smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[NH+](C)c1ccc(NCc2cccc3ccccc32)cc1 ZINC000008701108 170346764 /nfs/dbraw/zinc/34/67/64/170346764.db2.gz XMYMVFPGXDCBBO-UHFFFAOYSA-N 1 2 276.383 4.518 20 0 CJADLO Fc1ccc(Oc2ccc(CNc3cccc[nH+]3)cc2)cc1 ZINC000019777823 328850523 /nfs/dbraw/zinc/85/05/23/328850523.db2.gz HQMSZVIZELTNDM-UHFFFAOYSA-N 1 2 294.329 4.625 20 0 CJADLO Cc1nc([C@H](C)[NH2+][C@H](C)c2ccccc2Cl)c(C)s1 ZINC000020124140 171005848 /nfs/dbraw/zinc/00/58/48/171005848.db2.gz ZLORRRJBRNZYCF-ZJUUUORDSA-N 1 2 294.851 4.825 20 0 CJADLO Cc1nc([C@H](C)[NH2+][C@@H](C)c2ccccc2Cl)c(C)s1 ZINC000020124141 171005345 /nfs/dbraw/zinc/00/53/45/171005345.db2.gz ZLORRRJBRNZYCF-UWVGGRQHSA-N 1 2 294.851 4.825 20 0 CJADLO Cc1nc([C@@H](C)[NH2+][C@H](C)c2ccccc2Cl)c(C)s1 ZINC000020124142 171005839 /nfs/dbraw/zinc/00/58/39/171005839.db2.gz ZLORRRJBRNZYCF-NXEZZACHSA-N 1 2 294.851 4.825 20 0 CJADLO Cc1nc([C@@H](C)[NH2+][C@@H](C)c2ccccc2Cl)c(C)s1 ZINC000020124143 171006255 /nfs/dbraw/zinc/00/62/55/171006255.db2.gz ZLORRRJBRNZYCF-VHSXEESVSA-N 1 2 294.851 4.825 20 0 CJADLO Clc1ccccc1CNc1ccc2ccccc2[nH+]1 ZINC000020551917 171247492 /nfs/dbraw/zinc/24/74/92/171247492.db2.gz NCZGKILFXRMXPC-UHFFFAOYSA-N 1 2 268.747 4.500 20 0 CJADLO C[C@@H](Nc1cccc(Cl)c1)c1ccc(-n2cc[nH+]c2)cc1 ZINC000020558168 262312247 /nfs/dbraw/zinc/31/22/47/262312247.db2.gz HNNYTNDWPWDDEJ-CYBMUJFWSA-N 1 2 297.789 4.699 20 0 CJADLO C[C@H](Nc1cccc(Cl)c1)c1ccc(-n2cc[nH+]c2)cc1 ZINC000020558169 262250757 /nfs/dbraw/zinc/25/07/57/262250757.db2.gz HNNYTNDWPWDDEJ-ZDUSSCGKSA-N 1 2 297.789 4.699 20 0 CJADLO c1c(CNc2ccccc2-c2ccccc2)[nH+]c2ccccn12 ZINC000021305384 171302198 /nfs/dbraw/zinc/30/21/98/171302198.db2.gz WIIUTJHSKDTVRD-UHFFFAOYSA-N 1 2 299.377 4.613 20 0 CJADLO C[C@@H](Nc1cccc[nH+]1)c1ccc(Cl)cc1Cl ZINC000022147397 171357400 /nfs/dbraw/zinc/35/74/00/171357400.db2.gz RSPLGQGCQOGBMD-SECBINFHSA-N 1 2 267.159 4.562 20 0 CJADLO C[C@H](Nc1cccc[nH+]1)c1ccc(Cl)cc1Cl ZINC000022147400 171357088 /nfs/dbraw/zinc/35/70/88/171357088.db2.gz RSPLGQGCQOGBMD-VIFPVBQESA-N 1 2 267.159 4.562 20 0 CJADLO C[C@H](Nc1ccc([NH+]2CCCC2)cc1)c1ccc(F)cc1 ZINC000035019281 171937823 /nfs/dbraw/zinc/93/78/23/171937823.db2.gz YPQPEXIGCPMTDF-AWEZNQCLSA-N 1 2 284.378 4.599 20 0 CJADLO C[C@H](Nc1ccc([NH+](C)C)cc1)c1ccccc1Cl ZINC000035164238 172025502 /nfs/dbraw/zinc/02/55/02/172025502.db2.gz JNQQCVLUCZSREY-LBPRGKRZSA-N 1 2 274.795 4.579 20 0 CJADLO C[C@@H](Nc1ccc([NH+](C)C)cc1)c1ccccc1Cl ZINC000035164240 172025569 /nfs/dbraw/zinc/02/55/69/172025569.db2.gz JNQQCVLUCZSREY-GFCCVEGCSA-N 1 2 274.795 4.579 20 0 CJADLO Cc1nc([C@@H](C)[NH2+][C@@H](C)c2ccccc2Cl)cs1 ZINC000036915249 527032591 /nfs/dbraw/zinc/03/25/91/527032591.db2.gz YGIWTLHYKDUSKH-VHSXEESVSA-N 1 2 280.824 4.517 20 0 CJADLO Cc1nc([C@H](C)[NH2+][C@@H](C)c2ccccc2Cl)cs1 ZINC000036915250 527066294 /nfs/dbraw/zinc/06/62/94/527066294.db2.gz YGIWTLHYKDUSKH-UWVGGRQHSA-N 1 2 280.824 4.517 20 0 CJADLO Cc1nc([C@@H](C)[NH2+][C@H](C)c2ccccc2Cl)cs1 ZINC000036915251 527034303 /nfs/dbraw/zinc/03/43/03/527034303.db2.gz YGIWTLHYKDUSKH-NXEZZACHSA-N 1 2 280.824 4.517 20 0 CJADLO Cc1nc([C@H](C)[NH2+][C@H](C)c2ccccc2Cl)cs1 ZINC000036915252 527066979 /nfs/dbraw/zinc/06/69/79/527066979.db2.gz YGIWTLHYKDUSKH-ZJUUUORDSA-N 1 2 280.824 4.517 20 0 CJADLO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1cc(F)ccc1F ZINC000036921856 330313902 /nfs/dbraw/zinc/31/39/02/330313902.db2.gz PEOQDYVJAHCRIL-UWVGGRQHSA-N 1 2 297.295 4.655 20 0 CJADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1cc(F)ccc1F ZINC000036921857 330313862 /nfs/dbraw/zinc/31/38/62/330313862.db2.gz PEOQDYVJAHCRIL-ZJUUUORDSA-N 1 2 297.295 4.655 20 0 CJADLO C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1F)c1c(F)cccc1F ZINC000036921858 330313874 /nfs/dbraw/zinc/31/38/74/330313874.db2.gz PEOQDYVJAHCRIL-VHSXEESVSA-N 1 2 297.295 4.655 20 0 CJADLO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1F)c1cc(F)ccc1F ZINC000036921859 330313774 /nfs/dbraw/zinc/31/37/74/330313774.db2.gz PEOQDYVJAHCRIL-NXEZZACHSA-N 1 2 297.295 4.655 20 0 CJADLO C[C@H]([NH2+]Cc1c(F)cccc1Cl)c1cc(F)ccc1F ZINC000036921967 330313961 /nfs/dbraw/zinc/31/39/61/330313961.db2.gz ZAAKLCZUZBFLMU-VIFPVBQESA-N 1 2 299.723 4.608 20 0 CJADLO C[C@@H]([NH2+]Cc1c(F)cccc1Cl)c1cc(F)ccc1F ZINC000036921968 330313930 /nfs/dbraw/zinc/31/39/30/330313930.db2.gz ZAAKLCZUZBFLMU-SECBINFHSA-N 1 2 299.723 4.608 20 0 CJADLO Cc1ccc([C@@H](C)[NH2+][C@H](c2ccco2)c2ccccc2)o1 ZINC000036960257 260057696 /nfs/dbraw/zinc/05/76/96/260057696.db2.gz HPBCELJPAXKKNS-KDOFPFPSSA-N 1 2 281.355 4.621 20 0 CJADLO Cc1ccc([C@H](C)[NH2+][C@H](c2ccco2)c2ccccc2)o1 ZINC000036960259 260057888 /nfs/dbraw/zinc/05/78/88/260057888.db2.gz HPBCELJPAXKKNS-KSSFIOAISA-N 1 2 281.355 4.621 20 0 CJADLO Cc1ccc([C@@H](C)[NH2+][C@@H](c2ccco2)c2ccccc2)o1 ZINC000036960261 260057938 /nfs/dbraw/zinc/05/79/38/260057938.db2.gz HPBCELJPAXKKNS-RDTXWAMCSA-N 1 2 281.355 4.621 20 0 CJADLO Cc1ccc([C@H](C)[NH2+][C@@H](c2ccco2)c2ccccc2)o1 ZINC000036960263 260057681 /nfs/dbraw/zinc/05/76/81/260057681.db2.gz HPBCELJPAXKKNS-KBXCAEBGSA-N 1 2 281.355 4.621 20 0 CJADLO Cc1nc([C@@H](C)[NH2+][C@@H](C)c2cc3ccccc3o2)cs1 ZINC000037070931 527033269 /nfs/dbraw/zinc/03/32/69/527033269.db2.gz ASJIUFITUJJTFA-MNOVXSKESA-N 1 2 286.400 4.610 20 0 CJADLO Cc1nc([C@H](C)[NH2+][C@@H](C)c2cc3ccccc3o2)cs1 ZINC000037070932 527065334 /nfs/dbraw/zinc/06/53/34/527065334.db2.gz ASJIUFITUJJTFA-QWRGUYRKSA-N 1 2 286.400 4.610 20 0 CJADLO Cc1nc([C@@H](C)[NH2+][C@H](C)c2cc3ccccc3o2)cs1 ZINC000037070933 527034773 /nfs/dbraw/zinc/03/47/73/527034773.db2.gz ASJIUFITUJJTFA-GHMZBOCLSA-N 1 2 286.400 4.610 20 0 CJADLO Cc1nc([C@H](C)[NH2+][C@H](C)c2cc3ccccc3o2)cs1 ZINC000037070934 527066010 /nfs/dbraw/zinc/06/60/10/527066010.db2.gz ASJIUFITUJJTFA-WDEREUQCSA-N 1 2 286.400 4.610 20 0 CJADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1ccc(F)cc1F ZINC000037508040 326854554 /nfs/dbraw/zinc/85/45/54/326854554.db2.gz MINFQVASDIKJQV-ZJUUUORDSA-N 1 2 297.295 4.655 20 0 CJADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1ccccc1F ZINC000037764121 333538101 /nfs/dbraw/zinc/53/81/01/333538101.db2.gz DUPLZPYMUHURQW-MNOVXSKESA-N 1 2 279.305 4.516 20 0 CJADLO C[C@@H]([NH2+][C@@H](C)c1ccccc1F)c1c(F)cccc1F ZINC000037764122 333538272 /nfs/dbraw/zinc/53/82/72/333538272.db2.gz DUPLZPYMUHURQW-WDEREUQCSA-N 1 2 279.305 4.516 20 0 CJADLO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1F)c1ccccc1F ZINC000037764123 333538292 /nfs/dbraw/zinc/53/82/92/333538292.db2.gz DUPLZPYMUHURQW-GHMZBOCLSA-N 1 2 279.305 4.516 20 0 CJADLO C[C@H]([NH2+]Cc1c(F)cccc1Cl)c1c(F)cccc1F ZINC000037771655 333538436 /nfs/dbraw/zinc/53/84/36/333538436.db2.gz IFHUUEVVECSIKC-VIFPVBQESA-N 1 2 299.723 4.608 20 0 CJADLO C[C@@H]([NH2+]Cc1c(F)cccc1Cl)c1c(F)cccc1F ZINC000037771656 333538516 /nfs/dbraw/zinc/53/85/16/333538516.db2.gz IFHUUEVVECSIKC-SECBINFHSA-N 1 2 299.723 4.608 20 0 CJADLO C[C@H]([NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1)c1c(F)cccc1F ZINC000037771748 333538704 /nfs/dbraw/zinc/53/87/04/333538704.db2.gz DHHQMKYFDJSYFB-GMXVVIOVSA-N 1 2 291.341 4.532 20 0 CJADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1c(F)cccc1F ZINC000037771758 333538750 /nfs/dbraw/zinc/53/87/50/333538750.db2.gz WIEQIYUKWHTNSB-AOOOYVTPSA-N 1 2 297.295 4.655 20 0 CJADLO Cc1cc([C@@H](C)Nc2ccc3ccccc3[nH+]2)c(C)o1 ZINC000044730905 525478695 /nfs/dbraw/zinc/47/86/95/525478695.db2.gz ZMNDPVUQAXEURP-GFCCVEGCSA-N 1 2 266.344 4.618 20 0 CJADLO Cc1cc([C@H](C)Nc2ccc3ccccc3[nH+]2)c(C)o1 ZINC000044730906 525534399 /nfs/dbraw/zinc/53/43/99/525534399.db2.gz ZMNDPVUQAXEURP-LBPRGKRZSA-N 1 2 266.344 4.618 20 0 CJADLO Cc1ccc([C@@H](C)Nc2ccc3ccccc3[nH+]2)cc1 ZINC000048346227 328130190 /nfs/dbraw/zinc/13/01/90/328130190.db2.gz MHGIQKYYDAKBKL-CQSZACIVSA-N 1 2 262.356 4.716 20 0 CJADLO Cc1ccc([C@H](C)Nc2ccc3ccccc3[nH+]2)cc1 ZINC000048346230 328130177 /nfs/dbraw/zinc/13/01/77/328130177.db2.gz MHGIQKYYDAKBKL-AWEZNQCLSA-N 1 2 262.356 4.716 20 0 CJADLO Cc1ccccc1SCc1cn2cc(Cl)ccc2[nH+]1 ZINC000059929586 330406868 /nfs/dbraw/zinc/40/68/68/330406868.db2.gz TXFVCGWHCRWGOM-UHFFFAOYSA-N 1 2 288.803 4.588 20 0 CJADLO Fc1ccccc1C[N@@H+](Cc1ccco1)Cc1ccccc1 ZINC000071793667 176263840 /nfs/dbraw/zinc/26/38/40/176263840.db2.gz UBUZVYSLBQSWJB-UHFFFAOYSA-N 1 2 295.357 4.621 20 0 CJADLO Fc1ccccc1C[N@H+](Cc1ccco1)Cc1ccccc1 ZINC000071793667 176263838 /nfs/dbraw/zinc/26/38/38/176263838.db2.gz UBUZVYSLBQSWJB-UHFFFAOYSA-N 1 2 295.357 4.621 20 0 CJADLO C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1ccccc1F ZINC000071793813 176263892 /nfs/dbraw/zinc/26/38/92/176263892.db2.gz IVFXNDPJUBZFPL-GFCCVEGCSA-N 1 2 277.770 4.672 20 0 CJADLO C[C@H](c1ccccc1Cl)[N@H+](C)Cc1ccccc1F ZINC000071793813 176263891 /nfs/dbraw/zinc/26/38/91/176263891.db2.gz IVFXNDPJUBZFPL-GFCCVEGCSA-N 1 2 277.770 4.672 20 0 CJADLO CC(C)c1ccc(SCc2cn3ccccc3[nH+]2)cc1 ZINC000071844608 333885224 /nfs/dbraw/zinc/88/52/24/333885224.db2.gz IGSIYMUMQVSDQZ-UHFFFAOYSA-N 1 2 282.412 4.750 20 0 CJADLO Cc1ccc2[nH+]c(CSc3cccc(Cl)c3)cn2c1 ZINC000072076734 333902769 /nfs/dbraw/zinc/90/27/69/333902769.db2.gz CMUBUVFNIMQILP-UHFFFAOYSA-N 1 2 288.803 4.588 20 0 CJADLO CC(C)c1nc(C[NH2+][C@H](C)c2ccccc2Cl)cs1 ZINC000076571251 334084797 /nfs/dbraw/zinc/08/47/97/334084797.db2.gz IOLUXLQZJJQYJV-LLVKDONJSA-N 1 2 294.851 4.771 20 0 CJADLO CC(C)c1nc([C@@H](C)[NH2+]Cc2ccccc2Cl)cs1 ZINC000076900157 519866519 /nfs/dbraw/zinc/86/65/19/519866519.db2.gz ALKGANOKSCOIHH-LLVKDONJSA-N 1 2 294.851 4.771 20 0 CJADLO CC(C)c1nc([C@H](C)[NH2+]Cc2ccccc2Cl)cs1 ZINC000076900158 519867483 /nfs/dbraw/zinc/86/74/83/519867483.db2.gz ALKGANOKSCOIHH-NSHDSACASA-N 1 2 294.851 4.771 20 0 CJADLO COc1c(C)c[nH+]c(CSc2cccc(Cl)c2)c1C ZINC000078817930 177393082 /nfs/dbraw/zinc/39/30/82/177393082.db2.gz