC[C@@H](OC(=O)c1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1 ZINC000504815200 340152902 /nfs/dbraw/zinc/15/29/02/340152902.db2.gz YNDSTMSKUGSANH-CQSZACIVSA-N 0 3 320.732 3.105 10 5 DGBEHN O=[N+]([O-])c1ccc(Cl)c(CNCC[C@H]2CCSC2)c1 ZINC000704796579 660818586 /nfs/dbraw/zinc/81/85/86/660818586.db2.gz JSODDIXRRPZCTJ-JTQLQIEISA-N 0 3 300.811 3.481 10 5 DGBEHN Cc1ccc(CNCCOCc2ccccc2)cc1[N+](=O)[O-] ZINC000080244708 1176242002 /nfs/dbraw/zinc/24/20/02/1176242002.db2.gz SKGDUZCYOKEKAQ-UHFFFAOYSA-N 0 3 300.358 3.210 10 5 DGBEHN CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)CC1(CO)CC1 ZINC000188960122 200328378 /nfs/dbraw/zinc/32/83/78/200328378.db2.gz VVNWFRWBKSDLNR-UHFFFAOYSA-N 0 3 316.357 3.059 10 5 DGBEHN CC(C)COC1CCN(CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000054328517 283613551 /nfs/dbraw/zinc/61/35/51/283613551.db2.gz IRSNPYKWFXOAKE-UHFFFAOYSA-N 0 3 322.405 3.111 10 5 DGBEHN CC(C)C[C@@H](CN(C)C)NCc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000105436516 194104485 /nfs/dbraw/zinc/10/44/85/194104485.db2.gz OPPCOVIFBOFNQT-ZDUSSCGKSA-N 0 3 313.829 3.314 10 5 DGBEHN CC(C)COCCCNCc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000061558494 184174374 /nfs/dbraw/zinc/17/43/74/184174374.db2.gz QXAUKRXFZSMBPZ-UHFFFAOYSA-N 0 3 300.786 3.401 10 5 DGBEHN CN(C)[C@H]1CCN(C(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000170865684 400778055 /nfs/dbraw/zinc/77/80/55/400778055.db2.gz FQCZSTXZYOBPKM-HNNXBMFYSA-N 0 3 319.408 3.164 10 5 DGBEHN COc1ccc(OCCN[C@H](C)c2ccc(C)o2)c([N+](=O)[O-])c1 ZINC000182570193 432205794 /nfs/dbraw/zinc/20/57/94/432205794.db2.gz JWYYYKMBRMRZNU-GFCCVEGCSA-N 0 3 320.345 3.234 10 5 DGBEHN C[C@H](NCCC(=O)Nc1ccccc1[N+](=O)[O-])c1cccs1 ZINC000192798490 432417386 /nfs/dbraw/zinc/41/73/86/432417386.db2.gz DJWCGAAYIIKODB-NSHDSACASA-N 0 3 319.386 3.336 10 5 DGBEHN Cc1c([C@@H](C)N[C@H](CO)CC2CCCC2)cccc1[N+](=O)[O-] ZINC000511020536 294398821 /nfs/dbraw/zinc/39/88/21/294398821.db2.gz WGTKZISRUIFXEF-HIFRSBDPSA-N 0 3 306.406 3.495 10 5 DGBEHN COC[C@@H](NCCc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000539381181 313909854 /nfs/dbraw/zinc/90/98/54/313909854.db2.gz MEXAUKKQOOZYKZ-QGZVFWFLSA-N 0 3 318.348 3.254 10 5 DGBEHN C[C@@H](N[C@@H](CC(N)=O)C1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000182014100 323279708 /nfs/dbraw/zinc/27/97/08/323279708.db2.gz CHLMUYLDOUGAAO-WBMJQRKESA-N 0 3 319.405 3.070 10 5 DGBEHN C[C@@H]1[C@H](C(F)(F)F)CCN1CCc1ccc([N+](=O)[O-])cc1 ZINC000470952179 244196518 /nfs/dbraw/zinc/19/65/18/244196518.db2.gz BFMJJXWEQPFQGV-ZWNOBZJWSA-N 0 3 302.296 3.410 10 5 DGBEHN CC(C)[C@@H](C)N[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000016518487 182048287 /nfs/dbraw/zinc/04/82/87/182048287.db2.gz FEONYYWTCYKNIM-ZJUUUORDSA-N 0 3 313.785 3.209 10 5 DGBEHN N[C@@H]1CN(Cc2ccccc2Cl)c2ccc([N+](=O)[O-])cc21 ZINC000019795936 182150575 /nfs/dbraw/zinc/15/05/75/182150575.db2.gz