WHQAITZCGGJKHB-UHFFFAOYSA-N 1 2 293.819 4.653 20 0 CJADLO C[C@H]([NH2+][C@H](c1ccco1)c1ccccc1)c1ccccc1F ZINC000078991527 334144891 /nfs/dbraw/zinc/14/48/91/334144891.db2.gz QXWCRLDKXSPEPV-LIRRHRJNSA-N 1 2 295.357 4.859 20 0 CJADLO C[C@@H]([NH2+][C@H](c1ccco1)c1ccccc1)c1ccccc1F ZINC000078991536 334145086 /nfs/dbraw/zinc/14/50/86/334145086.db2.gz QXWCRLDKXSPEPV-KUHUBIRLSA-N 1 2 295.357 4.859 20 0 CJADLO C[C@H]([NH2+][C@@H](c1ccco1)c1ccccc1)c1ccccc1F ZINC000078991546 334144912 /nfs/dbraw/zinc/14/49/12/334144912.db2.gz QXWCRLDKXSPEPV-IFXJQAMLSA-N 1 2 295.357 4.859 20 0 CJADLO C[C@@H]([NH2+][C@@H](c1ccco1)c1ccccc1)c1ccccc1F ZINC000078991551 334144945 /nfs/dbraw/zinc/14/49/45/334144945.db2.gz QXWCRLDKXSPEPV-AUUYWEPGSA-N 1 2 295.357 4.859 20 0 CJADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1ccc(Cl)cc1Cl ZINC000079876391 334163609 /nfs/dbraw/zinc/16/36/09/334163609.db2.gz FMMILLSQUKTCRX-NSHDSACASA-N 1 2 295.213 4.581 20 0 CJADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1ccc(Cl)cc1Cl ZINC000079876391 334163608 /nfs/dbraw/zinc/16/36/08/334163608.db2.gz FMMILLSQUKTCRX-NSHDSACASA-N 1 2 295.213 4.581 20 0 CJADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1ccc(Cl)cc1Cl ZINC000079876394 334163627 /nfs/dbraw/zinc/16/36/27/334163627.db2.gz FMMILLSQUKTCRX-LLVKDONJSA-N 1 2 295.213 4.581 20 0 CJADLO C[C@H](c1cccnc1)[N@H+](C)Cc1ccc(Cl)cc1Cl ZINC000079876394 334163626 /nfs/dbraw/zinc/16/36/26/334163626.db2.gz FMMILLSQUKTCRX-LLVKDONJSA-N 1 2 295.213 4.581 20 0 CJADLO CC[C@H]([NH2+][C@@H](C)c1ccccc1Cl)c1nccs1 ZINC000080261387 334168863 /nfs/dbraw/zinc/16/88/63/334168863.db2.gz CKARWZDEQSCGCX-GWCFXTLKSA-N 1 2 280.824 4.598 20 0 CJADLO CC[C@@H]([NH2+][C@@H](C)c1ccccc1Cl)c1nccs1 ZINC000080261394 334168930 /nfs/dbraw/zinc/16/89/30/334168930.db2.gz CKARWZDEQSCGCX-GXFFZTMASA-N 1 2 280.824 4.598 20 0 CJADLO CC[C@H]([NH2+][C@H](C)c1ccccc1Cl)c1nccs1 ZINC000080261399 334168811 /nfs/dbraw/zinc/16/88/11/334168811.db2.gz CKARWZDEQSCGCX-MFKMUULPSA-N 1 2 280.824 4.598 20 0 CJADLO CC[C@@H]([NH2+][C@H](C)c1ccccc1Cl)c1nccs1 ZINC000080261402 334168850 /nfs/dbraw/zinc/16/88/50/334168850.db2.gz CKARWZDEQSCGCX-ZWNOBZJWSA-N 1 2 280.824 4.598 20 0 CJADLO C[C@H]([NH2+]C(c1ccccc1)c1ccccc1)c1nccs1 ZINC000080266536 334168993 /nfs/dbraw/zinc/16/89/93/334168993.db2.gz SMSJHNBOXKWSFL-AWEZNQCLSA-N 1 2 294.423 4.583 20 0 CJADLO C[C@@H]([NH2+]C(c1ccccc1)c1ccccc1)c1nccs1 ZINC000080266539 334168805 /nfs/dbraw/zinc/16/88/05/334168805.db2.gz SMSJHNBOXKWSFL-CQSZACIVSA-N 1 2 294.423 4.583 20 0 CJADLO Cc1csc([C@@H](C)[NH2+][C@@H](C)c2ccccc2Cl)n1 ZINC000080273287 334169327 /nfs/dbraw/zinc/16/93/27/334169327.db2.gz LBNVTKWGBXTDKN-WDEREUQCSA-N 1 2 280.824 4.517 20 0 CJADLO Cc1csc([C@H](C)[NH2+][C@@H](C)c2ccccc2Cl)n1 ZINC000080273290 330351402 /nfs/dbraw/zinc/35/14/02/330351402.db2.gz LBNVTKWGBXTDKN-QWRGUYRKSA-N 1 2 280.824 4.517 20 0 CJADLO Cc1csc([C@@H](C)[NH2+][C@H](C)c2ccccc2Cl)n1 ZINC000080273293 330351405 /nfs/dbraw/zinc/35/14/05/330351405.db2.gz LBNVTKWGBXTDKN-GHMZBOCLSA-N 1 2 280.824 4.517 20 0 CJADLO Cc1csc([C@H](C)[NH2+][C@H](C)c2ccccc2Cl)n1 ZINC000080273299 330351302 /nfs/dbraw/zinc/35/13/02/330351302.db2.gz LBNVTKWGBXTDKN-MNOVXSKESA-N 1 2 280.824 4.517 20 0 CJADLO Cc1csc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)cc2Cl)n1 ZINC000080273656 334169441 /nfs/dbraw/zinc/16/94/41/334169441.db2.gz DZMSFXQUFVEJPD-VHSXEESVSA-N 1 2 298.814 4.656 20 0 CJADLO Cc1csc([C@H](C)[NH2+][C@@H](C)c2ccc(F)cc2Cl)n1 ZINC000080273659 334169494 /nfs/dbraw/zinc/16/94/94/334169494.db2.gz DZMSFXQUFVEJPD-UWVGGRQHSA-N 1 2 298.814 4.656 20 0 CJADLO Cc1csc([C@@H](C)[NH2+][C@H](C)c2ccc(F)cc2Cl)n1 ZINC000080273661 334169525 /nfs/dbraw/zinc/16/95/25/334169525.db2.gz DZMSFXQUFVEJPD-NXEZZACHSA-N 1 2 298.814 4.656 20 0 CJADLO Cc1csc([C@H](C)[NH2+][C@H](C)c2ccc(F)cc2Cl)n1 ZINC000080273664 334169347 /nfs/dbraw/zinc/16/93/47/334169347.db2.gz DZMSFXQUFVEJPD-ZJUUUORDSA-N 1 2 298.814 4.656 20 0 CJADLO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2csc(C(C)C)n2)o1 ZINC000090048487 327176491 /nfs/dbraw/zinc/17/64/91/327176491.db2.gz GZEAOILOQUELKB-NWDGAFQWSA-N 1 2 278.421 4.580 20 0 CJADLO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2csc(C(C)C)n2)o1 ZINC000090048488 327176546 /nfs/dbraw/zinc/17/65/46/327176546.db2.gz GZEAOILOQUELKB-RYUDHWBXSA-N 1 2 278.421 4.580 20 0 CJADLO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2csc(C(C)C)n2)o1 ZINC000090048489 327176522 /nfs/dbraw/zinc/17/65/22/327176522.db2.gz GZEAOILOQUELKB-VXGBXAGGSA-N 1 2 278.421 4.580 20 0 CJADLO Cc1ccc([C@H](C)[NH2+][C@H](C)c2csc(C(C)C)n2)o1 ZINC000090048490 327176447 /nfs/dbraw/zinc/17/64/47/327176447.db2.gz GZEAOILOQUELKB-NEPJUHHUSA-N 1 2 278.421 4.580 20 0 CJADLO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2c(F)cccc2Cl)o1 ZINC000090180266 260336668 /nfs/dbraw/zinc/33/66/68/260336668.db2.gz CRJXWIUIOJNJPV-MNOVXSKESA-N 1 2 281.758 4.792 20 0 CJADLO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2c(F)cccc2Cl)o1 ZINC000090180267 260336280 /nfs/dbraw/zinc/33/62/80/260336280.db2.gz CRJXWIUIOJNJPV-QWRGUYRKSA-N 1 2 281.758 4.792 20 0 CJADLO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2c(F)cccc2Cl)o1 ZINC000090180268 260336352 /nfs/dbraw/zinc/33/63/52/260336352.db2.gz CRJXWIUIOJNJPV-GHMZBOCLSA-N 1 2 281.758 4.792 20 0 CJADLO Cc1ccc([C@H](C)[NH2+][C@H](C)c2c(F)cccc2Cl)o1 ZINC000090180269 260336539 /nfs/dbraw/zinc/33/65/39/260336539.db2.gz CRJXWIUIOJNJPV-WDEREUQCSA-N 1 2 281.758 4.792 20 0 CJADLO C[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccccc1Cl ZINC000090459442 327178775 /nfs/dbraw/zinc/17/87/75/327178775.db2.gz RLKPVUPONOJWRW-JTQLQIEISA-N 1 2 292.835 4.525 20 0 CJADLO C[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccccc1Cl ZINC000090459447 327178665 /nfs/dbraw/zinc/17/86/65/327178665.db2.gz RLKPVUPONOJWRW-SNVBAGLBSA-N 1 2 292.835 4.525 20 0 CJADLO Cc1ccc([C@@H](C)Nc2cc(C(F)(F)F)cc[nH+]2)s1 ZINC000090803166 260262468 /nfs/dbraw/zinc/26/24/68/260262468.db2.gz OEQSKFFZRJGMRU-SECBINFHSA-N 1 2 286.322 4.643 20 0 CJADLO Cc1ccc([C@H](C)Nc2cc(C(F)(F)F)cc[nH+]2)s1 ZINC000090803167 260262519 /nfs/dbraw/zinc/26/25/19/260262519.db2.gz OEQSKFFZRJGMRU-VIFPVBQESA-N 1 2 286.322 4.643 20 0 CJADLO Cc1ccc([C@@H](C)Nc2cc(C(F)(F)F)cc[nH+]2)cc1 ZINC000090803234 260262636 /nfs/dbraw/zinc/26/26/36/260262636.db2.gz NXSJBPARVCGYCR-LLVKDONJSA-N 1 2 280.293 4.582 20 0 CJADLO Cc1ccc([C@H](C)Nc2cc(C(F)(F)F)cc[nH+]2)cc1 ZINC000090803236 260262687 /nfs/dbraw/zinc/26/26/87/260262687.db2.gz NXSJBPARVCGYCR-NSHDSACASA-N 1 2 280.293 4.582 20 0 CJADLO FC(F)(F)c1cc[nH+]c(N[C@@H]2CCCc3sccc32)c1 ZINC000090803381 260262540 /nfs/dbraw/zinc/26/25/40/260262540.db2.gz DMJMWXCUPWOBFU-LLVKDONJSA-N 1 2 298.333 4.651 20 0 CJADLO FC(F)(F)c1cc[nH+]c(N[C@H]2CCCc3sccc32)c1 ZINC000090803383 260262419 /nfs/dbraw/zinc/26/24/19/260262419.db2.gz DMJMWXCUPWOBFU-NSHDSACASA-N 1 2 298.333 4.651 20 0 CJADLO Cc1ccc(N[C@@H](C)c2cc3ccccc3o2)c(C)[nH+]1 ZINC000094664638 265249062 /nfs/dbraw/zinc/24/90/62/265249062.db2.gz STKKXDKPRUUNJC-ZDUSSCGKSA-N 1 2 266.344 4.618 20 0 CJADLO Cc1ccc(N[C@H](C)c2cc3ccccc3o2)c(C)[nH+]1 ZINC000094664639 265248979 /nfs/dbraw/zinc/24/89/79/265248979.db2.gz STKKXDKPRUUNJC-CYBMUJFWSA-N 1 2 266.344 4.618 20 0 CJADLO c1c(CNc2ccc(-c3ccccc3)cc2)[nH+]c2ccccn12 ZINC000096954565 185140830 /nfs/dbraw/zinc/14/08/30/185140830.db2.gz YUASFVBQYSCWGD-UHFFFAOYSA-N 1 2 299.377 4.613 20 0 CJADLO CCCc1nc(C[NH2+][C@@H](C)c2ccccc2Cl)cs1 ZINC000097098322 327291676 /nfs/dbraw/zinc/29/16/76/327291676.db2.gz QVJMEQQSMNDRLV-NSHDSACASA-N 1 2 294.851 4.600 20 0 CJADLO CC(C)c1ccc(NCc2cn3cc(Cl)ccc3[nH+]2)cc1 ZINC000105857541 330329907 /nfs/dbraw/zinc/32/99/07/330329907.db2.gz USUOOASNQCYBMJ-UHFFFAOYSA-N 1 2 299.805 4.723 20 0 CJADLO CC(C)c1ccccc1NCc1cn2cc(Cl)ccc2[nH+]1 ZINC000105913300 330330601 /nfs/dbraw/zinc/33/06/01/330330601.db2.gz SEZJATOBWJRJLE-UHFFFAOYSA-N 1 2 299.805 4.723 20 0 CJADLO CCCc1ccccc1NCc1cn2cc(Cl)ccc2[nH+]1 ZINC000106422474 330337761 /nfs/dbraw/zinc/33/77/61/330337761.db2.gz SEVXTOFEHRZQNK-UHFFFAOYSA-N 1 2 299.805 4.552 20 0 CJADLO CCC[C@@H](C)CC(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000109727035 326865271 /nfs/dbraw/zinc/86/52/71/326865271.db2.gz RLFXCSTZJXCVQT-CQSZACIVSA-N 1 2 298.386 4.639 20 0 CJADLO CC[C@H]([NH2+][C@@H](C)c1ccc(F)cc1F)c1nc(C)cs1 ZINC000112544296 327286673 /nfs/dbraw/zinc/28/66/73/327286673.db2.gz OODNCFVPRWVQRD-HZMBPMFUSA-N 1 2 296.386 4.532 20 0 CJADLO CC[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1F)c1nc(C)cs1 ZINC000112544297 327286626 /nfs/dbraw/zinc/28/66/26/327286626.db2.gz OODNCFVPRWVQRD-IINYFYTJSA-N 1 2 296.386 4.532 20 0 CJADLO CC[C@H]([NH2+][C@H](C)c1ccc(F)cc1F)c1nc(C)cs1 ZINC000112544299 327286496 /nfs/dbraw/zinc/28/64/96/327286496.db2.gz OODNCFVPRWVQRD-YGRLFVJLSA-N 1 2 296.386 4.532 20 0 CJADLO CC[C@@H]([NH2+][C@H](C)c1ccc(F)cc1F)c1nc(C)cs1 ZINC000112544301 327286500 /nfs/dbraw/zinc/28/65/00/327286500.db2.gz OODNCFVPRWVQRD-QMTHXVAHSA-N 1 2 296.386 4.532 20 0 CJADLO CC[C@H]([NH2+][C@@H](C)c1cc(F)ccc1F)c1nc(C)cs1 ZINC000112544471 328440874 /nfs/dbraw/zinc/44/08/74/328440874.db2.gz RKKKCXJXNCEOLI-HZMBPMFUSA-N 1 2 296.386 4.532 20 0 CJADLO CC[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1F)c1nc(C)cs1 ZINC000112544472 328441028 /nfs/dbraw/zinc/44/10/28/328441028.db2.gz RKKKCXJXNCEOLI-IINYFYTJSA-N 1 2 296.386 4.532 20 0 CJADLO CC[C@H]([NH2+][C@H](C)c1cc(F)ccc1F)c1nc(C)cs1 ZINC000112544473 328440984 /nfs/dbraw/zinc/44/09/84/328440984.db2.gz RKKKCXJXNCEOLI-YGRLFVJLSA-N 1 2 296.386 4.532 20 0 CJADLO CC[C@@H]([NH2+][C@H](C)c1cc(F)ccc1F)c1nc(C)cs1 ZINC000112544474 328441080 /nfs/dbraw/zinc/44/10/80/328441080.db2.gz RKKKCXJXNCEOLI-QMTHXVAHSA-N 1 2 296.386 4.532 20 0 CJADLO Cc1ccc(F)c(C[NH2+][C@H](c2ccco2)c2ccccc2)c1 ZINC000116912596 330361247 /nfs/dbraw/zinc/36/12/47/330361247.db2.gz NLYZQGJSKRYLOF-IBGZPJMESA-N 1 2 295.357 4.606 20 0 CJADLO Cc1ccc(F)c(C[NH2+][C@@H](c2ccco2)c2ccccc2)c1 ZINC000116912598 330361273 /nfs/dbraw/zinc/36/12/73/330361273.db2.gz NLYZQGJSKRYLOF-LJQANCHMSA-N 1 2 295.357 4.606 20 0 CJADLO CC(C)c1nc(C[N@@H+]([C@@H](C)c2ccco2)C2CC2)cs1 ZINC000119176291 267305050 /nfs/dbraw/zinc/30/50/50/267305050.db2.gz HFMIZWSGMSUFEJ-LBPRGKRZSA-N 1 2 290.432 4.585 20 0 CJADLO CC(C)c1nc(C[N@H+]([C@@H](C)c2ccco2)C2CC2)cs1 ZINC000119176291 267305049 /nfs/dbraw/zinc/30/50/49/267305049.db2.gz HFMIZWSGMSUFEJ-LBPRGKRZSA-N 1 2 290.432 4.585 20 0 CJADLO CC(C)c1nc(C[N@@H+]([C@H](C)c2ccco2)C2CC2)cs1 ZINC000119176454 267304936 /nfs/dbraw/zinc/30/49/36/267304936.db2.gz HFMIZWSGMSUFEJ-GFCCVEGCSA-N 1 2 290.432 4.585 20 0 CJADLO CC(C)c1nc(C[N@H+]([C@H](C)c2ccco2)C2CC2)cs1 ZINC000119176454 267304934 /nfs/dbraw/zinc/30/49/34/267304934.db2.gz HFMIZWSGMSUFEJ-GFCCVEGCSA-N 1 2 290.432 4.585 20 0 CJADLO Cc1csc(C[NH2+][C@H](C)c2ccc(-c3ccccc3)o2)n1 ZINC000126285711 333595890 /nfs/dbraw/zinc/59/58/90/333595890.db2.gz QBEIPISZZQIUIK-CYBMUJFWSA-N 1 2 298.411 4.562 20 0 CJADLO Cc1ccc(N[C@H](C)c2cc3ccccc3s2)c[nH+]1 ZINC000126645048 333601737 /nfs/dbraw/zinc/60/17/37/333601737.db2.gz JMAAJESZACEZJY-GFCCVEGCSA-N 1 2 268.385 4.778 20 0 CJADLO Cc1ccc(N[C@H](c2[nH]cc[nH+]2)c2ccccc2)cc1Cl ZINC000128388785 333666176 /nfs/dbraw/zinc/66/61/76/333666176.db2.gz JCEABUQQMBUMAC-INIZCTEOSA-N 1 2 297.789 4.573 20 0 CJADLO CC(C)c1cccc(N[C@@H](c2[nH]cc[nH+]2)c2ccccc2)c1 ZINC000128408641 333667938 /nfs/dbraw/zinc/66/79/38/333667938.db2.gz WTLZAIODJLKYBU-GOSISDBHSA-N 1 2 291.398 4.735 20 0 CJADLO CC(C)c1csc(C[NH2+][C@@H](C)c2ccccc2Cl)n1 ZINC000128669963 519855371 /nfs/dbraw/zinc/85/53/71/519855371.db2.gz CTNAZNODQVKDKJ-NSHDSACASA-N 1 2 294.851 4.771 20 0 CJADLO CC(C)c1csc(C[NH2+][C@H](C)c2ccccc2Cl)n1 ZINC000128670185 519855334 /nfs/dbraw/zinc/85/53/34/519855334.db2.gz CTNAZNODQVKDKJ-LLVKDONJSA-N 1 2 294.851 4.771 20 0 CJADLO Cc1ccc(N[C@H](c2[nH]cc[nH+]2)c2ccccc2)c(Cl)c1 ZINC000129603867 333781543 /nfs/dbraw/zinc/78/15/43/333781543.db2.gz ZEJBQMSOETXAEA-INIZCTEOSA-N 1 2 297.789 4.573 20 0 CJADLO Cc1ccc(N[C@@H](c2[nH]cc[nH+]2)c2ccccc2)c(Cl)c1 ZINC000129604083 333781518 /nfs/dbraw/zinc/78/15/18/333781518.db2.gz ZEJBQMSOETXAEA-MRXNPFEDSA-N 1 2 297.789 4.573 20 0 CJADLO Cc1ccc(Cl)c(N[C@H](c2[nH]cc[nH+]2)c2ccccc2)c1 ZINC000129605120 333781611 /nfs/dbraw/zinc/78/16/11/333781611.db2.gz SKXSESFXUBRIPH-INIZCTEOSA-N 1 2 297.789 4.573 20 0 CJADLO Cc1ccc(Cl)c(N[C@@H](c2[nH]cc[nH+]2)c2ccccc2)c1 ZINC000129605372 333781627 /nfs/dbraw/zinc/78/16/27/333781627.db2.gz SKXSESFXUBRIPH-MRXNPFEDSA-N 1 2 297.789 4.573 20 0 CJADLO Cc1cccc(N[C@H](c2[nH]cc[nH+]2)c2ccccc2)c1Cl ZINC000129610233 333782052 /nfs/dbraw/zinc/78/20/52/333782052.db2.gz AIAFQUMVAJKSJB-INIZCTEOSA-N 1 2 297.789 4.573 20 0 CJADLO Cc1cccc(N[C@@H](c2[nH]cc[nH+]2)c2ccccc2)c1Cl ZINC000129610425 333782134 /nfs/dbraw/zinc/78/21/34/333782134.db2.gz AIAFQUMVAJKSJB-MRXNPFEDSA-N 1 2 297.789 4.573 20 0 CJADLO CC(C)c1ncc(C[N@@H+](C)[C@H](C)c2ccccc2F)s1 ZINC000129712030 328130371 /nfs/dbraw/zinc/13/03/71/328130371.db2.gz QBTDBLMKGXSIRO-GFCCVEGCSA-N 1 2 292.423 4.599 20 0 CJADLO CC(C)c1ncc(C[N@H+](C)[C@H](C)c2ccccc2F)s1 ZINC000129712030 328130369 /nfs/dbraw/zinc/13/03/69/328130369.db2.gz QBTDBLMKGXSIRO-GFCCVEGCSA-N 1 2 292.423 4.599 20 0 CJADLO Cc1cnc([C@H](C)[NH2+][C@@H](C)c2ccccc2Cl)s1 ZINC000134899481 526160168 /nfs/dbraw/zinc/16/01/68/526160168.db2.gz MRSWLYXCGMGEDD-QWRGUYRKSA-N 1 2 280.824 4.517 20 0 CJADLO Cc1ccc([C@@H](C)[N@@H+](C)Cc2csc(C3CC3)n2)cc1 ZINC000135045618 334113685 /nfs/dbraw/zinc/11/36/85/334113685.db2.gz NOEIRLJLEOZQCP-CYBMUJFWSA-N 1 2 286.444 4.522 20 0 CJADLO Cc1ccc([C@@H](C)[N@H+](C)Cc2csc(C3CC3)n2)cc1 ZINC000135045618 334113684 /nfs/dbraw/zinc/11/36/84/334113684.db2.gz NOEIRLJLEOZQCP-CYBMUJFWSA-N 1 2 286.444 4.522 20 0 CJADLO Cc1ccc([C@H](C)[N@@H+](C)Cc2csc(C3CC3)n2)cc1 ZINC000135045641 334113743 /nfs/dbraw/zinc/11/37/43/334113743.db2.gz NOEIRLJLEOZQCP-ZDUSSCGKSA-N 1 2 286.444 4.522 20 0 CJADLO Cc1ccc([C@H](C)[N@H+](C)Cc2csc(C3CC3)n2)cc1 ZINC000135045641 334113742 /nfs/dbraw/zinc/11/37/42/334113742.db2.gz NOEIRLJLEOZQCP-ZDUSSCGKSA-N 1 2 286.444 4.522 20 0 CJADLO C[C@@H](c1ccc(Cl)cc1)[N@@H+](Cc1nccs1)C1CC1 ZINC000135174854 334119007 /nfs/dbraw/zinc/11/90/07/334119007.db2.gz ZBLZZSUAZZZMJN-NSHDSACASA-N 1 2 292.835 4.522 20 0 CJADLO C[C@@H](c1ccc(Cl)cc1)[N@H+](Cc1nccs1)C1CC1 ZINC000135174854 334119005 /nfs/dbraw/zinc/11/90/05/334119005.db2.gz ZBLZZSUAZZZMJN-NSHDSACASA-N 1 2 292.835 4.522 20 0 CJADLO C[C@H](c1ccc(Cl)cc1)[N@@H+](Cc1nccs1)C1CC1 ZINC000135174872 334118898 /nfs/dbraw/zinc/11/88/98/334118898.db2.gz ZBLZZSUAZZZMJN-LLVKDONJSA-N 1 2 292.835 4.522 20 0 CJADLO C[C@H](c1ccc(Cl)cc1)[N@H+](Cc1nccs1)C1CC1 ZINC000135174872 334118897 /nfs/dbraw/zinc/11/88/97/334118897.db2.gz ZBLZZSUAZZZMJN-LLVKDONJSA-N 1 2 292.835 4.522 20 0 CJADLO C[C@H]([NH2+]Cc1cccc(Cl)c1F)c1c(F)cccc1F ZINC000135375687 334128116 /nfs/dbraw/zinc/12/81/16/334128116.db2.gz JSQPCGIRQPAMDG-VIFPVBQESA-N 1 2 299.723 4.608 20 0 CJADLO C[C@@H]([NH2+]Cc1cccc(Cl)c1F)c1c(F)cccc1F ZINC000135375707 334128223 /nfs/dbraw/zinc/12/82/23/334128223.db2.gz JSQPCGIRQPAMDG-SECBINFHSA-N 1 2 299.723 4.608 20 0 CJADLO Cc1cc(C)c(NC(=O)CC[C@@H](C)c2ccccc2)c(C)[nH+]1 ZINC000137082795 334169479 /nfs/dbraw/zinc/16/94/79/334169479.db2.gz GXGSUBVAUCJABF-CYBMUJFWSA-N 1 2 296.414 4.529 20 0 CJADLO Cc1cc(C)c(NC(=O)CC[C@H](C)c2ccccc2)c(C)[nH+]1 ZINC000137082849 334169392 /nfs/dbraw/zinc/16/93/92/334169392.db2.gz GXGSUBVAUCJABF-ZDUSSCGKSA-N 1 2 296.414 4.529 20 0 CJADLO CCCCn1cc[nH+]c1-c1cccc(NCc2ccco2)c1 ZINC000152254808 328082870 /nfs/dbraw/zinc/08/28/70/328082870.db2.gz ZZLUZUIMTJDRBD-UHFFFAOYSA-N 1 2 295.386 4.555 20 0 CJADLO C[C@H]([NH2+]Cc1ccc(Cl)cc1F)c1c(F)cccc1F ZINC000157220291 264238311 /nfs/dbraw/zinc/23/83/11/264238311.db2.gz DNZYPXFTFFTZKN-VIFPVBQESA-N 1 2 299.723 4.608 20 0 CJADLO C[C@@H]([NH2+]Cc1ccc(Cl)cc1F)c1c(F)cccc1F ZINC000157220437 264238526 /nfs/dbraw/zinc/23/85/26/264238526.db2.gz DNZYPXFTFFTZKN-SECBINFHSA-N 1 2 299.723 4.608 20 0 CJADLO C[C@@H]([NH2+]C(c1ccccc1)c1ccccc1)c1cscn1 ZINC000162296650 329991047 /nfs/dbraw/zinc/99/10/47/329991047.db2.gz KVJQBZOIOLOSHN-CQSZACIVSA-N 1 2 294.423 4.583 20 0 CJADLO CC[C@H]([NH2+][C@@H](C)c1nc(C)cs1)c1ccc(F)cc1F ZINC000162365803 330006804 /nfs/dbraw/zinc/00/68/04/330006804.db2.gz VUNTVOBQLCZYTK-HZMBPMFUSA-N 1 2 296.386 4.532 20 0 CJADLO CC[C@@H]([NH2+][C@@H](C)c1nc(C)cs1)c1ccc(F)cc1F ZINC000162365920 330006875 /nfs/dbraw/zinc/00/68/75/330006875.db2.gz VUNTVOBQLCZYTK-IINYFYTJSA-N 1 2 296.386 4.532 20 0 CJADLO CC[C@H]([NH2+][C@H](C)c1nc(C)cs1)c1ccc(F)cc1F ZINC000162366061 330007059 /nfs/dbraw/zinc/00/70/59/330007059.db2.gz VUNTVOBQLCZYTK-YGRLFVJLSA-N 1 2 296.386 4.532 20 0 CJADLO CC[C@@H]([NH2+][C@H](C)c1nc(C)cs1)c1ccc(F)cc1F ZINC000162366180 330006956 /nfs/dbraw/zinc/00/69/56/330006956.db2.gz VUNTVOBQLCZYTK-QMTHXVAHSA-N 1 2 296.386 4.532 20 0 CJADLO CCc1ccc([C@@H](C)[NH2+][C@H](c2ccco2)c2ccccc2)o1 ZINC000163224080 334689205 /nfs/dbraw/zinc/68/92/05/334689205.db2.gz XTVRMLOQNIZASU-KUHUBIRLSA-N 1 2 295.382 4.875 20 0 CJADLO Cc1ccc(N[C@@H]2CCSc3ccc(Cl)cc32)c[nH+]1 ZINC000164553165 331252983 /nfs/dbraw/zinc/25/29/83/331252983.db2.gz ZGUUHCIQCKMJQV-CQSZACIVSA-N 1 2 290.819 4.692 20 0 CJADLO Cc1ccc(N[C@H]2CCSc3ccc(Cl)cc32)c[nH+]1 ZINC000164553284 331252942 /nfs/dbraw/zinc/25/29/42/331252942.db2.gz ZGUUHCIQCKMJQV-AWEZNQCLSA-N 1 2 290.819 4.692 20 0 CJADLO Cc1ccc(N[C@@H](C)c2cccc(C(F)(F)F)c2)c[nH+]1 ZINC000164567227 331255412 /nfs/dbraw/zinc/25/54/12/331255412.db2.gz ZLEYUUXLPUWWSY-NSHDSACASA-N 1 2 280.293 4.582 20 0 CJADLO Cc1ccc(N[C@H](C)c2cccc(C(F)(F)F)c2)c[nH+]1 ZINC000164567344 331255373 /nfs/dbraw/zinc/25/53/73/331255373.db2.gz ZLEYUUXLPUWWSY-LLVKDONJSA-N 1 2 280.293 4.582 20 0 CJADLO Cc1ccc(N[C@@H](C)c2ccc(C(F)(F)F)cc2)c[nH+]1 ZINC000164568334 331255470 /nfs/dbraw/zinc/25/54/70/331255470.db2.gz YORCZODXJCTFFD-NSHDSACASA-N 1 2 280.293 4.582 20 0 CJADLO Cc1ccc(N[C@H](C)c2ccc(C(F)(F)F)cc2)c[nH+]1 ZINC000164568431 331255452 /nfs/dbraw/zinc/25/54/52/331255452.db2.gz YORCZODXJCTFFD-LLVKDONJSA-N 1 2 280.293 4.582 20 0 CJADLO Cc1ccc(N[C@@H](C)c2ccccc2C(F)(F)F)c[nH+]1 ZINC000164703283 331291752 /nfs/dbraw/zinc/29/17/52/331291752.db2.gz JGKCJQDGNCAAEC-NSHDSACASA-N 1 2 280.293 4.582 20 0 CJADLO CC[C@@H](CC(=O)Nc1c(C)cc(C)[nH+]c1C)c1ccccc1 ZINC000171435406 335065867 /nfs/dbraw/zinc/06/58/67/335065867.db2.gz PZWNAVBRGPXYMA-INIZCTEOSA-N 1 2 296.414 4.529 20 0 CJADLO CC[C@H](CC(=O)Nc1c(C)cc(C)[nH+]c1C)c1ccccc1 ZINC000171435409 335065980 /nfs/dbraw/zinc/06/59/80/335065980.db2.gz PZWNAVBRGPXYMA-MRXNPFEDSA-N 1 2 296.414 4.529 20 0 CJADLO CC[C@H]([NH2+][C@@H](C)c1ncc(C)s1)c1ccc(F)cc1F ZINC000175261572 335178413 /nfs/dbraw/zinc/17/84/13/335178413.db2.gz YBBQOSZUERWYBE-HZMBPMFUSA-N 1 2 296.386 4.532 20 0 CJADLO CC[C@@H]([NH2+][C@@H](C)c1ncc(C)s1)c1ccc(F)cc1F ZINC000175261594 335178313 /nfs/dbraw/zinc/17/83/13/335178313.db2.gz YBBQOSZUERWYBE-IINYFYTJSA-N 1 2 296.386 4.532 20 0 CJADLO CC[C@H]([NH2+][C@H](C)c1ncc(C)s1)c1ccc(F)cc1F ZINC000175261616 335178388 /nfs/dbraw/zinc/17/83/88/335178388.db2.gz YBBQOSZUERWYBE-YGRLFVJLSA-N 1 2 296.386 4.532 20 0 CJADLO CC[C@@H]([NH2+][C@H](C)c1ncc(C)s1)c1ccc(F)cc1F ZINC000175261638 335178417 /nfs/dbraw/zinc/17/84/17/335178417.db2.gz YBBQOSZUERWYBE-QMTHXVAHSA-N 1 2 296.386 4.532 20 0 CJADLO C[C@@H](c1ccco1)[N@@H+](Cc1nc2ccccc2s1)C1CC1 ZINC000175687350 261241064 /nfs/dbraw/zinc/24/10/64/261241064.db2.gz LDVYMLIMYSFZCE-LBPRGKRZSA-N 1 2 298.411 4.615 20 0 CJADLO C[C@@H](c1ccco1)[N@H+](Cc1nc2ccccc2s1)C1CC1 ZINC000175687350 261241063 /nfs/dbraw/zinc/24/10/63/261241063.db2.gz LDVYMLIMYSFZCE-LBPRGKRZSA-N 1 2 298.411 4.615 20 0 CJADLO