ZJQZYFVYPQTINN-CQSZACIVSA-N 0 3 303.749 3.268 10 5 DGBEHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC(Cn2cccn2)CC1 ZINC000105886559 194158007 /nfs/dbraw/zinc/15/80/07/194158007.db2.gz JBAPPXAXNPKELB-CQSZACIVSA-N 0 3 314.389 3.265 10 5 DGBEHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC(Cn2cccn2)CC1 ZINC000105886557 194158087 /nfs/dbraw/zinc/15/80/87/194158087.db2.gz JBAPPXAXNPKELB-AWEZNQCLSA-N 0 3 314.389 3.265 10 5 DGBEHN C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@]2(O)CCCC[C@H]2C1 ZINC000269055367 207204764 /nfs/dbraw/zinc/20/47/64/207204764.db2.gz SCHBZGAQHGMPPT-JKIFEVAISA-N 0 3 304.390 3.283 10 5 DGBEHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC([C@@H](C)O)CC1 ZINC000470171303 533406599 /nfs/dbraw/zinc/40/65/99/533406599.db2.gz IAIQUAAGSBTQDB-JWAFFJSPSA-N 0 3 304.390 3.091 10 5 DGBEHN CC(C)(CO)CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000611521001 400415360 /nfs/dbraw/zinc/41/53/60/400415360.db2.gz RMETUSXCBXQIDL-KRWDZBQOSA-N 0 3 314.385 3.292 10 5 DGBEHN C[C@H](NCCn1cc([N+](=O)[O-])cn1)c1ccc2ccccc2c1 ZINC000130974806 196128847 /nfs/dbraw/zinc/12/88/47/196128847.db2.gz UOSDOEYOJYKRAI-ZDUSSCGKSA-N 0 3 310.357 3.295 10 5 DGBEHN O=[N+]([O-])c1ccc(OCCN2CCC[C@H]2c2ccco2)cc1 ZINC000116296156 431505116 /nfs/dbraw/zinc/50/51/16/431505116.db2.gz ILDSURFWRRDTIG-HNNXBMFYSA-N 0 3 302.330 3.404 10 5 DGBEHN Cc1cc([N+](=O)[O-])ccc1CN1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000183361409 432286879 /nfs/dbraw/zinc/28/68/79/432286879.db2.gz WNZQKYDUOOSPFD-NVXWUHKLSA-N 0 3 304.390 3.030 10 5 DGBEHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN[C@H](C)[C@H]1CCCO1 ZINC000183154642 432263461 /nfs/dbraw/zinc/26/34/61/432263461.db2.gz XRUBNQBUGFODBY-IUODEOHRSA-N 0 3 308.378 3.039 10 5 DGBEHN CC[C@@H](NC[C@@H]1CC2(CCC2)C(=O)O1)c1cccc([N+](=O)[O-])c1 ZINC000192161630 432338431 /nfs/dbraw/zinc/33/84/31/432338431.db2.gz YKEYCPABGCNNNC-LSDHHAIUSA-N 0 3 318.373 3.121 10 5 DGBEHN Cc1c([C@H](C)N[C@@H]2Cc3ccccc3[C@@H]2O)cccc1[N+](=O)[O-] ZINC000178357926 432726274 /nfs/dbraw/zinc/72/62/74/432726274.db2.gz YLFWRAYTCQLOOV-XZOAIXRZSA-N 0 3 312.369 3.212 10 5 DGBEHN Cc1nccn1C[C@H]1CCCN1[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000178292175 432716567 /nfs/dbraw/zinc/71/65/67/432716567.db2.gz WQJBPLXMJGRTAZ-SUMWQHHRSA-N 0 3 314.389 3.325 10 5 DGBEHN C[C@H]1CCN(CCn2cc([N+](=O)[O-])cn2)[C@H]1c1cccc(F)c1 ZINC000245411668 432828347 /nfs/dbraw/zinc/82/83/47/432828347.db2.gz XYOTUOBRPSZROO-BLLLJJGKSA-N 0 3 318.352 3.014 10 5 DGBEHN CC[C@@H](N[C@@H](C)CC(=O)N(CC)CC)c1cccc([N+](=O)[O-])c1 ZINC000161626948 432790347 /nfs/dbraw/zinc/79/03/47/432790347.db2.gz CDERMUJSMAMJEX-XJKSGUPXSA-N 0 3 321.421 3.283 10 5 DGBEHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)C[C@H]1CC=CCC1 ZINC000542243006 314064155 /nfs/dbraw/zinc/06/41/55/314064155.db2.gz KJMQPQRTXUZUII-AWEZNQCLSA-N 0 3 317.389 3.130 10 5 DGBEHN