C[C@H](c1ccco1)[N@@H+](Cc1nc2ccccc2s1)C1CC1 ZINC000175687367 261240942 /nfs/dbraw/zinc/24/09/42/261240942.db2.gz LDVYMLIMYSFZCE-GFCCVEGCSA-N 1 2 298.411 4.615 20 0 CJADLO C[C@H](c1ccco1)[N@H+](Cc1nc2ccccc2s1)C1CC1 ZINC000175687367 261240939 /nfs/dbraw/zinc/24/09/39/261240939.db2.gz LDVYMLIMYSFZCE-GFCCVEGCSA-N 1 2 298.411 4.615 20 0 CJADLO Cc1cnc([C@@H](C)[NH2+]Cc2ccc(-c3ccccc3)o2)s1 ZINC000175859252 335211211 /nfs/dbraw/zinc/21/12/11/335211211.db2.gz PMHZOCDYIBTQHA-CYBMUJFWSA-N 1 2 298.411 4.562 20 0 CJADLO Cc1cnc([C@H](C)[NH2+]Cc2ccc(-c3ccccc3)o2)s1 ZINC000175859273 335211214 /nfs/dbraw/zinc/21/12/14/335211214.db2.gz PMHZOCDYIBTQHA-ZDUSSCGKSA-N 1 2 298.411 4.562 20 0 CJADLO CC(C)n1cc[nH+]c1CNc1cccc(-c2cccs2)c1 ZINC000176970002 333051585 /nfs/dbraw/zinc/05/15/85/333051585.db2.gz JZECFRBVPRYTAD-UHFFFAOYSA-N 1 2 297.427 4.805 20 0 CJADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1ccc(Cl)cc1Cl ZINC000176983947 335351925 /nfs/dbraw/zinc/35/19/25/335351925.db2.gz AEAWFYQGSDTWBW-NSHDSACASA-N 1 2 295.213 4.581 20 0 CJADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1ccc(Cl)cc1Cl ZINC000176983947 335351924 /nfs/dbraw/zinc/35/19/24/335351924.db2.gz AEAWFYQGSDTWBW-NSHDSACASA-N 1 2 295.213 4.581 20 0 CJADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1ccc(Cl)cc1Cl ZINC000176983958 335351888 /nfs/dbraw/zinc/35/18/88/335351888.db2.gz AEAWFYQGSDTWBW-LLVKDONJSA-N 1 2 295.213 4.581 20 0 CJADLO C[C@H](c1ccccn1)[N@H+](C)Cc1ccc(Cl)cc1Cl ZINC000176983958 335351887 /nfs/dbraw/zinc/35/18/87/335351887.db2.gz AEAWFYQGSDTWBW-LLVKDONJSA-N 1 2 295.213 4.581 20 0 CJADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1c(Cl)cccc1Cl ZINC000177064431 333053269 /nfs/dbraw/zinc/05/32/69/333053269.db2.gz QWEZEYBPDYQVRM-NSHDSACASA-N 1 2 295.213 4.581 20 0 CJADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1c(Cl)cccc1Cl ZINC000177064431 333053268 /nfs/dbraw/zinc/05/32/68/333053268.db2.gz QWEZEYBPDYQVRM-NSHDSACASA-N 1 2 295.213 4.581 20 0 CJADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1c(Cl)cccc1Cl ZINC000177064443 333053203 /nfs/dbraw/zinc/05/32/03/333053203.db2.gz QWEZEYBPDYQVRM-LLVKDONJSA-N 1 2 295.213 4.581 20 0 CJADLO C[C@H](c1ccccn1)[N@H+](C)Cc1c(Cl)cccc1Cl ZINC000177064443 333053202 /nfs/dbraw/zinc/05/32/02/333053202.db2.gz QWEZEYBPDYQVRM-LLVKDONJSA-N 1 2 295.213 4.581 20 0 CJADLO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ncc(C(C)(C)C)o2)cc1 ZINC000177432452 261700784 /nfs/dbraw/zinc/70/07/84/261700784.db2.gz WZDNSHGYTXMKHW-KBPBESRZSA-N 1 2 286.419 4.692 20 0 CJADLO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ncc(C(C)(C)C)o2)cc1 ZINC000177432482 261701010 /nfs/dbraw/zinc/70/10/10/261701010.db2.gz WZDNSHGYTXMKHW-UONOGXRCSA-N 1 2 286.419 4.692 20 0 CJADLO Cc1ccc(C[N@H+](C)[C@@H](C)c2ncc(C(C)(C)C)o2)s1 ZINC000177670700 333061553 /nfs/dbraw/zinc/06/15/53/333061553.db2.gz LMCYKHCKGJPMRL-LBPRGKRZSA-N 1 2 292.448 4.535 20 0 CJADLO Cc1ccc(C[N@@H+](C)[C@@H](C)c2ncc(C(C)(C)C)o2)s1 ZINC000177670700 333061552 /nfs/dbraw/zinc/06/15/52/333061552.db2.gz LMCYKHCKGJPMRL-LBPRGKRZSA-N 1 2 292.448 4.535 20 0 CJADLO Cc1ccc(C[N@H+](C)[C@H](C)c2ncc(C(C)(C)C)o2)s1 ZINC000177670713 333061663 /nfs/dbraw/zinc/06/16/63/333061663.db2.gz LMCYKHCKGJPMRL-GFCCVEGCSA-N 1 2 292.448 4.535 20 0 CJADLO Cc1ccc(C[N@@H+](C)[C@H](C)c2ncc(C(C)(C)C)o2)s1 ZINC000177670713 333061661 /nfs/dbraw/zinc/06/16/61/333061661.db2.gz LMCYKHCKGJPMRL-GFCCVEGCSA-N 1 2 292.448 4.535 20 0 CJADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000177824056 333063471 /nfs/dbraw/zinc/06/34/71/333063471.db2.gz LIYRUMUCPZTBPM-KEYYUXOJSA-N 1 2 298.430 4.726 20 0 CJADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000177824056 333063470 /nfs/dbraw/zinc/06/34/70/333063470.db2.gz LIYRUMUCPZTBPM-KEYYUXOJSA-N 1 2 298.430 4.726 20 0 CJADLO C[C@@H](c1ccc(Cl)cc1)[N@@H+](Cc1cscn1)C1CC1 ZINC000178514141 333074651 /nfs/dbraw/zinc/07/46/51/333074651.db2.gz JOLPDZVEWAPERZ-NSHDSACASA-N 1 2 292.835 4.522 20 0 CJADLO C[C@@H](c1ccc(Cl)cc1)[N@H+](Cc1cscn1)C1CC1 ZINC000178514141 333074650 /nfs/dbraw/zinc/07/46/50/333074650.db2.gz JOLPDZVEWAPERZ-NSHDSACASA-N 1 2 292.835 4.522 20 0 CJADLO C[C@H](c1ccc(Cl)cc1)[N@@H+](Cc1cscn1)C1CC1 ZINC000178514153 333074624 /nfs/dbraw/zinc/07/46/24/333074624.db2.gz JOLPDZVEWAPERZ-LLVKDONJSA-N 1 2 292.835 4.522 20 0 CJADLO C[C@H](c1ccc(Cl)cc1)[N@H+](Cc1cscn1)C1CC1 ZINC000178514153 333074623 /nfs/dbraw/zinc/07/46/23/333074623.db2.gz JOLPDZVEWAPERZ-LLVKDONJSA-N 1 2 292.835 4.522 20 0 CJADLO C[C@H](Nc1cccc([NH+]2CCCCCC2)c1)c1ccoc1 ZINC000179959020 327804231 /nfs/dbraw/zinc/80/42/31/327804231.db2.gz DIWVZXPYHQQFIE-HNNXBMFYSA-N 1 2 284.403 4.833 20 0 CJADLO CCc1nc([C@H](C)[NH2+][C@H](CC)c2ccccc2F)cs1 ZINC000180522338 261864273 /nfs/dbraw/zinc/86/42/73/261864273.db2.gz QXMPNELLLABTCK-SMDDNHRTSA-N 1 2 292.423 4.647 20 0 CJADLO Cc1ccc(N[C@@H](C)c2cccc(-c3ccncc3)c2)c[nH+]1 ZINC000182910028 335849909 /nfs/dbraw/zinc/84/99/09/335849909.db2.gz MOYGKVQTBNBMON-HNNXBMFYSA-N 1 2 289.382 4.625 20 0 CJADLO Cc1ccc(CNc2ccccc2SC(C)C)c(C)[nH+]1 ZINC000184488396 333129220 /nfs/dbraw/zinc/12/92/20/333129220.db2.gz HKSCYUWPSBGGIX-UHFFFAOYSA-N 1 2 286.444 4.811 20 0 CJADLO CC[C@H]([NH2+][C@@H](C)c1cccc(Cl)c1F)c1nccs1 ZINC000184659298 333131139 /nfs/dbraw/zinc/13/11/39/333131139.db2.gz UZKDNKYMXUBJPQ-CABZTGNLSA-N 1 2 298.814 4.738 20 0 CJADLO CC[C@@H]([NH2+][C@@H](C)c1cccc(Cl)c1F)c1nccs1 ZINC000184659316 333131064 /nfs/dbraw/zinc/13/10/64/333131064.db2.gz UZKDNKYMXUBJPQ-JOYOIKCWSA-N 1 2 298.814 4.738 20 0 CJADLO CC[C@H]([NH2+][C@H](C)c1cccc(Cl)c1F)c1nccs1 ZINC000184659334 333131098 /nfs/dbraw/zinc/13/10/98/333131098.db2.gz UZKDNKYMXUBJPQ-SKDRFNHKSA-N 1 2 298.814 4.738 20 0 CJADLO CC[C@@H]([NH2+][C@H](C)c1cccc(Cl)c1F)c1nccs1 ZINC000184659356 333131071 /nfs/dbraw/zinc/13/10/71/333131071.db2.gz UZKDNKYMXUBJPQ-BXKDBHETSA-N 1 2 298.814 4.738 20 0 CJADLO Cc1cnc([C@@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2F)s1 ZINC000184662402 333131136 /nfs/dbraw/zinc/13/11/36/333131136.db2.gz LSWWCUUQUBWBNR-VHSXEESVSA-N 1 2 298.814 4.656 20 0 CJADLO Cc1cnc([C@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2F)s1 ZINC000184662418 333131120 /nfs/dbraw/zinc/13/11/20/333131120.db2.gz LSWWCUUQUBWBNR-UWVGGRQHSA-N 1 2 298.814 4.656 20 0 CJADLO Cc1cnc([C@@H](C)[NH2+][C@H](C)c2cccc(Cl)c2F)s1 ZINC000184662433 333131142 /nfs/dbraw/zinc/13/11/42/333131142.db2.gz LSWWCUUQUBWBNR-NXEZZACHSA-N 1 2 298.814 4.656 20 0 CJADLO Cc1cnc([C@H](C)[NH2+][C@H](C)c2cccc(Cl)c2F)s1 ZINC000184662453 333131190 /nfs/dbraw/zinc/13/11/90/333131190.db2.gz LSWWCUUQUBWBNR-ZJUUUORDSA-N 1 2 298.814 4.656 20 0 CJADLO Cc1ccc(CSCc2csc(C(C)C)n2)c(C)[nH+]1 ZINC000184816649 329262796 /nfs/dbraw/zinc/26/27/96/329262796.db2.gz MVYVYCIBERMRIH-UHFFFAOYSA-N 1 2 292.473 4.712 20 0 CJADLO Cc1ccc(CS[C@@H](C)c2nc3ccccc3o2)c(C)[nH+]1 ZINC000184834553 333132669 /nfs/dbraw/zinc/13/26/69/333132669.db2.gz OQQZMHWABADZOH-ZDUSSCGKSA-N 1 2 298.411 4.834 20 0 CJADLO Cc1ccc(CS[C@H](C)c2nc3ccccc3o2)c(C)[nH+]1 ZINC000184834573 333132716 /nfs/dbraw/zinc/13/27/16/333132716.db2.gz OQQZMHWABADZOH-CYBMUJFWSA-N 1 2 298.411 4.834 20 0 CJADLO C[C@H]([NH2+][C@@H](C)c1ccccc1)c1nc(C2CCCCC2)no1 ZINC000185232486 262047005 /nfs/dbraw/zinc/04/70/05/262047005.db2.gz NGKXCCYEUJUJCP-KBPBESRZSA-N 1 2 299.418 4.529 20 0 CJADLO C[C@@H]([NH2+][C@@H](C)c1nc(C2CCCCC2)no1)c1ccccc1 ZINC000185232502 262046849 /nfs/dbraw/zinc/04/68/49/262046849.db2.gz NGKXCCYEUJUJCP-KGLIPLIRSA-N 1 2 299.418 4.529 20 0 CJADLO C[C@@H]([NH2+][C@@H](C)c1ccccc1)c1nc(C2CCCCC2)no1 ZINC000185232519 262046983 /nfs/dbraw/zinc/04/69/83/262046983.db2.gz NGKXCCYEUJUJCP-UONOGXRCSA-N 1 2 299.418 4.529 20 0 CJADLO C[C@@H]([NH2+][C@H](C)c1ccccc1)c1nc(C2CCCCC2)no1 ZINC000185232533 262047092 /nfs/dbraw/zinc/04/70/92/262047092.db2.gz NGKXCCYEUJUJCP-ZIAGYGMSSA-N 1 2 299.418 4.529 20 0 CJADLO CC[C@H]([NH2+][C@@H](C)c1nccs1)c1cccc(Cl)c1F ZINC000185980622 327916161 /nfs/dbraw/zinc/91/61/61/327916161.db2.gz JMFRNNDQDLRIPZ-CABZTGNLSA-N 1 2 298.814 4.738 20 0 CJADLO CC[C@@H]([NH2+][C@@H](C)c1nccs1)c1cccc(Cl)c1F ZINC000185980640 327916081 /nfs/dbraw/zinc/91/60/81/327916081.db2.gz JMFRNNDQDLRIPZ-JOYOIKCWSA-N 1 2 298.814 4.738 20 0 CJADLO CC(C)c1nc([C@@H](C)[NH2+][C@@H]2CCCc3occc32)cs1 ZINC000186239630 262085621 /nfs/dbraw/zinc/08/56/21/262085621.db2.gz LAJYQGXRHLGKQE-DGCLKSJQSA-N 1 2 290.432 4.588 20 0 CJADLO CC(C)c1nc([C@H](C)[NH2+][C@@H]2CCCc3occc32)cs1 ZINC000186239645 262085647 /nfs/dbraw/zinc/08/56/47/262085647.db2.gz LAJYQGXRHLGKQE-WCQYABFASA-N 1 2 290.432 4.588 20 0 CJADLO CC(C)c1nc([C@@H](C)[NH2+][C@H]2CCCc3occc32)cs1 ZINC000186239665 262085553 /nfs/dbraw/zinc/08/55/53/262085553.db2.gz LAJYQGXRHLGKQE-YPMHNXCESA-N 1 2 290.432 4.588 20 0 CJADLO CC(C)c1nc([C@H](C)[NH2+][C@H]2CCCc3occc32)cs1 ZINC000186239684 262085383 /nfs/dbraw/zinc/08/53/83/262085383.db2.gz LAJYQGXRHLGKQE-AAEUAGOBSA-N 1 2 290.432 4.588 20 0 CJADLO CC(C)c1nc([C@@H](C)Nc2ccc([NH+](C)C)cc2)cs1 ZINC000186475630 262094614 /nfs/dbraw/zinc/09/46/14/262094614.db2.gz BLSRPLXGEMFCQA-GFCCVEGCSA-N 1 2 289.448 4.506 20 0 CJADLO CC(C)c1nc([C@H](C)Nc2ccc([NH+](C)C)cc2)cs1 ZINC000186475649 262094584 /nfs/dbraw/zinc/09/45/84/262094584.db2.gz BLSRPLXGEMFCQA-LBPRGKRZSA-N 1 2 289.448 4.506 20 0 CJADLO Cc1ccc(CSc2ccnc3ccccc32)c(C)[nH+]1 ZINC000186606412 329346395 /nfs/dbraw/zinc/34/63/95/329346395.db2.gz BPKHIQPUPGBLHQ-UHFFFAOYSA-N 1 2 280.396 4.539 20 0 CJADLO Cc1csc([C@@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2F)n1 ZINC000187504705 333171899 /nfs/dbraw/zinc/17/18/99/333171899.db2.gz QIGLUGGPJKMZLM-VHSXEESVSA-N 1 2 298.814 4.656 20 0 CJADLO Cc1csc([C@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2F)n1 ZINC000187504729 333171745 /nfs/dbraw/zinc/17/17/45/333171745.db2.gz QIGLUGGPJKMZLM-UWVGGRQHSA-N 1 2 298.814 4.656 20 0 CJADLO Cc1csc([C@@H](C)[NH2+][C@H](C)c2cccc(Cl)c2F)n1 ZINC000187504746 333171803 /nfs/dbraw/zinc/17/18/03/333171803.db2.gz QIGLUGGPJKMZLM-NXEZZACHSA-N 1 2 298.814 4.656 20 0 CJADLO Cc1csc([C@H](C)[NH2+][C@H](C)c2cccc(Cl)c2F)n1 ZINC000187504761 333171779 /nfs/dbraw/zinc/17/17/79/333171779.db2.gz QIGLUGGPJKMZLM-ZJUUUORDSA-N 1 2 298.814 4.656 20 0 CJADLO Cc1nc([C@@H]2CCC[N@H+]2Cc2ccc(Cl)s2)cs1 ZINC000189829668 329389516 /nfs/dbraw/zinc/38/95/16/329389516.db2.gz CQWGRXRZKAPLNK-LBPRGKRZSA-N 1 2 298.864 4.504 20 0 CJADLO Cc1nc([C@@H]2CCC[N@@H+]2Cc2ccc(Cl)s2)cs1 ZINC000189829668 329389515 /nfs/dbraw/zinc/38/95/15/329389515.db2.gz CQWGRXRZKAPLNK-LBPRGKRZSA-N 1 2 298.864 4.504 20 0 CJADLO Cc1nc([C@H]2CCC[N@H+]2Cc2ccc(Cl)s2)cs1 ZINC000189829685 329389504 /nfs/dbraw/zinc/38/95/04/329389504.db2.gz CQWGRXRZKAPLNK-GFCCVEGCSA-N 1 2 298.864 4.504 20 0 CJADLO Cc1nc([C@H]2CCC[N@@H+]2Cc2ccc(Cl)s2)cs1 ZINC000189829685 329389502 /nfs/dbraw/zinc/38/95/02/329389502.db2.gz CQWGRXRZKAPLNK-GFCCVEGCSA-N 1 2 298.864 4.504 20 0 CJADLO Cc1[nH+]c2ccccc2c(NC(=O)c2ccco2)c1C(C)C ZINC000191319624 534671761 /nfs/dbraw/zinc/67/17/61/534671761.db2.gz IWDRYKWSRFUAID-UHFFFAOYSA-N 1 2 294.354 4.512 20 0 CJADLO Cc1cc(C)c(NC(=O)c2ccc(C3CCC3)cc2)c(C)[nH+]1 ZINC000191864279 333226497 /nfs/dbraw/zinc/22/64/97/333226497.db2.gz WWEYHGXQXBKGFB-UHFFFAOYSA-N 1 2 294.398 4.527 20 0 CJADLO Cc1[nH+]c2ccccc2c(NC(=O)C2CC=CC2)c1C(C)C ZINC000191956784 333227677 /nfs/dbraw/zinc/22/76/77/333227677.db2.gz WJUCYRMADOOVTP-UHFFFAOYSA-N 1 2 294.398 4.571 20 0 CJADLO CCC(CC)c1cc(C[NH2+]Cc2sccc2Cl)on1 ZINC000193127433 333243119 /nfs/dbraw/zinc/24/31/19/333243119.db2.gz ZLRPTGKXFRKQIR-UHFFFAOYSA-N 1 2 298.839 4.583 20 0 CJADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1cccc(Cl)c1Cl ZINC000194155021 336006529 /nfs/dbraw/zinc/00/65/29/336006529.db2.gz NJKDBKRZIISNRW-NSHDSACASA-N 1 2 295.213 4.581 20 0 CJADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1cccc(Cl)c1Cl ZINC000194155021 336006528 /nfs/dbraw/zinc/00/65/28/336006528.db2.gz NJKDBKRZIISNRW-NSHDSACASA-N 1 2 295.213 4.581 20 0 CJADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1cccc(Cl)c1Cl ZINC000194155032 336006558 /nfs/dbraw/zinc/00/65/58/336006558.db2.gz NJKDBKRZIISNRW-LLVKDONJSA-N 1 2 295.213 4.581 20 0 CJADLO C[C@H](c1ccccn1)[N@H+](C)Cc1cccc(Cl)c1Cl ZINC000194155032 336006557 /nfs/dbraw/zinc/00/65/57/336006557.db2.gz NJKDBKRZIISNRW-LLVKDONJSA-N 1 2 295.213 4.581 20 0 CJADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1cccc(Cl)c1Cl ZINC000194294987 336014334 /nfs/dbraw/zinc/01/43/34/336014334.db2.gz FYKXREAFBYDCRU-NSHDSACASA-N 1 2 295.213 4.581 20 0 CJADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1cccc(Cl)c1Cl ZINC000194294987 336014333 /nfs/dbraw/zinc/01/43/33/336014333.db2.gz FYKXREAFBYDCRU-NSHDSACASA-N 1 2 295.213 4.581 20 0 CJADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1cccc(Cl)c1Cl ZINC000194294996 336014522 /nfs/dbraw/zinc/01/45/22/336014522.db2.gz FYKXREAFBYDCRU-LLVKDONJSA-N 1 2 295.213 4.581 20 0 CJADLO C[C@H](c1cccnc1)[N@H+](C)Cc1cccc(Cl)c1Cl ZINC000194294996 336014520 /nfs/dbraw/zinc/01/45/20/336014520.db2.gz FYKXREAFBYDCRU-LLVKDONJSA-N 1 2 295.213 4.581 20 0 CJADLO C[C@H]([NH2+][C@H](c1nccs1)c1ccccc1)c1ccccc1 ZINC000195038160 329690184 /nfs/dbraw/zinc/69/01/84/329690184.db2.gz MLRBVINMKFCYJQ-YOEHRIQHSA-N 1 2 294.423 4.583 20 0 CJADLO C[C@H]([NH2+][C@@H](c1nccs1)c1ccccc1)c1ccccc1 ZINC000195038190 329690180 /nfs/dbraw/zinc/69/01/80/329690180.db2.gz MLRBVINMKFCYJQ-WMLDXEAASA-N 1 2 294.423 4.583 20 0 CJADLO C[C@@H]([NH2+][C@@H](c1nccs1)c1ccccc1)c1ccccc1 ZINC000195038204 329690297 /nfs/dbraw/zinc/69/02/97/329690297.db2.gz MLRBVINMKFCYJQ-RHSMWYFYSA-N 1 2 294.423 4.583 20 0 CJADLO Cc1cccc2[nH+]c(CSc3ccccc3Cl)cn21 ZINC000219738274 333156272 /nfs/dbraw/zinc/15/62/72/333156272.db2.gz FEUSWVZKGOZTAO-UHFFFAOYSA-N 1 2 288.803 4.588 20 0 CJADLO Cc1ccc(SCc2cn3c(cccc3C)[nH+]2)cc1C ZINC000219738580 333156262 /nfs/dbraw/zinc/15/62/62/333156262.db2.gz NWHCLLOLABQQCQ-UHFFFAOYSA-N 1 2 282.412 4.552 20 0 CJADLO Cc1cnc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)o1 ZINC000220885646 333170229 /nfs/dbraw/zinc/17/02/29/333170229.db2.gz OPYWEWMEQKQPIF-VHSXEESVSA-N 1 2 299.201 4.702 20 0 CJADLO Cc1cnc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)o1 ZINC000220885690 333170406 /nfs/dbraw/zinc/17/04/06/333170406.db2.gz OPYWEWMEQKQPIF-UWVGGRQHSA-N 1 2 299.201 4.702 20 0 CJADLO Cc1cnc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2Cl)o1 ZINC000220885754 333170209 /nfs/dbraw/zinc/17/02/09/333170209.db2.gz OPYWEWMEQKQPIF-NXEZZACHSA-N 1 2 299.201 4.702 20 0 CJADLO Cc1cnc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2Cl)o1 ZINC000220885819 333170200 /nfs/dbraw/zinc/17/02/00/333170200.db2.gz OPYWEWMEQKQPIF-ZJUUUORDSA-N 1 2 299.201 4.702 20 0 CJADLO Cc1cnc([C@@H](C)[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)o1 ZINC000220926638 333170873 /nfs/dbraw/zinc/17/08/73/333170873.db2.gz DYGOZOHYLINTTR-VHSXEESVSA-N 1 2 299.201 4.702 20 0 CJADLO Cc1cnc([C@H](C)[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)o1 ZINC000220926693 333170795 /nfs/dbraw/zinc/17/07/95/333170795.db2.gz DYGOZOHYLINTTR-UWVGGRQHSA-N 1 2 299.201 4.702 20 0 CJADLO Cc1cnc([C@@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2Cl)o1 ZINC000220926756 333170793 /nfs/dbraw/zinc/17/07/93/333170793.db2.gz DYGOZOHYLINTTR-NXEZZACHSA-N 1 2 299.201 4.702 20 0 CJADLO Cc1cnc([C@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2Cl)o1 ZINC000220926808 260141881 /nfs/dbraw/zinc/14/18/81/260141881.db2.gz DYGOZOHYLINTTR-ZJUUUORDSA-N 1 2 299.201 4.702 20 0 CJADLO Cc1cnc([C@@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2Cl)o1 ZINC000220942769 333171206 /nfs/dbraw/zinc/17/12/06/333171206.db2.gz QPZMUWSEZINPQM-VHSXEESVSA-N 1 2 299.201 4.702 20 0 CJADLO Cc1cnc([C@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2Cl)o1 ZINC000220942822 333171112 /nfs/dbraw/zinc/17/11/12/333171112.db2.gz QPZMUWSEZINPQM-UWVGGRQHSA-N 1 2 299.201 4.702 20 0 CJADLO Cc1cnc([C@@H](C)[NH2+][C@H](C)c2cccc(Cl)c2Cl)o1 ZINC000220942890 333171127 /nfs/dbraw/zinc/17/11/27/333171127.db2.gz QPZMUWSEZINPQM-NXEZZACHSA-N 1 2 299.201 4.702 20 0 CJADLO Cc1cnc([C@H](C)[NH2+][C@H](C)c2cccc(Cl)c2Cl)o1 ZINC000220942943 333171183 /nfs/dbraw/zinc/17/11/83/333171183.db2.gz QPZMUWSEZINPQM-ZJUUUORDSA-N 1 2 299.201 4.702 20 0 CJADLO C[C@@H]([NH2+]Cc1ccc(F)cc1Cl)c1c(F)cccc1F ZINC000225258622 333234294 /nfs/dbraw/zinc/23/42/94/333234294.db2.gz CEFHYHBYSFULAJ-SECBINFHSA-N 1 2 299.723 4.608 20 0 CJADLO Clc1ccc(CCNc2ccc3ccccc3[nH+]2)s1 ZINC000225733623 333239497 /nfs/dbraw/zinc/23/94/97/333239497.db2.gz KPFXKONVTFNTTI-UHFFFAOYSA-N 1 2 288.803 4.604 20 0 CJADLO Cc1[nH]ncc1C[NH2+][C@@H](c1ccc(C(C)(C)C)cc1)C(C)C ZINC000236731766 333375272 /nfs/dbraw/zinc/37/52/72/333375272.db2.gz GFYPKTZHSMBJST-GOSISDBHSA-N 1 2 299.462 4.503 20 0 CJADLO Cc1[nH]ncc1C[NH2+][C@H](c1ccc(C(C)(C)C)cc1)C(C)C ZINC000236785148 333375516 /nfs/dbraw/zinc/37/55/16/333375516.db2.gz GFYPKTZHSMBJST-SFHVURJKSA-N 1 2 299.462 4.503 20 0 CJADLO Cc1cc(N2CCCC2)ccc1[NH2+][C@@H](C)CCc1ccco1 ZINC000237362293 334087432 /nfs/dbraw/zinc/08/74/32/334087432.db2.gz WOEAZUUMLIJUCL-INIZCTEOSA-N 1 2 298.430 4.621 20 0 CJADLO Cc1ccc(F)c(C[NH2+][C@H](C)c2c(F)cccc2Cl)c1 ZINC000237451693 333379522 /nfs/dbraw/zinc/37/95/22/333379522.db2.gz QEPZCDWNHLBVOB-LLVKDONJSA-N 1 2 295.760 4.777 20 0 CJADLO Cc1ccc([C@@H](C)[NH2+]Cc2csc(-c3ccccc3)n2)o1 ZINC000237512413 334090259 /nfs/dbraw/zinc/09/02/59/334090259.db2.gz DBXAWDSQFZTILK-CYBMUJFWSA-N 1 2 298.411 4.562 20 0 CJADLO Cc1cc(N2CCCC2)ccc1[NH2+][C@H](C)CCc1ccco1 ZINC000237533857 334090774 /nfs/dbraw/zinc/09/07/74/334090774.db2.gz WOEAZUUMLIJUCL-MRXNPFEDSA-N 1 2 298.430 4.621 20 0 CJADLO Cc1ccc(F)c(C[NH2+][C@@H](C)c2c(F)cccc2Cl)c1 ZINC000237566186 333380236 /nfs/dbraw/zinc/38/02/36/333380236.db2.gz QEPZCDWNHLBVOB-NSHDSACASA-N 1 2 295.760 4.777 20 0 CJADLO Cc1ccc([C@H](C)[NH2+]Cc2csc(-c3ccccc3)n2)o1 ZINC000237642589 334093427 /nfs/dbraw/zinc/09/34/27/334093427.db2.gz DBXAWDSQFZTILK-ZDUSSCGKSA-N 1 2 298.411 4.562 20 0 CJADLO Clc1ccccc1-c1ccc(CNc2cccc[nH+]2)o1 ZINC000237661191 333380753 /nfs/dbraw/zinc/38/07/53/333380753.db2.gz CHHSJBUWMRFFEI-UHFFFAOYSA-N 1 2 284.746 4.607 20 0 CJADLO C[C@H](c1ccccc1)[N@@H+](C)Cc1c(F)cccc1Cl ZINC000248133048 334295373 /nfs/dbraw/zinc/29/53/73/334295373.db2.gz QYNFKIQPZQUORK-GFCCVEGCSA-N 1 2 277.770 4.672 20 0 CJADLO C[C@H](c1ccccc1)[N@H+](C)Cc1c(F)cccc1Cl ZINC000248133048 334295371 /nfs/dbraw/zinc/29/53/71/334295371.db2.gz QYNFKIQPZQUORK-GFCCVEGCSA-N 1 2 277.770 4.672 20 0 CJADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000248344277 334298727 /nfs/dbraw/zinc/29/87/27/334298727.db2.gz LIYRUMUCPZTBPM-CKEIUWERSA-N 1 2 298.430 4.726 20 0 CJADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000248344277 334298725 /nfs/dbraw/zinc/29/87/25/334298725.db2.gz LIYRUMUCPZTBPM-CKEIUWERSA-N 1 2 298.430 4.726 20 0 CJADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000248344278 334298778 /nfs/dbraw/zinc/29/87/78/334298778.db2.gz LIYRUMUCPZTBPM-CPUCHLNUSA-N 1 2 298.430 4.726 20 0 CJADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000248344278 334298777 /nfs/dbraw/zinc/29/87/77/334298777.db2.gz LIYRUMUCPZTBPM-CPUCHLNUSA-N 1 2 298.430 4.726 20 0 CJADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000248344279 334298690 /nfs/dbraw/zinc/29/86/90/334298690.db2.gz LIYRUMUCPZTBPM-JKIFEVAISA-N 1 2 298.430 4.726 20 0 CJADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000248344279 334298688 /nfs/dbraw/zinc/29/86/88/334298688.db2.gz LIYRUMUCPZTBPM-JKIFEVAISA-N 1 2 298.430 4.726 20 0 CJADLO CC[C@@H]([NH2+][C@@H](C)c1csc(C)n1)c1ccc(F)cc1F ZINC000265655026 522917354 /nfs/dbraw/zinc/91/73/54/522917354.db2.gz