Cc1c([C@@H](C)NCCN2CC=C(C)CC2)cccc1[N+](=O)[O-] ZINC000545157676 314228883 /nfs/dbraw/zinc/22/88/83/314228883.db2.gz LQBVKNJHOWSKON-OAHLLOKOSA-N 0 3 303.406 3.206 10 5 DGBEHN CCCCC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000005458416 181246496 /nfs/dbraw/zinc/24/64/96/181246496.db2.gz SMVSWJSQLSGCPK-UHFFFAOYSA-N 0 3 301.140 3.486 10 5 DGBEHN N[C@H]1CN(Cc2ccccc2Cl)c2ccc([N+](=O)[O-])cc21 ZINC000019795939 182150682 /nfs/dbraw/zinc/15/06/82/182150682.db2.gz ZJQZYFVYPQTINN-AWEZNQCLSA-N 0 3 303.749 3.268 10 5 DGBEHN O=[N+]([O-])C1[C@@H](c2ccccc2)Oc2ccc(Cl)cc2[C@@H]1O ZINC000215977731 285075290 /nfs/dbraw/zinc/07/52/90/285075290.db2.gz QPNVLFYMEAMXSZ-SOUVJXGZSA-N 0 3 305.717 3.152 10 5 DGBEHN O=[N+]([O-])C1CN(Cc2ccccc2)C[C@@H]1c1ccccc1F ZINC000113877272 400382298 /nfs/dbraw/zinc/38/22/98/400382298.db2.gz JGEJNSUYFKBRNM-NVXWUHKLSA-N 0 3 300.333 3.070 10 5 DGBEHN O=[N+]([O-])C1CN(Cc2ccccc2)C[C@@H]1c1cccc(F)c1 ZINC000114031916 400385622 /nfs/dbraw/zinc/38/56/22/400385622.db2.gz REGUWZVPUVLAMT-SJORKVTESA-N 0 3 300.333 3.070 10 5 DGBEHN CC(C)(C)Oc1cc(NCCN2CCCC2)ccc1[N+](=O)[O-] ZINC000359476516 286316556 /nfs/dbraw/zinc/31/65/56/286316556.db2.gz ATKHBDQPZQAHHC-UHFFFAOYSA-N 0 3 307.394 3.280 10 5 DGBEHN COc1cccc(CCN[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)n1 ZINC000361929570 286746154 /nfs/dbraw/zinc/74/61/54/286746154.db2.gz NWUOBSZRWASDRE-CYBMUJFWSA-N 0 3 315.373 3.200 10 5 DGBEHN O=[N+]([O-])c1ccc(Cl)c(CN2CCC(c3ccn[nH]3)CC2)c1 ZINC000172177526 432200909 /nfs/dbraw/zinc/20/09/09/432200909.db2.gz APMNLVOGCFMVKE-UHFFFAOYSA-N 0 3 320.780 3.351 10 5 DGBEHN CC(C)(O)CCN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000480712941 277313451 /nfs/dbraw/zinc/31/34/51/277313451.db2.gz LBKPGVYVQVCCMB-KRWDZBQOSA-N 0 3 314.385 3.435 10 5 DGBEHN Cc1cc([N+](=O)[O-])ccc1CN1CCC(Cn2cccn2)CC1 ZINC000183333535 432283478 /nfs/dbraw/zinc/28/34/78/432283478.db2.gz JHJHGOUKHVVHQB-UHFFFAOYSA-N 0 3 314.389 3.012 10 5 DGBEHN Cc1ccc([C@@H](C)NCCC(=O)Nc2ccc([N+](=O)[O-])cc2)o1 ZINC000192806453 432417098 /nfs/dbraw/zinc/41/70/98/432417098.db2.gz XXOCDXALICKFGV-GFCCVEGCSA-N 0 3 317.345 3.176 10 5 DGBEHN CCOc1ccc([C@H](C)NC[C@H]2CCCC[C@H]2O)cc1[N+](=O)[O-] ZINC000245504540 432837591 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Cc1c([C@H](C)N[C@H](CO)CC2CCCC2)cccc1[N+](=O)[O-] ZINC000511020538 294398918 /nfs/dbraw/zinc/39/89/18/294398918.db2.gz WGTKZISRUIFXEF-ZFWWWQNUSA-N 0 3 306.406 3.495 10 5 DGBEHN CC1=CCN(CCNCc2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000545151331 314228466 /nfs/dbraw/zinc/22/84/66/314228466.db2.gz REORLXPGOUIUML-UHFFFAOYSA-N 0 3 317.433 3.460 10 5 DGBEHN C[C@H](NCCc1ccc([N+](=O)[O-])cc1)c1cn2ccccc2n1 ZINC000556232866 314749528 /nfs/dbraw/zinc/74/95/28/314749528.db2.gz DCHFODNHFRWLOV-ZDUSSCGKSA-N 0 3 310.357 3.136 10 5 DGBEHN CCOC[C@@H](NCc1cc(Cl)ccc1[N+](=O)[O-])C(C)C ZINC000233733949 1202602883 /nfs/dbraw/zinc/60/28/83/1202602883.db2.gz ISSBRVMRYJZDDE-CYBMUJFWSA-N 0 3 300.786 3.399 10 5 DGBEHN Cc1cc([N+](=O)[O-])ccc1CN1CCC([C@H]2CCCO2)CC1 ZINC000188281393 200221617 /nfs/dbraw/zinc/22/16/17/200221617.db2.gz WFOAVNZIGACFBH-QGZVFWFLSA-N 0 3 304.390 3.294 10 5 DGBEHN Cc1ccc([N+](=O)[O-])cc1[C@@H](N)c1cncc(Br)c1 ZINC000040177386 183044033 /nfs/dbraw/zinc/04/40/33/183044033.db2.gz GMESYKIKSYSPNX-ZDUSSCGKSA-N 0 3 322.162 3.109 10 5 DGBEHN C[C@@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)(C)C ZINC000074317708 400504198 /nfs/dbraw/zinc/50/41/98/400504198.db2.gz FYMIASFHESGCSI-SECBINFHSA-N 0 3 313.785 3.211 10 5 DGBEHN O=[N+]([O-])c1cnc2c(c1)CN(C[C@@H]1CCc3ccccc3C1)CC2 ZINC000612469092 400550742 /nfs/dbraw/zinc/55/07/42/400550742.db2.gz KOKNUKJOJGPFJG-CQSZACIVSA-N 0 3 323.396 3.153 10 5 DGBEHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC(c2ccnn2C)CC1 ZINC000195502465 165372425 /nfs/dbraw/zinc/37/24/25/165372425.db2.gz WMAXOQOYMBYVDB-CYBMUJFWSA-N 0 3 314.389 3.269 10 5 DGBEHN O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@@H]1Cc3ccccc3[C@@H]1O)CCC2 ZINC000192871209 275038403 /nfs/dbraw/zinc/03/84/03/275038403.db2.gz HSQKMYODWBHBTC-QRVBRYPASA-N 0 3 324.380 3.220 10 5 DGBEHN Cc1sc(C(=O)Nc2cccc(CN(C)C)c2)cc1[N+](=O)[O-] ZINC000047454146 431909952 /nfs/dbraw/zinc/90/99/52/431909952.db2.gz CYYZQGDUCOWSGT-UHFFFAOYSA-N 0 3 319.386 3.279 10 5 DGBEHN CC(C)C[C@H](NCCn1cc([N+](=O)[O-])cn1)c1cccs1 ZINC000090538395 431892976 /nfs/dbraw/zinc/89/29/76/431892976.db2.gz DLURATSKSCLXHC-ZDUSSCGKSA-N 0 3 308.407 3.230 10 5 DGBEHN Cc1c(CN[C@H]2CCCC[C@H]2n2cccn2)cccc1[N+](=O)[O-] ZINC000128349352 431992482 /nfs/dbraw/zinc/99/24/82/431992482.db2.gz CWXQCZYHCFUXGY-DOTOQJQBSA-N 0 3 314.389 3.373 10 5 DGBEHN Cc1nccn1C[C@H]1CCCN1Cc1ccc([N+](=O)[O-])cc1C ZINC000183385494 432289053 /nfs/dbraw/zinc/28/90/53/432289053.db2.gz HRDIFMTZSLTKFP-QGZVFWFLSA-N 0 3 314.389 3.073 10 5 DGBEHN O=[N+]([O-])c1ccccc1CN[C@@H]1CCCC[C@@H]1n1cccn1 ZINC000128566472 431996189 /nfs/dbraw/zinc/99/61/89/431996189.db2.gz KMTCGOCQIJOOBF-ZBFHGGJFSA-N 0 3 300.362 3.065 10 5 DGBEHN C[C@@H]1CCN(CCn2cc([N+](=O)[O-])cn2)[C@@H]1c1cccc(F)c1 ZINC000175152810 432404483 /nfs/dbraw/zinc/40/44/83/432404483.db2.gz XYOTUOBRPSZROO-WBMJQRKESA-N 0 3 318.352 3.014 10 5 DGBEHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@H](C)C1CCCC1 ZINC000184631238 432414429 /nfs/dbraw/zinc/41/44/29/432414429.db2.gz AVGCIHQHTKNMSG-GFCCVEGCSA-N 0 3 305.378 3.010 10 5 DGBEHN Cc1c([C@H](C)NCCN2CC=C(C)CC2)cccc1[N+](=O)[O-] ZINC000545157672 314228630 /nfs/dbraw/zinc/22/86/30/314228630.db2.gz LQBVKNJHOWSKON-HNNXBMFYSA-N 0 3 303.406 3.206 10 5 DGBEHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC2(C1)CCOCC2 ZINC000459625329 500571629 /nfs/dbraw/zinc/57/16/29/500571629.db2.gz UTXIVXSPKLNXAU-NTEUORMPSA-N 0 3 302.374 3.111 10 5 DGBEHN Cc1cc([C@@H](N)c2cncc(Br)c2)cc([N+](=O)[O-])c1 ZINC000095620332 185382728 /nfs/dbraw/zinc/38/27/28/185382728.db2.gz