PETQCYRJVMKLKB-LKFCYVNXSA-N 1 2 296.386 4.532 20 0 CJADLO CC[C@H]([NH2+][C@H](C)c1csc(C)n1)c1ccc(F)cc1F ZINC000265655028 522744862 /nfs/dbraw/zinc/74/48/62/522744862.db2.gz PETQCYRJVMKLKB-OTYXRUKQSA-N 1 2 296.386 4.532 20 0 CJADLO CC[C@H]([NH2+][C@@H](C)c1csc(C)n1)c1ccc(F)cc1F ZINC000265655030 522703506 /nfs/dbraw/zinc/70/35/06/522703506.db2.gz PETQCYRJVMKLKB-XPTSAGLGSA-N 1 2 296.386 4.532 20 0 CJADLO CC[C@@H]([NH2+][C@H](C)c1csc(C)n1)c1ccc(F)cc1F ZINC000265655032 522941758 /nfs/dbraw/zinc/94/17/58/522941758.db2.gz PETQCYRJVMKLKB-YMTOWFKASA-N 1 2 296.386 4.532 20 0 CJADLO CC[C@@H]([NH2+][C@H](C)c1csc(C)n1)c1cc(F)ccc1F ZINC000268852754 522940223 /nfs/dbraw/zinc/94/02/23/522940223.db2.gz CKDLXQFXDWNXMM-YMTOWFKASA-N 1 2 296.386 4.532 20 0 CJADLO CCC[C@H]([NH2+][C@@H](C)c1cscn1)c1ccc(F)cc1F ZINC000271162291 521171107 /nfs/dbraw/zinc/17/11/07/521171107.db2.gz SGVCOZFAJZKMER-HZMBPMFUSA-N 1 2 296.386 4.613 20 0 CJADLO CCC[C@@H]([NH2+][C@@H](C)c1cscn1)c1ccc(F)cc1F ZINC000271162294 520789668 /nfs/dbraw/zinc/78/96/68/520789668.db2.gz SGVCOZFAJZKMER-IINYFYTJSA-N 1 2 296.386 4.613 20 0 CJADLO C[C@@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1cc2ccccc2o1 ZINC000273303681 525561028 /nfs/dbraw/zinc/56/10/28/525561028.db2.gz ORAKMJBHYVPLRB-GFCCVEGCSA-N 1 2 298.386 4.569 20 0 CJADLO C[C@@H]([NH2+]Cc1cc(C(C)(C)C)on1)c1cc2ccccc2o1 ZINC000278515390 525511100 /nfs/dbraw/zinc/51/11/00/525511100.db2.gz BVNZPKNLJWVNMF-GFCCVEGCSA-N 1 2 298.386 4.569 20 0 CJADLO C[C@H]([NH2+]Cc1cc(C(C)(C)C)on1)c1cc2ccccc2o1 ZINC000278515395 525430966 /nfs/dbraw/zinc/43/09/66/525430966.db2.gz BVNZPKNLJWVNMF-LBPRGKRZSA-N 1 2 298.386 4.569 20 0 CJADLO Cc1cc2ccccc2[nH+]c1NCc1cccc2cccnc21 ZINC000301674167 261339675 /nfs/dbraw/zinc/33/96/75/261339675.db2.gz BCKAFCQUGPQURC-UHFFFAOYSA-N 1 2 299.377 4.704 20 0 CJADLO Cc1ccc2[nH+]c(CSc3ccc(C)c(C)c3)cn2c1 ZINC000302745063 333334925 /nfs/dbraw/zinc/33/49/25/333334925.db2.gz FJUNPCFCKGOYRQ-UHFFFAOYSA-N 1 2 282.412 4.552 20 0 CJADLO Fc1cccc(Cl)c1C[N@@H+](Cc1cccs1)C1CC1 ZINC000302809870 333335302 /nfs/dbraw/zinc/33/53/02/333335302.db2.gz FXWYMNZVACGKBK-UHFFFAOYSA-N 1 2 295.810 4.705 20 0 CJADLO Fc1cccc(Cl)c1C[N@H+](Cc1cccs1)C1CC1 ZINC000302809870 333335301 /nfs/dbraw/zinc/33/53/01/333335301.db2.gz FXWYMNZVACGKBK-UHFFFAOYSA-N 1 2 295.810 4.705 20 0 CJADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1c(Cl)cccc1Cl ZINC000303031859 333336993 /nfs/dbraw/zinc/33/69/93/333336993.db2.gz XLUAEZVBSPROEZ-JTQLQIEISA-N 1 2 284.186 4.779 20 0 CJADLO C[C@@H](c1ccco1)[N@H+](C)Cc1c(Cl)cccc1Cl ZINC000303031859 333336992 /nfs/dbraw/zinc/33/69/92/333336992.db2.gz XLUAEZVBSPROEZ-JTQLQIEISA-N 1 2 284.186 4.779 20 0 CJADLO C[C@H](c1ccco1)[N@@H+](C)Cc1c(Cl)cccc1Cl ZINC000303031861 333337228 /nfs/dbraw/zinc/33/72/28/333337228.db2.gz XLUAEZVBSPROEZ-SNVBAGLBSA-N 1 2 284.186 4.779 20 0 CJADLO C[C@H](c1ccco1)[N@H+](C)Cc1c(Cl)cccc1Cl ZINC000303031861 333337227 /nfs/dbraw/zinc/33/72/27/333337227.db2.gz XLUAEZVBSPROEZ-SNVBAGLBSA-N 1 2 284.186 4.779 20 0 CJADLO Cc1cccc(-c2cccc(CNc3cccc[nH+]3)c2)c1 ZINC000303136936 328010682 /nfs/dbraw/zinc/01/06/82/328010682.db2.gz JRUPEFFDWAYFKQ-UHFFFAOYSA-N 1 2 274.367 4.669 20 0 CJADLO COc1c(C)c[nH+]c(CSc2ccccc2Cl)c1C ZINC000303576979 332939639 /nfs/dbraw/zinc/93/96/39/332939639.db2.gz QCCHRWVMWHUQNU-UHFFFAOYSA-N 1 2 293.819 4.653 20 0 CJADLO Cc1cccc2[nH+]c(CNc3ccccc3C(C)(C)C)cn21 ZINC000303947252 328371207 /nfs/dbraw/zinc/37/12/07/328371207.db2.gz UTUDWJSXZXRRAL-UHFFFAOYSA-N 1 2 293.414 4.552 20 0 CJADLO Cc1ccoc1C[NH2+][C@H](C)c1cc(Cl)sc1Cl ZINC000310463842 333058822 /nfs/dbraw/zinc/05/88/22/333058822.db2.gz YSGXZBOSZJAOIR-MRVPVSSYSA-N 1 2 290.215 4.807 20 0 CJADLO Cc1ccoc1C[NH2+][C@@H](C)c1cc(Cl)sc1Cl ZINC000310463843 333058799 /nfs/dbraw/zinc/05/87/99/333058799.db2.gz YSGXZBOSZJAOIR-QMMMGPOBSA-N 1 2 290.215 4.807 20 0 CJADLO C[C@@H]([NH2+]Cc1ccsc1Cl)c1c(F)cccc1F ZINC000312590992 260165169 /nfs/dbraw/zinc/16/51/69/260165169.db2.gz XDEDAOWJLRVOKK-MRVPVSSYSA-N 1 2 287.762 4.531 20 0 CJADLO C[C@H]([NH2+]Cc1ccsc1Cl)c1c(F)cccc1F ZINC000312590993 260165203 /nfs/dbraw/zinc/16/52/03/260165203.db2.gz XDEDAOWJLRVOKK-QMMMGPOBSA-N 1 2 287.762 4.531 20 0 CJADLO Cc1ccc([C@@H](C)[NH2+]Cc2cc(Cl)sc2Cl)o1 ZINC000312606322 327535419 /nfs/dbraw/zinc/53/54/19/327535419.db2.gz RESSVASGASHIPO-MRVPVSSYSA-N 1 2 290.215 4.807 20 0 CJADLO Cc1ccc([C@H](C)[NH2+]Cc2cc(Cl)sc2Cl)o1 ZINC000312606323 327535608 /nfs/dbraw/zinc/53/56/08/327535608.db2.gz RESSVASGASHIPO-QMMMGPOBSA-N 1 2 290.215 4.807 20 0 CJADLO C[C@@H]([NH2+]Cc1ccsc1Cl)c1cccc(F)c1F ZINC000312777544 260201484 /nfs/dbraw/zinc/20/14/84/260201484.db2.gz IIESXJUYMKQBBZ-MRVPVSSYSA-N 1 2 287.762 4.531 20 0 CJADLO C[C@H]([NH2+]Cc1ccsc1Cl)c1cccc(F)c1F ZINC000312777549 260201364 /nfs/dbraw/zinc/20/13/64/260201364.db2.gz IIESXJUYMKQBBZ-QMMMGPOBSA-N 1 2 287.762 4.531 20 0 CJADLO C[C@H]1C[C@@H](Nc2cccc(C(F)F)c2Cl)c2[nH+]ccn21 ZINC000334522328 224749697 /nfs/dbraw/zinc/74/96/97/224749697.db2.gz RZRTXIXFJSCYJH-GZMMTYOYSA-N 1 2 297.736 4.592 20 0 CJADLO Cc1occc1SCc1ccc(C(C)C)[nH+]c1C ZINC000338564065 526829906 /nfs/dbraw/zinc/82/99/06/526829906.db2.gz QWILORIKWPZTTE-UHFFFAOYSA-N 1 2 261.390 4.707 20 0 CJADLO Cc1nc([C@H]2CCC[N@H+]2Cc2sccc2Cl)cs1 ZINC000338564194 527081816 /nfs/dbraw/zinc/08/18/16/527081816.db2.gz GRTGWXYPPJXOQQ-GFCCVEGCSA-N 1 2 298.864 4.504 20 0 CJADLO Cc1nc([C@H]2CCC[N@@H+]2Cc2sccc2Cl)cs1 ZINC000338564194 527081810 /nfs/dbraw/zinc/08/18/10/527081810.db2.gz GRTGWXYPPJXOQQ-GFCCVEGCSA-N 1 2 298.864 4.504 20 0 CJADLO Cc1nc([C@@H]2CCC[N@H+]2Cc2sccc2Cl)cs1 ZINC000338564195 527054348 /nfs/dbraw/zinc/05/43/48/527054348.db2.gz GRTGWXYPPJXOQQ-LBPRGKRZSA-N 1 2 298.864 4.504 20 0 CJADLO Cc1nc([C@@H]2CCC[N@@H+]2Cc2sccc2Cl)cs1 ZINC000338564195 527054342 /nfs/dbraw/zinc/05/43/42/527054342.db2.gz GRTGWXYPPJXOQQ-LBPRGKRZSA-N 1 2 298.864 4.504 20 0 CJADLO Cc1cnccc1SCc1ccc(C(C)C)[nH+]c1C ZINC000338624824 526243681 /nfs/dbraw/zinc/24/36/81/526243681.db2.gz JDFWBYSUQOPVFT-UHFFFAOYSA-N 1 2 272.417 4.509 20 0 CJADLO Cc1ccoc1C[NH2+][C@H](C)c1nc(-c2ccccc2)cs1 ZINC000344254728 534449233 /nfs/dbraw/zinc/44/92/33/534449233.db2.gz HDRRVFPDQGZPMO-CYBMUJFWSA-N 1 2 298.411 4.562 20 0 CJADLO Cc1ccoc1C[NH2+][C@@H](C)c1nc(-c2ccccc2)cs1 ZINC000344254735 534447590 /nfs/dbraw/zinc/44/75/90/534447590.db2.gz HDRRVFPDQGZPMO-ZDUSSCGKSA-N 1 2 298.411 4.562 20 0 CJADLO CCSc1ccccc1[C@@H](C)Nc1ccc(C)[nH+]c1 ZINC000347127654 529257866 /nfs/dbraw/zinc/25/78/66/529257866.db2.gz MKZAGBUWMGCITF-CYBMUJFWSA-N 1 2 272.417 4.675 20 0 CJADLO CCSc1ccccc1[C@H](C)Nc1ccc(C)[nH+]c1 ZINC000347127658 529257779 /nfs/dbraw/zinc/25/77/79/529257779.db2.gz MKZAGBUWMGCITF-ZDUSSCGKSA-N 1 2 272.417 4.675 20 0 CJADLO Cc1ccc(N[C@@H](C)c2ccc(-c3ccncc3)cc2)c[nH+]1 ZINC000347149068 226061127 /nfs/dbraw/zinc/06/11/27/226061127.db2.gz MXXFLRAVKDOQIC-HNNXBMFYSA-N 1 2 289.382 4.625 20 0 CJADLO Cc1ccc(N[C@H](C)c2ccc(-c3ccncc3)cc2)c[nH+]1 ZINC000347149078 226061118 /nfs/dbraw/zinc/06/11/18/226061118.db2.gz MXXFLRAVKDOQIC-OAHLLOKOSA-N 1 2 289.382 4.625 20 0 CJADLO CCSCc1cc[nH+]c(NCc2ccc3occc3c2)c1 ZINC000351619374 529202051 /nfs/dbraw/zinc/20/20/51/529202051.db2.gz IKVBRFYJGODBBI-UHFFFAOYSA-N 1 2 298.411 4.693 20 0 CJADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2ncc(Cl)s2)s1 ZINC000352011354 228173940 /nfs/dbraw/zinc/17/39/40/228173940.db2.gz QMQGCEXAHZARBU-JTQLQIEISA-N 1 2 298.864 4.504 20 0 CJADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2ncc(Cl)s2)s1 ZINC000352011354 228173939 /nfs/dbraw/zinc/17/39/39/228173939.db2.gz QMQGCEXAHZARBU-JTQLQIEISA-N 1 2 298.864 4.504 20 0 CJADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2ncc(Cl)s2)s1 ZINC000352011355 228174032 /nfs/dbraw/zinc/17/40/32/228174032.db2.gz QMQGCEXAHZARBU-SNVBAGLBSA-N 1 2 298.864 4.504 20 0 CJADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2ncc(Cl)s2)s1 ZINC000352011355 228174031 /nfs/dbraw/zinc/17/40/31/228174031.db2.gz QMQGCEXAHZARBU-SNVBAGLBSA-N 1 2 298.864 4.504 20 0 CJADLO Fc1ccc2cc[nH+]c(N[C@H]3CSc4ccccc43)c2c1 ZINC000354338729 534510158 /nfs/dbraw/zinc/51/01/58/534510158.db2.gz IEXOMYNQBOZDDW-HNNXBMFYSA-N 1 2 296.370 4.633 20 0 CJADLO COc1ccc([C@@H](C)Nc2[nH+]ccc3ccc(F)cc32)cc1 ZINC000354561135 533118359 /nfs/dbraw/zinc/11/83/59/533118359.db2.gz HBXVQOKXMGPNMR-GFCCVEGCSA-N 1 2 296.345 4.556 20 0 CJADLO COc1ccc([C@H](C)Nc2[nH+]ccc3ccc(F)cc32)cc1 ZINC000354561136 227032367 /nfs/dbraw/zinc/03/23/67/227032367.db2.gz HBXVQOKXMGPNMR-LBPRGKRZSA-N 1 2 296.345 4.556 20 0 CJADLO Fc1ccc2cc[nH+]c(NCc3ccc(Cl)s3)c2c1 ZINC000354568043 534508842 /nfs/dbraw/zinc/50/88/42/534508842.db2.gz ODJKZEWHQAPNAY-UHFFFAOYSA-N 1 2 292.766 4.701 20 0 CJADLO COc1cccc([C@@H](C)Nc2[nH+]ccc3ccc(F)cc32)c1 ZINC000354585349 533712548 /nfs/dbraw/zinc/71/25/48/533712548.db2.gz XRJJOZJTIBNGCH-GFCCVEGCSA-N 1 2 296.345 4.556 20 0 CJADLO COc1cccc([C@H](C)Nc2[nH+]ccc3ccc(F)cc32)c1 ZINC000354585350 533776314 /nfs/dbraw/zinc/77/63/14/533776314.db2.gz XRJJOZJTIBNGCH-LBPRGKRZSA-N 1 2 296.345 4.556 20 0 CJADLO CC[C@H](CC(F)(F)F)Nc1[nH+]ccc2ccc(F)cc21 ZINC000354593722 328857988 /nfs/dbraw/zinc/85/79/88/328857988.db2.gz KDCFGDSRVVPRGH-LLVKDONJSA-N 1 2 286.272 4.517 20 0 CJADLO CC[C@H](Nc1[nH+]ccc2ccc(F)cc21)c1c(C)noc1C ZINC000354888730 529682080 /nfs/dbraw/zinc/68/20/80/529682080.db2.gz PWKZPJQJOZZHLR-HNNXBMFYSA-N 1 2 299.349 4.542 20 0 CJADLO CC[C@@H](Nc1[nH+]ccc2ccc(F)cc21)c1c(C)noc1C ZINC000354888742 529213439 /nfs/dbraw/zinc/21/34/39/529213439.db2.gz PWKZPJQJOZZHLR-OAHLLOKOSA-N 1 2 299.349 4.542 20 0 CJADLO CCSc1cccc(F)c1NCc1ccc(C)[nH+]c1C ZINC000357268331 266269770 /nfs/dbraw/zinc/26/97/70/266269770.db2.gz KWUPBZYMXFEMRQ-UHFFFAOYSA-N 1 2 290.407 4.562 20 0 CJADLO Cc1nc(-c2ccc([C@@H](C)Nc3cccc[nH+]3)cc2)cs1 ZINC000357468050 266303829 /nfs/dbraw/zinc/30/38/29/266303829.db2.gz