MKUJSHDDJWLAKW-CYBMUJFWSA-N 0 3 322.162 3.109 10 5 DGBEHN CN(Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C[C@@H]1CC=CCC1 ZINC000444681259 530022835 /nfs/dbraw/zinc/02/28/35/530022835.db2.gz TUBPQFZTAMNWJD-GFCCVEGCSA-N 0 3 300.362 3.259 10 5 DGBEHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CCSC2(CCOCC2)C1 ZINC000186844520 200020889 /nfs/dbraw/zinc/02/08/89/200020889.db2.gz XBNHCOIHGJJJHF-CYBMUJFWSA-N 0 3 322.430 3.254 10 5 DGBEHN COc1ccc(OCCN2CCCC23CCC3)c([N+](=O)[O-])c1 ZINC000444783696 239354810 /nfs/dbraw/zinc/35/48/10/239354810.db2.gz 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ZINC000128349129 278596529 /nfs/dbraw/zinc/59/65/29/278596529.db2.gz CWXQCZYHCFUXGY-NVXWUHKLSA-N 0 3 314.389 3.373 10 5 DGBEHN O=[N+]([O-])c1cc(Cl)ccc1CN1CCC(c2ccn[nH]2)CC1 ZINC000116275279 431500051 /nfs/dbraw/zinc/50/00/51/431500051.db2.gz GXVODWAMJWPXHS-UHFFFAOYSA-N 0 3 320.780 3.351 10 5 DGBEHN COc1ccc([C@@H](CNc2ccccc2[N+](=O)[O-])N(C)C)cc1 ZINC000025777834 431665873 /nfs/dbraw/zinc/66/58/73/431665873.db2.gz DICASZDMFDONOQ-QGZVFWFLSA-N 0 3 315.373 3.318 10 5 DGBEHN C[C@H](NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCCC1 ZINC000184650932 432415864 /nfs/dbraw/zinc/41/58/64/432415864.db2.gz NHGCKEGYHKBWCR-NSHDSACASA-N 0 3 316.361 3.313 10 5 DGBEHN O=[N+]([O-])c1cccc([C@@H](O)CN2CCC[C@@H]2c2ccco2)c1 ZINC000154318937 432491007 /nfs/dbraw/zinc/49/10/07/432491007.db2.gz CZRUQDLOMYHWFR-CABCVRRESA-N 0 3 302.330 3.058 10 5 DGBEHN CCN1CCc2c(cccc2Nc2cc(C)c([N+](=O)[O-])cn2)C1 ZINC000301679207 433673019 /nfs/dbraw/zinc/67/30/19/433673019.db2.gz DYIHVDWPOHOVEA-UHFFFAOYSA-N 0 3 312.373 3.420 10 5 DGBEHN Cc1c([C@@H](C)N[C@@H](CO)CC2CCCC2)cccc1[N+](=O)[O-] ZINC000511020537 294399099 /nfs/dbraw/zinc/39/90/99/294399099.db2.gz WGTKZISRUIFXEF-UKRRQHHQSA-N 0 3 306.406 3.495 10 5 DGBEHN CC(=O)c1cc(NCCN2CCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000286303284 434224958 /nfs/dbraw/zinc/22/49/58/434224958.db2.gz YNHAMJKJUYHOFN-LBPRGKRZSA-N 0 3 305.378 3.084 10 5 DGBEHN Cc1cc(NCCOCC2CCC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000564789438 315199978 /nfs/dbraw/zinc/19/99/78/315199978.db2.gz CXKANKOARKKDRD-UHFFFAOYSA-N 0 3 315.373 3.102 10 5 DGBEHN CCO[C@H]1C[C@H](NCc2csc([N+](=O)[O-])c2)C12CCCC2 ZINC000583030558 324305167 /nfs/dbraw/zinc/30/51/67/324305167.db2.gz QRMYEBLAWISQRU-STQMWFEESA-N 0 3 310.419 3.484 10 5 DGBEHN C[C@@H]1CN(Cc2ccccc2)CCN1c1ccc([N+](=O)[O-])cc1 ZINC000309678650 1199708927 /nfs/dbraw/zinc/70/89/27/1199708927.db2.gz YGEVBFNFUBGXEI-OAHLLOKOSA-N 0 3 311.385 3.306 10 5 DGBEHN CN(C)[C@H](CNCc1ccc(Cl)c([N+](=O)[O-])c1)c1ccco1 ZINC000237014124 202121365 /nfs/dbraw/zinc/12/13/65/202121365.db2.gz 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432163271 /nfs/dbraw/zinc/16/32/71/432163271.db2.gz PGOAYXXHARDLRY-MGPLVRAMSA-N 0 3 322.311 3.257 10 5 DGBEHN CC[C@H](N[C@H](C)CC(=O)N(CC)CC)c1cccc([N+](=O)[O-])c1 