DACLYTPAXOCVCJ-GFCCVEGCSA-N 1 2 295.411 4.687 20 0 CJADLO Cc1nc(-c2ccc([C@H](C)Nc3cccc[nH+]3)cc2)cs1 ZINC000357468052 266303704 /nfs/dbraw/zinc/30/37/04/266303704.db2.gz DACLYTPAXOCVCJ-LBPRGKRZSA-N 1 2 295.411 4.687 20 0 CJADLO Cc1ccc2c(c1)C[N@H+](Cc1cnc(C3CCCC3)s1)C2 ZINC000361106659 266784550 /nfs/dbraw/zinc/78/45/50/266784550.db2.gz GCJIKYVFTHWYJI-UHFFFAOYSA-N 1 2 298.455 4.625 20 0 CJADLO Cc1ccc2c(c1)C[N@@H+](Cc1cnc(C3CCCC3)s1)C2 ZINC000361106659 266784547 /nfs/dbraw/zinc/78/45/47/266784547.db2.gz GCJIKYVFTHWYJI-UHFFFAOYSA-N 1 2 298.455 4.625 20 0 CJADLO CCCC[C@H](CC)C(=O)Nc1ccccc1-c1[nH]cc(C)[nH+]1 ZINC000370122511 267293422 /nfs/dbraw/zinc/29/34/22/267293422.db2.gz PQIIUVKEBLHVKR-AWEZNQCLSA-N 1 2 299.418 4.540 20 0 CJADLO CCCC[C@@H](CC)C(=O)Nc1ccccc1-c1[nH]cc(C)[nH+]1 ZINC000370122512 267292905 /nfs/dbraw/zinc/29/29/05/267292905.db2.gz PQIIUVKEBLHVKR-CQSZACIVSA-N 1 2 299.418 4.540 20 0 CJADLO Cc1sc(C[NH2+][C@H](C)c2ccco2)nc1-c1ccccc1 ZINC000370675678 267337735 /nfs/dbraw/zinc/33/77/35/267337735.db2.gz DEYYWTCOENVHTA-GFCCVEGCSA-N 1 2 298.411 4.562 20 0 CJADLO Cc1sc(C[NH2+][C@@H](C)c2ccco2)nc1-c1ccccc1 ZINC000370675679 267337091 /nfs/dbraw/zinc/33/70/91/267337091.db2.gz DEYYWTCOENVHTA-LBPRGKRZSA-N 1 2 298.411 4.562 20 0 CJADLO Cc1c[nH]c(-c2ccccc2NC(=O)CCCC(C)(C)C)[nH+]1 ZINC000371247143 267377441 /nfs/dbraw/zinc/37/74/41/267377441.db2.gz KOTSTSRWMZTUOK-UHFFFAOYSA-N 1 2 299.418 4.540 20 0 CJADLO CCCCCc1ccc(N[C@@H]2C[C@H](C)n3cc[nH+]c32)cc1 ZINC000379153816 328552234 /nfs/dbraw/zinc/55/22/34/328552234.db2.gz JQCGTKKILDCSJG-WMLDXEAASA-N 1 2 283.419 4.734 20 0 CJADLO CC[C@H](Nc1ccc(N(CC)CC)[nH+]c1)c1ccsc1 ZINC000382146109 336082752 /nfs/dbraw/zinc/08/27/52/336082752.db2.gz RLDWVEQQJQPDCC-HNNXBMFYSA-N 1 2 289.448 4.553 20 0 CJADLO CC[C@@H](Nc1ccc(N(CC)CC)[nH+]c1)c1ccsc1 ZINC000382146116 336082985 /nfs/dbraw/zinc/08/29/85/336082985.db2.gz RLDWVEQQJQPDCC-OAHLLOKOSA-N 1 2 289.448 4.553 20 0 CJADLO Cc1ccc(C)c(N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000386243437 329129588 /nfs/dbraw/zinc/12/95/88/329129588.db2.gz TXABALGZIDKIQY-INIZCTEOSA-N 1 2 291.398 4.662 20 0 CJADLO Cc1ccc(C)c(N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000386243438 336168804 /nfs/dbraw/zinc/16/88/04/336168804.db2.gz TXABALGZIDKIQY-MRXNPFEDSA-N 1 2 291.398 4.662 20 0 CJADLO CCc1ccc(N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000386910307 336182193 /nfs/dbraw/zinc/18/21/93/336182193.db2.gz JAGFDCYOQGMTOD-HNNXBMFYSA-N 1 2 291.398 4.608 20 0 CJADLO CCc1ccc(N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000386910308 336182159 /nfs/dbraw/zinc/18/21/59/336182159.db2.gz JAGFDCYOQGMTOD-OAHLLOKOSA-N 1 2 291.398 4.608 20 0 CJADLO Cc1cc([C@@H](C)[NH2+][C@@H](c2ccco2)c2ccccc2)c(C)o1 ZINC000387247986 336190260 /nfs/dbraw/zinc/19/02/60/336190260.db2.gz CITRNDYNKAQQJE-AUUYWEPGSA-N 1 2 295.382 4.930 20 0 CJADLO Cc1cc([C@H](C)[NH2+][C@@H](c2ccco2)c2ccccc2)c(C)o1 ZINC000387248000 336190270 /nfs/dbraw/zinc/19/02/70/336190270.db2.gz CITRNDYNKAQQJE-IFXJQAMLSA-N 1 2 295.382 4.930 20 0 CJADLO Cc1cc([C@@H](C)[NH2+][C@H](c2ccco2)c2ccccc2)c(C)o1 ZINC000387248005 336190445 /nfs/dbraw/zinc/19/04/45/336190445.db2.gz CITRNDYNKAQQJE-KUHUBIRLSA-N 1 2 295.382 4.930 20 0 CJADLO Cc1cc([C@H](C)[NH2+][C@H](c2ccco2)c2ccccc2)c(C)o1 ZINC000387248009 336190458 /nfs/dbraw/zinc/19/04/58/336190458.db2.gz CITRNDYNKAQQJE-LIRRHRJNSA-N 1 2 295.382 4.930 20 0 CJADLO COc1ccc2cc([C@@H](C)Nc3ccc(C)[nH+]c3)ccc2c1 ZINC000388134061 327841279 /nfs/dbraw/zinc/84/12/79/327841279.db2.gz CAMHHUNYKDRXOZ-CQSZACIVSA-N 1 2 292.382 4.725 20 0 CJADLO C[C@@H]([NH2+]Cc1sccc1Cl)c1c(F)cccc1F ZINC000394062954 329100763 /nfs/dbraw/zinc/10/07/63/329100763.db2.gz QCCMHRRXFCSRRT-MRVPVSSYSA-N 1 2 287.762 4.531 20 0 CJADLO C[C@H]([NH2+]Cc1sccc1Cl)c1c(F)cccc1F ZINC000394062955 329100700 /nfs/dbraw/zinc/10/07/00/329100700.db2.gz QCCMHRRXFCSRRT-QMMMGPOBSA-N 1 2 287.762 4.531 20 0 CJADLO Cc1ccc2cc([C@H](C)[NH2+][C@@H](C)c3nccs3)oc2c1 ZINC000414228267 262828859 /nfs/dbraw/zinc/82/88/59/262828859.db2.gz XVUUPDHHSCMBDF-RYUDHWBXSA-N 1 2 286.400 4.610 20 0 CJADLO FC(F)(F)[C@@H]1CCC[C@@H]([NH2+]c2ccc3c(c2)CCCN3)C1 ZINC000414856796 263073269 /nfs/dbraw/zinc/07/32/69/263073269.db2.gz ZIOQMXBVXCHFTQ-CHWSQXEVSA-N 1 2 298.352 4.578 20 0 CJADLO FC(F)(F)[C@@H]1CCC[C@@H](Nc2ccc3c(c2)CCC[NH2+]3)C1 ZINC000414856796 263073268 /nfs/dbraw/zinc/07/32/68/263073268.db2.gz ZIOQMXBVXCHFTQ-CHWSQXEVSA-N 1 2 298.352 4.578 20 0 CJADLO FC(F)(F)[C@@H]1CCC[C@H]([NH2+]c2ccc3c(c2)CCCN3)C1 ZINC000414856799 263073380 /nfs/dbraw/zinc/07/33/80/263073380.db2.gz ZIOQMXBVXCHFTQ-OLZOCXBDSA-N 1 2 298.352 4.578 20 0 CJADLO FC(F)(F)[C@@H]1CCC[C@H](Nc2ccc3c(c2)CCC[NH2+]3)C1 ZINC000414856799 263073379 /nfs/dbraw/zinc/07/33/79/263073379.db2.gz ZIOQMXBVXCHFTQ-OLZOCXBDSA-N 1 2 298.352 4.578 20 0 CJADLO FC(F)(F)[C@H]1CCC[C@@H]([NH2+]c2ccc3c(c2)CCCN3)C1 ZINC000414856803 263073235 /nfs/dbraw/zinc/07/32/35/263073235.db2.gz ZIOQMXBVXCHFTQ-QWHCGFSZSA-N 1 2 298.352 4.578 20 0 CJADLO FC(F)(F)[C@H]1CCC[C@@H](Nc2ccc3c(c2)CCC[NH2+]3)C1 ZINC000414856803 263073234 /nfs/dbraw/zinc/07/32/34/263073234.db2.gz ZIOQMXBVXCHFTQ-QWHCGFSZSA-N 1 2 298.352 4.578 20 0 CJADLO FC(F)(F)[C@H]1CCC[C@H]([NH2+]c2ccc3c(c2)CCCN3)C1 ZINC000414856807 263073258 /nfs/dbraw/zinc/07/32/58/263073258.db2.gz ZIOQMXBVXCHFTQ-STQMWFEESA-N 1 2 298.352 4.578 20 0 CJADLO FC(F)(F)[C@H]1CCC[C@H](Nc2ccc3c(c2)CCC[NH2+]3)C1 ZINC000414856807 263073257 /nfs/dbraw/zinc/07/32/57/263073257.db2.gz ZIOQMXBVXCHFTQ-STQMWFEESA-N 1 2 298.352 4.578 20 0 CJADLO C[C@@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccc(C2CC2)cc1 ZINC000419359145 329719905 /nfs/dbraw/zinc/71/99/05/329719905.db2.gz QYBGRQYXTAAJLZ-CYBMUJFWSA-N 1 2 298.430 4.700 20 0 CJADLO Cc1ncc(CSCc2ccc(C(C)C)[nH+]c2C)s1 ZINC000419416601 329725114 /nfs/dbraw/zinc/72/51/14/329725114.db2.gz WQDHZJBIJLHXNL-UHFFFAOYSA-N 1 2 292.473 4.712 20 0 CJADLO Cc1csc(CSCc2ccc(C(C)C)[nH+]c2C)n1 ZINC000419426362 329727968 /nfs/dbraw/zinc/72/79/68/329727968.db2.gz MZOYCCMZCSUMJL-UHFFFAOYSA-N 1 2 292.473 4.712 20 0 CJADLO Cc1cccnc1CSCc1ccc(C(C)C)[nH+]c1C ZINC000419458218 329731505 /nfs/dbraw/zinc/73/15/05/329731505.db2.gz YLHMEUBAHUOEGX-UHFFFAOYSA-N 1 2 286.444 4.650 20 0 CJADLO CCOC1CC(CSCc2ccc(C(C)C)[nH+]c2C)C1 ZINC000419472751 329735306 /nfs/dbraw/zinc/73/53/06/329735306.db2.gz IQEXFPDZYKJCJT-UHFFFAOYSA-N 1 2 293.476 4.562 20 0 CJADLO Cc1[nH+]c(C(C)C)ccc1CS[C@@H](C)c1cccnc1 ZINC000419475993 329735459 /nfs/dbraw/zinc/73/54/59/329735459.db2.gz NSKYVFCRIWJJRI-AWEZNQCLSA-N 1 2 286.444 4.903 20 0 CJADLO Cc1[nH+]c(C(C)C)ccc1CS[C@H](C)c1cccnc1 ZINC000419475994 329735439 /nfs/dbraw/zinc/73/54/39/329735439.db2.gz NSKYVFCRIWJJRI-CQSZACIVSA-N 1 2 286.444 4.903 20 0 CJADLO Cc1cnc([C@@H](C)SCc2ccc(C(C)C)[nH+]c2C)o1 ZINC000419487739 329736898 /nfs/dbraw/zinc/73/68/98/329736898.db2.gz BMGLMZYURKGABE-CYBMUJFWSA-N 1 2 290.432 4.804 20 0 CJADLO C[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc(Cl)s1 ZINC000423205786 330176987 /nfs/dbraw/zinc/17/69/87/330176987.db2.gz BMWZXLMGLJEVSX-SECBINFHSA-N 1 2 278.808 4.543 20 0 CJADLO C[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc(Cl)s1 ZINC000423205787 330176981 /nfs/dbraw/zinc/17/69/81/330176981.db2.gz BMWZXLMGLJEVSX-VIFPVBQESA-N 1 2 278.808 4.543 20 0 CJADLO CSc1ccc([C@@H](C)Nc2ccc3c(c2)CC[NH2+]3)cc1 ZINC000423208136 330177362 /nfs/dbraw/zinc/17/73/62/330177362.db2.gz DCWVISXJSORUIA-GFCCVEGCSA-N 1 2 284.428 4.550 20 0 CJADLO CSc1ccc([C@H](C)Nc2ccc3c(c2)CC[NH2+]3)cc1 ZINC000423208137 330177445 /nfs/dbraw/zinc/17/74/45/330177445.db2.gz DCWVISXJSORUIA-LBPRGKRZSA-N 1 2 284.428 4.550 20 0 CJADLO CC[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1cc(C)ccc1OC ZINC000423208704 330177757 /nfs/dbraw/zinc/17/77/57/330177757.db2.gz DLLJUDHHNNSNGB-KRWDZBQOSA-N 1 2 296.414 4.535 20 0 CJADLO CC[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1cc(C)ccc1OC ZINC000423208712 330177720 /nfs/dbraw/zinc/17/77/20/330177720.db2.gz DLLJUDHHNNSNGB-QGZVFWFLSA-N 1 2 296.414 4.535 20 0 CJADLO C[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc(F)c(Cl)c1 ZINC000423212605 330178080 /nfs/dbraw/zinc/17/80/80/330178080.db2.gz IOUNLXQQYZFGKT-JTQLQIEISA-N 1 2 290.769 4.620 20 0 CJADLO C[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc(F)c(Cl)c1 ZINC000423212606 330178054 /nfs/dbraw/zinc/17/80/54/330178054.db2.gz IOUNLXQQYZFGKT-SNVBAGLBSA-N 1 2 290.769 4.620 20 0 CJADLO Cc1ccc([C@H](Nc2ccc3c(c2)CC[NH2+]3)C2CCC2)o1 ZINC000423214198 330178448 /nfs/dbraw/zinc/17/84/48/330178448.db2.gz KXJXEEBCZKBOTA-GOSISDBHSA-N 1 2 282.387 4.509 20 0 CJADLO Cc1ccc([C@@H](Nc2ccc3c(c2)CC[NH2+]3)C2CCC2)o1 ZINC000423214199 330178380 /nfs/dbraw/zinc/17/83/80/330178380.db2.gz KXJXEEBCZKBOTA-SFHVURJKSA-N 1 2 282.387 4.509 20 0 CJADLO CC(C)Oc1ccc([C@H](C)Nc2ccc3c(c2)CC[NH2+]3)cc1 ZINC000423215209 330178332 /nfs/dbraw/zinc/17/83/32/330178332.db2.gz MLYYUYQFQLUAHE-AWEZNQCLSA-N 1 2 296.414 4.615 20 0 CJADLO CC(C)Oc1ccc([C@@H](C)Nc2ccc3c(c2)CC[NH2+]3)cc1 ZINC000423215210 330178235 /nfs/dbraw/zinc/17/82/35/330178235.db2.gz MLYYUYQFQLUAHE-CQSZACIVSA-N 1 2 296.414 4.615 20 0 CJADLO CCC[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccsc1 ZINC000423215582 330178676 /nfs/dbraw/zinc/17/86/76/330178676.db2.gz NDWNQQHJBDGSQW-INIZCTEOSA-N 1 2 272.417 4.669 20 0 CJADLO CCC[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccsc1 ZINC000423215584 330178743 /nfs/dbraw/zinc/17/87/43/330178743.db2.gz NDWNQQHJBDGSQW-MRXNPFEDSA-N 1 2 272.417 4.669 20 0 CJADLO C[C@@H]1CC[C@@H](Nc2ccc3c(c2)CC[NH2+]3)c2sccc21 ZINC000423216328 330178765 /nfs/dbraw/zinc/17/87/65/330178765.db2.gz OKDGMWNSOQMDTP-BDJLRTHQSA-N 1 2 284.428 4.767 20 0 CJADLO C[C@@H]1CC[C@H](Nc2ccc3c(c2)CC[NH2+]3)c2sccc21 ZINC000423216409 330178565 /nfs/dbraw/zinc/17/85/65/330178565.db2.gz