ZINC000090918446 431898133 /nfs/dbraw/zinc/89/81/33/431898133.db2.gz CDERMUJSMAMJEX-CJNGLKHVSA-N 0 3 321.421 3.283 10 5 DGBEHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@@]2(O)CCCC[C@@H]2C1 ZINC000248170121 432274364 /nfs/dbraw/zinc/27/43/64/432274364.db2.gz UPDIYJGJABLBEB-UNEWFSDZSA-N 0 3 304.390 3.283 10 5 DGBEHN CC[C@@H](NCCO[C@@H]1CCCCO1)c1cccc([N+](=O)[O-])c1 ZINC000193091725 432447034 /nfs/dbraw/zinc/44/70/34/432447034.db2.gz MGLWXILUYGGEFA-HZPDHXFCSA-N 0 3 308.378 3.179 10 5 DGBEHN C[C@H](CN[C@@H](C)c1ccccc1[N+](=O)[O-])NC(=O)OC(C)(C)C ZINC000227304025 432711995 /nfs/dbraw/zinc/71/19/95/432711995.db2.gz BNJOBSRYZZDCDW-NEPJUHHUSA-N 0 3 323.393 3.159 10 5 DGBEHN CCOc1ccc([C@H](C)N[C@H](C)[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000245508075 432838050 /nfs/dbraw/zinc/83/80/50/432838050.db2.gz REKUIEQDECPCMT-YWPYICTPSA-N 0 3 308.378 3.212 10 5 DGBEHN CN(C)[C@H](CNc1cc(F)ccc1[N+](=O)[O-])c1ccccc1 ZINC000302870927 433888427 /nfs/dbraw/zinc/88/84/27/433888427.db2.gz YVBCYHKQFLYBSC-MRXNPFEDSA-N 0 3 303.337 3.449 10 5 DGBEHN C[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])nc2)CN1Cc1ccccc1 ZINC000398001422 434451259 /nfs/dbraw/zinc/45/12/59/434451259.db2.gz WLPJQIABSYNJLH-BBRMVZONSA-N 0 3 312.373 3.065 10 5 DGBEHN C[C@H](N[C@H](CC(N)=O)C1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000182014117 323279415 /nfs/dbraw/zinc/27/94/15/323279415.db2.gz CHLMUYLDOUGAAO-BLLLJJGKSA-N 0 3 319.405 3.070 10 5 DGBEHN Cc1cc([C@H](N)c2cncc(Br)c2)cc([N+](=O)[O-])c1 ZINC000095620331 185382771 /nfs/dbraw/zinc/38/27/71/185382771.db2.gz MKUJSHDDJWLAKW-ZDUSSCGKSA-N 0 3 322.162 3.109 10 5 DGBEHN C[C@H]1[C@H](Nc2ccncc2[N+](=O)[O-])CCN1Cc1ccccc1 ZINC000309883241 231106938 /nfs/dbraw/zinc/10/69/38/231106938.db2.gz KGDBLVORHUVZRX-DZGCQCFKSA-N 0 3 312.373 3.065 10 5 DGBEHN C[C@H](NC[C@H](O)c1cc(F)ccc1F)c1cccc([N+](=O)[O-])c1 ZINC000180444660 199160067 /nfs/dbraw/zinc/16/00/67/199160067.db2.gz KSPNQNHAMUJVEV-QFYYESIMSA-N 0 3 322.311 3.257 10 5 DGBEHN O=[N+]([O-])c1cc(CN2CC[C@@H]3[C@H](CCCN3C3CC3)C2)cs1 ZINC000134880337 432087914 /nfs/dbraw/zinc/08/79/14/432087914.db2.gz CGSGRTWAFHLXHU-UKRRQHHQSA-N 0 3 321.446 3.105 10 5 DGBEHN Cc1cc([N+](=O)[O-])ccc1CNCC[C@@](C)(O)c1ccccc1 ZINC000189823314 432094401 /nfs/dbraw/zinc/09/44/01/432094401.db2.gz OQXHJGGUVNAHAH-GOSISDBHSA-N 0 3 314.385 3.291 10 5 DGBEHN Cc1nccc(CN2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000449503602 240251236 /nfs/dbraw/zinc/25/12/36/240251236.db2.gz UKFDTAIWQQABQH-HNNXBMFYSA-N 0 3 312.373 3.073 10 5 DGBEHN N[C@H]1CN(Cc2ccc(Cl)cc2)c2ccc([N+](=O)[O-])cc21 ZINC000019795930 182150876 /nfs/dbraw/zinc/15/08/76/182150876.db2.gz VXFDCHDJSCBUEC-AWEZNQCLSA-N 0 3 303.749 3.268 10 5 DGBEHN C/C(=C\c1cccc([N+](=O)[O-])c1)CNCCO[C@H]1CC1(F)F ZINC000594972075 401214541 /nfs/dbraw/zinc/21/45/41/401214541.db2.gz XTVIVAHSKVSRKZ-OIOXUXFSSA-N 0 3 312.316 3.012 10 5 DGBEHN Cc1c(CN2CCC(c3cc[nH]n3)CC2)cccc1[N+](=O)[O-] ZINC000195507549 165371728 /nfs/dbraw/zinc/37/17/28/165371728.db2.gz JJDHMFLQZGBWPU-UHFFFAOYSA-N 0 3 300.362 3.006 10 5 DGBEHN CCC[C@H](NCC[C@@H](C)[S@](C)=O)c1cccc([N+](=O)[O-])c1 ZINC000090469307 431892116 /nfs/dbraw/zinc/89/21/16/431892116.db2.gz CBYWVXPHEJIRPC-PYDTXJQDSA-N 0 3 312.435 3.183 10 5 DGBEHN CCC[C@H](NCC[C@H](C)[S@](C)=O)c1cccc([N+](=O)[O-])c1 ZINC000090469309 431892192 /nfs/dbraw/zinc/89/21/92/431892192.db2.gz CBYWVXPHEJIRPC-HCQWSFJTSA-N 0 3 312.435 3.183 10 5 DGBEHN C[C@@H]1CCN(CCn2ccc([N+](=O)[O-])n2)[C@@H]1c1cccc(F)c1 ZINC000176288029 432507632 /nfs/dbraw/zinc/50/76/32/432507632.db2.gz XOHXFHQNNPHPAQ-WBMJQRKESA-N 0 3 318.352 3.014 10 5 DGBEHN COc1cc(N[C@H](C)CN2CCCCC2)c([N+](=O)[O-])cc1F ZINC000301620281 433642291 /nfs/dbraw/zinc/64/22/91/433642291.db2.gz MHVBBEQAXDITPQ-LLVKDONJSA-N 0 3 311.357 3.029 10 5 DGBEHN COc1cc(N[C@@H](C)CN2CCCCC2)c([N+](=O)[O-])cc1F ZINC000301620282 433643045 /nfs/dbraw/zinc/64/30/45/433643045.db2.gz MHVBBEQAXDITPQ-NSHDSACASA-N 0 3 311.357 3.029 10 5 DGBEHN Cc1nc(N[C@@H](C)CN(C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000301980351 433809706 /nfs/dbraw/zinc/80/97/06/433809706.db2.gz AOWHHKLNFWNOCG-ZDUSSCGKSA-N 0 3 314.389 3.231 10 5 DGBEHN Cc1c([C@H](C)N[C@@H](CO)CC2CCCC2)cccc1[N+](=O)[O-] ZINC000511020535 294398781 /nfs/dbraw/zinc/39/87/81/294398781.db2.gz WGTKZISRUIFXEF-DZGCQCFKSA-N 0 3 306.406 3.495 10 5 DGBEHN COc1cccc(CCN[C@H](C)c2cccc([N+](=O)[O-])c2C)n1 ZINC000361926104 500859928 /nfs/dbraw/zinc/85/99/28/500859928.db2.gz PWHIGHMERYSGHY-CYBMUJFWSA-N 0 3 315.373 3.200 10 5 DGBEHN CC(C)[C@H](C)N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000016519024 182048568 /nfs/dbraw/zinc/04/85/68/182048568.db2.gz PLOBQCCBCHTILX-VHSXEESVSA-N 0 3 313.785 3.209 10 5 DGBEHN N[C@@H]1CN(Cc2cccc(Cl)c2)c2ccc([N+](=O)[O-])cc21 ZINC000019795932 182150631 /nfs/dbraw/zinc/15/06/31/182150631.db2.gz BKDYGMNBNCUCMC-CQSZACIVSA-N 0 3 303.749 3.268 10 5 DGBEHN C[C@H](c1ccc(Cl)cc1)N(C)CCn1cc([N+](=O)[O-])cn1 ZINC000157597923 197200427 /nfs/dbraw/zinc/20/04/27/197200427.db2.gz CHWAOEJOEVMUAQ-LLVKDONJSA-N 0 3 308.769 3.138 10 5 DGBEHN Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@@H]2CN2CCCCC2)n1 ZINC000614517859 400910412 /nfs/dbraw/zinc/91/04/12/400910412.db2.gz CEAHPDCSLJCGLI-OAHLLOKOSA-N 0 3 318.421 3.061 10 5 DGBEHN C[C@H](NCc1cc(F)ccc1[N+](=O)[O-])[C@@H]1COc2ccccc21 ZINC000185641131 165011045 /nfs/dbraw/zinc/01/10/45/165011045.db2.gz DUFMAMKFMTVUFP-NHYWBVRUSA-N 0 3 316.332 3.388 10 5 DGBEHN O=[N+]([O-])c1ccc(F)cc1CN[C@H]1CCCC[C@H]1n1cccn1 ZINC000187766466 165103934 /nfs/dbraw/zinc/10/39/34/165103934.db2.gz DVLNNWCESYOASQ-GOEBONIOSA-N 0 3 318.352 3.204 10 5 DGBEHN COc1ccc(OCCN[C@@H](C)c2cccs2)c([N+](=O)[O-])c1 ZINC000182546180 432203251 /nfs/dbraw/zinc/20/32/51/432203251.db2.gz JKZLGYUQCUOYLS-NSHDSACASA-N 0 3 322.386 3.395 10 5 DGBEHN Cc1ccc([C@@H](C)NC[C@@H](O)CC2CCCC2)cc1[N+](=O)[O-] ZINC000191062704 432215337 /nfs/dbraw/zinc/21/53/37/432215337.db2.gz RFDLBQQXBCYRSP-CJNGLKHVSA-N 0 3 306.406 3.495 10 5 DGBEHN O=[N+]([O-])c1cccc(OCCN2CCC[C@H]2c2ccco2)c1 ZINC000116292271 431500831 /nfs/dbraw/zinc/50/08/31/431500831.db2.gz QZPKNKXOZYAEOE-HNNXBMFYSA-N 0 3 302.330 3.404 10 5 DGBEHN O=[N+]([O-])C1[C@H](O)c2cc(Cl)ccc2O[C@@H]1c1ccccc1 ZINC000196489239 280353234 /nfs/dbraw/zinc/35/32/34/280353234.db2.gz QPNVLFYMEAMXSZ-RBSFLKMASA-N 0 3 305.717 3.152 10 5 DGBEHN O=[N+]([O-])c1ccc(CN(C[C@H]2CCCO2)[C@@H]2CCSC2)cc1 ZINC000123567991 431867827 /nfs/dbraw/zinc/86/78/27/431867827.db2.gz RXPPQZKSTOLVQV-HZPDHXFCSA-N 0 3 322.430 3.081 10 5 DGBEHN CC(C)COC1CCN(CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000054341963 431970775 /nfs/dbraw/zinc/97/07/75/431970775.db2.gz DKFWDHQBAXVJKT-UHFFFAOYSA-N 0 3 322.405 3.111 10 5 DGBEHN C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)CCC(=O)OC(C)(C)C ZINC000055058553 431975325 /nfs/dbraw/zinc/97/53/25/431975325.db2.gz QIHSUZNSXDAQJT-LBPRGKRZSA-N 0 3 308.378 3.319 10 5 DGBEHN COc1ccc(CN(C)CCc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000055025037 431975378 /nfs/dbraw/zinc/97/53/78/431975378.db2.gz IDODGGYNXKNBMZ-UHFFFAOYSA-N 0 3 318.348 3.417 10 5 DGBEHN Cc1cc([N+](=O)[O-])ccc1CN1CCC[C@@H](c2cc[nH]n2)C1 ZINC000183289060 432278099 /nfs/dbraw/zinc/27/80/99/432278099.db2.gz XOWWGHNRAAYJKE-CQSZACIVSA-N 0 3 300.362 3.006 10 5 DGBEHN CC(C)c1ccc([C@H](C)NCCn2ccc([N+](=O)[O-])n2)cc1 ZINC000176194538 432500202 /nfs/dbraw/zinc/50/02/02/432500202.db2.gz NFKIHFUVSGYOKR-ZDUSSCGKSA-N 0 3 302.378 3.266 10 5 DGBEHN Cc1c([C@H](C)N[C@H]2Cc3ccccc3[C@@H]2O)cccc1[N+](=O)[O-] ZINC000178357958 432725385 /nfs/dbraw/zinc/72/53/85/432725385.db2.gz YLFWRAYTCQLOOV-IWEFOYFVSA-N 0 3 312.369 3.212 10 5 DGBEHN CCOc1ccc([C@H](C)N[C@@H](C)[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000245508073 432837891 /nfs/dbraw/zinc/83/78/91/432837891.db2.gz REKUIEQDECPCMT-SLEUVZQESA-N 0 3 308.378 3.212 10 5 DGBEHN CC(=O)c1ccc(NCCN2[C@H](C)CCC[C@H]2C)c([N+](=O)[O-])c1 ZINC000341135803 432972310 /nfs/dbraw/zinc/97/23/10/432972310.db2.gz YUVKCDFITLIAFH-CHWSQXEVSA-N 0 3 319.405 3.472 10 5 DGBEHN CC[C@@H](C)N[C@@H](CNc1ccc([N+](=O)[O-])nc1)c1ccco1 ZINC000450527629 434247263 /nfs/dbraw/zinc/24/72/63/434247263.db2.gz HYACTPQRXYVWRW-YPMHNXCESA-N 0 3 304.350 3.124 10 5 DGBEHN O=[N+]([O-])c1cccc(Cl)c1CNC1(CCO)CCCCC1 ZINC000492059664 434908504 /nfs/dbraw/zinc/90/85/04/434908504.db2.gz HJGNZSPYVTZUBC-UHFFFAOYSA-N 0 3 312.797 3.423 10 5 DGBEHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)C[C@@H]1CC=CCC1 ZINC000542243011 314064118 /nfs/dbraw/zinc/06/41/18/314064118.db2.gz KJMQPQRTXUZUII-CQSZACIVSA-N 0 3 317.389 3.130 10 5 DGBEHN CCO[C@@H]1C[C@@H](NCc2csc([N+](=O)[O-])c2)C12CCCC2 ZINC000583030555 324304852 /nfs/dbraw/zinc/30/48/52/324304852.db2.gz QRMYEBLAWISQRU-CHWSQXEVSA-N 0 3 310.419 3.484 10 5 DGBEHN