OKDGMWNSOQMDTP-BZNIZROVSA-N 1 2 284.428 4.767 20 0 CJADLO C[C@H]1CC[C@@H](Nc2ccc3c(c2)CC[NH2+]3)c2sccc21 ZINC000423216411 330178569 /nfs/dbraw/zinc/17/85/69/330178569.db2.gz OKDGMWNSOQMDTP-MEDUHNTESA-N 1 2 284.428 4.767 20 0 CJADLO C[C@H]1CC[C@H](Nc2ccc3c(c2)CC[NH2+]3)c2sccc21 ZINC000423216413 330178545 /nfs/dbraw/zinc/17/85/45/330178545.db2.gz OKDGMWNSOQMDTP-ZBEGNZNMSA-N 1 2 284.428 4.767 20 0 CJADLO CSc1ccccc1[C@@H](C)Nc1ccc2c(c1)CC[NH2+]2 ZINC000423216547 330178682 /nfs/dbraw/zinc/17/86/82/330178682.db2.gz OSVZSXIAAVLUEN-GFCCVEGCSA-N 1 2 284.428 4.550 20 0 CJADLO CSc1ccccc1[C@H](C)Nc1ccc2c(c1)CC[NH2+]2 ZINC000423216548 330178720 /nfs/dbraw/zinc/17/87/20/330178720.db2.gz OSVZSXIAAVLUEN-LBPRGKRZSA-N 1 2 284.428 4.550 20 0 CJADLO C[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc(F)cc1Cl ZINC000423219213 330179130 /nfs/dbraw/zinc/17/91/30/330179130.db2.gz SXLXOBNRNDWLKU-JTQLQIEISA-N 1 2 290.769 4.620 20 0 CJADLO C[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc(F)cc1Cl ZINC000423219215 330179091 /nfs/dbraw/zinc/17/90/91/330179091.db2.gz SXLXOBNRNDWLKU-SNVBAGLBSA-N 1 2 290.769 4.620 20 0 CJADLO Cc1ccc([C@H](Nc2ccc3c(c2)CC[NH2+]3)C2CC2)cc1 ZINC000423220503 330179350 /nfs/dbraw/zinc/17/93/50/330179350.db2.gz VJKCSSOXJIYCJU-IBGZPJMESA-N 1 2 278.399 4.526 20 0 CJADLO Cc1ccc([C@@H](Nc2ccc3c(c2)CC[NH2+]3)C2CC2)cc1 ZINC000423220504 330179374 /nfs/dbraw/zinc/17/93/74/330179374.db2.gz VJKCSSOXJIYCJU-LJQANCHMSA-N 1 2 278.399 4.526 20 0 CJADLO Cc1cc([C@@H](C)Nc2ccc3c(c2)CC[NH2+]3)c(C)s1 ZINC000423220842 330179354 /nfs/dbraw/zinc/17/93/54/330179354.db2.gz VZKGRMBDROOPRI-LLVKDONJSA-N 1 2 272.417 4.506 20 0 CJADLO Cc1cc([C@H](C)Nc2ccc3c(c2)CC[NH2+]3)c(C)s1 ZINC000423220843 330179488 /nfs/dbraw/zinc/17/94/88/330179488.db2.gz VZKGRMBDROOPRI-NSHDSACASA-N 1 2 272.417 4.506 20 0 CJADLO C[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1csc(Cl)c1 ZINC000423221178 330179510 /nfs/dbraw/zinc/17/95/10/330179510.db2.gz WRKXGWPYFUEBRY-SECBINFHSA-N 1 2 278.808 4.543 20 0 CJADLO C[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1csc(Cl)c1 ZINC000423221179 330179403 /nfs/dbraw/zinc/17/94/03/330179403.db2.gz WRKXGWPYFUEBRY-VIFPVBQESA-N 1 2 278.808 4.543 20 0 CJADLO C[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1cccc(C2CC2)c1 ZINC000423221430 330179275 /nfs/dbraw/zinc/17/92/75/330179275.db2.gz WTZPGYFZRCDVCS-CYBMUJFWSA-N 1 2 278.399 4.705 20 0 CJADLO C[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1cccc(C2CC2)c1 ZINC000423221435 330179268 /nfs/dbraw/zinc/17/92/68/330179268.db2.gz WTZPGYFZRCDVCS-ZDUSSCGKSA-N 1 2 278.399 4.705 20 0 CJADLO CC[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc(Cl)s1 ZINC000423221935 330179568 /nfs/dbraw/zinc/17/95/68/330179568.db2.gz YSSUQGICNSUFON-GFCCVEGCSA-N 1 2 292.835 4.933 20 0 CJADLO CC[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc(Cl)s1 ZINC000423221936 330179718 /nfs/dbraw/zinc/17/97/18/330179718.db2.gz YSSUQGICNSUFON-LBPRGKRZSA-N 1 2 292.835 4.933 20 0 CJADLO CC(C)Sc1ccccc1NCc1c[nH+]cn1C(C)C ZINC000424154612 330301989 /nfs/dbraw/zinc/30/19/89/330301989.db2.gz MREIDSCKAILISU-UHFFFAOYSA-N 1 2 289.448 4.577 20 0 CJADLO CC(C)n1c[nH+]cc1CNc1cccc(C(F)F)c1Cl ZINC000424173879 330313668 /nfs/dbraw/zinc/31/36/68/330313668.db2.gz MLDGCHDNPWRVPB-UHFFFAOYSA-N 1 2 299.752 4.667 20 0 CJADLO Cc1cc2ccccc2c(NCc2c[nH+]cn2C(C)C)c1 ZINC000424184585 330320199 /nfs/dbraw/zinc/32/01/99/330320199.db2.gz YALXBEZXLJTAGD-UHFFFAOYSA-N 1 2 279.387 4.538 20 0 CJADLO CC(C)([NH2+]Cc1c(F)cccc1Cl)c1ccccc1F ZINC000429258609 330541097 /nfs/dbraw/zinc/54/10/97/330541097.db2.gz VKYWQGGHHNZRQV-UHFFFAOYSA-N 1 2 295.760 4.643 20 0 CJADLO Clc1ccc(-c2ccc(NCc3ccco3)[nH+]c2)s1 ZINC000432734021 330604713 /nfs/dbraw/zinc/60/47/13/330604713.db2.gz NEQNZSCFYCBRFS-UHFFFAOYSA-N 1 2 290.775 4.669 20 0 CJADLO Cc1cccc2[nH+]c3c(c(C)c12)C[C@H](C(F)(F)F)CC3 ZINC000435934473 330665979 /nfs/dbraw/zinc/66/59/79/330665979.db2.gz HMYNTUAYZBPHMB-LLVKDONJSA-N 1 2 279.305 4.519 20 0 CJADLO CCc1nc([C@@H](C)n2c[nH+]c3cc(C)c(C)cc32)sc1C ZINC000440533274 330750240 /nfs/dbraw/zinc/75/02/40/330750240.db2.gz HSAISRSPDKQDSG-GFCCVEGCSA-N 1 2 299.443 4.590 20 0 CJADLO CCc1c[nH+]ccc1[C@@H](C)[C@H](C)c1ccc(F)c(F)c1O ZINC000443096389 330794731 /nfs/dbraw/zinc/79/47/31/330794731.db2.gz UGANUXRKNRMORV-QWRGUYRKSA-N 1 2 291.341 4.535 20 0 CJADLO Cc1ccc(NC(=O)Nc2cccc3ccsc32)c(C)[nH+]1 ZINC000443903447 330807489 /nfs/dbraw/zinc/80/74/89/330807489.db2.gz DMODCKAZSIIVDX-UHFFFAOYSA-N 1 2 297.383 4.557 20 0 CJADLO CC[C@@H](CC(=O)Nc1ccc(C)[nH+]c1C)c1ccc(C)cc1 ZINC000446433383 330848800 /nfs/dbraw/zinc/84/88/00/330848800.db2.gz AOZIYYDAZMVMKD-INIZCTEOSA-N 1 2 296.414 4.529 20 0 CJADLO Clc1cccc(Cl)c1C1([NH2+]Cc2ccco2)CCC1 ZINC000447101049 330861466 /nfs/dbraw/zinc/86/14/66/330861466.db2.gz WPLRUXVWLXKCNO-UHFFFAOYSA-N 1 2 296.197 4.755 20 0 CJADLO C[C@H](c1cccs1)[N@@H+](C)Cc1nc(C(C)(C)C)cs1 ZINC000447370400 260000745 /nfs/dbraw/zinc/00/07/45/260000745.db2.gz AOUSNCWPPJDWNP-LLVKDONJSA-N 1 2 294.489 4.695 20 0 CJADLO C[C@H](c1cccs1)[N@H+](C)Cc1nc(C(C)(C)C)cs1 ZINC000447370400 260000744 /nfs/dbraw/zinc/00/07/44/260000744.db2.gz AOUSNCWPPJDWNP-LLVKDONJSA-N 1 2 294.489 4.695 20 0 CJADLO C[C@@H](c1cccs1)[N@@H+](C)Cc1nc(C(C)(C)C)cs1 ZINC000447370403 260000750 /nfs/dbraw/zinc/00/07/50/260000750.db2.gz AOUSNCWPPJDWNP-NSHDSACASA-N 1 2 294.489 4.695 20 0 CJADLO C[C@@H](c1cccs1)[N@H+](C)Cc1nc(C(C)(C)C)cs1 ZINC000447370403 260000749 /nfs/dbraw/zinc/00/07/49/260000749.db2.gz AOUSNCWPPJDWNP-NSHDSACASA-N 1 2 294.489 4.695 20 0 CJADLO Cc1cccn2cc(CNc3ccc(C4CCC4)cc3)[nH+]c12 ZINC000447409758 330866611 /nfs/dbraw/zinc/86/66/11/330866611.db2.gz XHFQCBSDVUTIBL-UHFFFAOYSA-N 1 2 291.398 4.522 20 0 CJADLO Cc1ccc(CCCNc2ccccc2C(C)(F)F)c[nH+]1 ZINC000449465406 330927842 /nfs/dbraw/zinc/92/78/42/330927842.db2.gz CVFJKGFDKDBPIU-UHFFFAOYSA-N 1 2 290.357 4.546 20 0 CJADLO CC(=O)c1cccc(C[N@H+]2CC(C)(C)[C@@H]2c2cccs2)c1 ZINC000451045066 331013317 /nfs/dbraw/zinc/01/33/17/331013317.db2.gz ZZFWGUPWYXOBQJ-KRWDZBQOSA-N 1 2 299.439 4.534 20 0 CJADLO CC(=O)c1cccc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccs2)c1 ZINC000451045066 331013316 /nfs/dbraw/zinc/01/33/16/331013316.db2.gz ZZFWGUPWYXOBQJ-KRWDZBQOSA-N 1 2 299.439 4.534 20 0 CJADLO CC(=O)c1cccc(C[N@H+]2CC(C)(C)[C@H]2c2cccs2)c1 ZINC000451045071 331013285 /nfs/dbraw/zinc/01/32/85/331013285.db2.gz ZZFWGUPWYXOBQJ-QGZVFWFLSA-N 1 2 299.439 4.534 20 0 CJADLO CC(=O)c1cccc(C[N@@H+]2CC(C)(C)[C@H]2c2cccs2)c1 ZINC000451045071 331013284 /nfs/dbraw/zinc/01/32/84/331013284.db2.gz ZZFWGUPWYXOBQJ-QGZVFWFLSA-N 1 2 299.439 4.534 20 0 CJADLO C[C@@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1cccc(C2CC2)c1 ZINC000451113321 331016113 /nfs/dbraw/zinc/01/61/13/331016113.db2.gz KNNFNPIRVYTQFW-CYBMUJFWSA-N 1 2 298.430 4.700 20 0 CJADLO C[C@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1cccc(C2CC2)c1 ZINC000451113322 331015986 /nfs/dbraw/zinc/01/59/86/331015986.db2.gz KNNFNPIRVYTQFW-ZDUSSCGKSA-N 1 2 298.430 4.700 20 0 CJADLO Cc1cccc([C@H](C)[NH2+][C@@H](C)c2ncc(C(C)(C)C)o2)c1 ZINC000452089380 331053718 /nfs/dbraw/zinc/05/37/18/331053718.db2.gz PXJFAUGYPYUWAJ-KBPBESRZSA-N 1 2 286.419 4.692 20 0 CJADLO Cc1cccc([C@@H](C)[NH2+][C@@H](C)c2ncc(C(C)(C)C)o2)c1 ZINC000452089383 331053708 /nfs/dbraw/zinc/05/37/08/331053708.db2.gz PXJFAUGYPYUWAJ-KGLIPLIRSA-N 1 2 286.419 4.692 20 0 CJADLO Cc1cccc([C@H](C)[NH2+][C@H](C)c2ncc(C(C)(C)C)o2)c1 ZINC000452089385 331053680 /nfs/dbraw/zinc/05/36/80/331053680.db2.gz PXJFAUGYPYUWAJ-UONOGXRCSA-N 1 2 286.419 4.692 20 0 CJADLO Cc1cccc([C@@H](C)[NH2+][C@H](C)c2ncc(C(C)(C)C)o2)c1 ZINC000452089387 331053643 /nfs/dbraw/zinc/05/36/43/331053643.db2.gz PXJFAUGYPYUWAJ-ZIAGYGMSSA-N 1 2 286.419 4.692 20 0 CJADLO CO[C@@H](C)c1cccc(NCc2ccc(C(C)C)[nH+]c2C)c1 ZINC000453078488 331087050 /nfs/dbraw/zinc/08/70/50/331087050.db2.gz IJYXOVMTTJDWEK-HNNXBMFYSA-N 1 2 298.430 4.833 20 0 CJADLO CO[C@H](C)c1cccc(NCc2ccc(C(C)C)[nH+]c2C)c1 ZINC000453078489 331087010 /nfs/dbraw/zinc/08/70/10/331087010.db2.gz IJYXOVMTTJDWEK-OAHLLOKOSA-N 1 2 298.430 4.833 20 0 CJADLO CC(=O)c1ccc(NCc2ccc(C(C)C)[nH+]c2C)cc1C ZINC000453099398 331089050 /nfs/dbraw/zinc/08/90/50/331089050.db2.gz KWIWGCMNARLODF-UHFFFAOYSA-N 1 2 296.414 4.637 20 0 CJADLO CCC(=O)c1cccc(NCc2ccc(C(C)C)[nH+]c2C)c1 ZINC000453111297 331090149 /nfs/dbraw/zinc/09/01/49/331090149.db2.gz RFLAKIFVTUIGMU-UHFFFAOYSA-N 1 2 296.414 4.718 20 0 CJADLO Cc1cc2ccccc2c(NCc2[nH+]ccn2C(C)C)c1 ZINC000453154821 331094859 /nfs/dbraw/zinc/09/48/59/331094859.db2.gz SQKJLHLGTNZXHI-UHFFFAOYSA-N 1 2 279.387 4.538 20 0 CJADLO CCn1cc[nH+]c1[C@@H](C)Nc1cccc(C(F)F)c1Cl ZINC000453195939 331100109 /nfs/dbraw/zinc/10/01/09/331100109.db2.gz QIKBUHXNIFMJKB-SECBINFHSA-N 1 2 299.752 4.667 20 0 CJADLO CCn1cc[nH+]c1[C@H](C)Nc1cccc(C(F)F)c1Cl ZINC000453195945 331100087 /nfs/dbraw/zinc/10/00/87/331100087.db2.gz QIKBUHXNIFMJKB-VIFPVBQESA-N 1 2 299.752 4.667 20 0 CJADLO CCC(C)(C)c1ccc(N[C@H]2C[C@H](C)n3cc[nH+]c32)cc1 ZINC000453211244 331101858 /nfs/dbraw/zinc/10/18/58/331101858.db2.gz GQLVXKGNZWQQPE-BBRMVZONSA-N 1 2 283.419 4.689 20 0 CJADLO CCC(C)(C)c1ccc(N[C@H]2C[C@@H](C)n3cc[nH+]c32)cc1 ZINC000453211245 331101895 /nfs/dbraw/zinc/10/18/95/331101895.db2.gz GQLVXKGNZWQQPE-CJNGLKHVSA-N 1 2 283.419 4.689 20 0 CJADLO CCC(C)(C)c1ccc(N[C@@H]2C[C@@H](C)n3cc[nH+]c32)cc1 ZINC000453211246 331101890 /nfs/dbraw/zinc/10/18/90/331101890.db2.gz GQLVXKGNZWQQPE-CZUORRHYSA-N 1 2 283.419 4.689 20 0 CJADLO CCC(C)(C)c1ccc(N[C@@H]2C[C@H](C)n3cc[nH+]c32)cc1 ZINC000453211247 331101920 /nfs/dbraw/zinc/10/19/20/331101920.db2.gz GQLVXKGNZWQQPE-XJKSGUPXSA-N 1 2 283.419 4.689 20 0 CJADLO Cc1c[nH]c(-c2ccccc2NC(=O)CCCCC(C)C)[nH+]1 ZINC000457668577 331230617 /nfs/dbraw/zinc/23/06/17/331230617.db2.gz NHWDZKCETZUQAN-UHFFFAOYSA-N 1 2 299.418 4.540 20 0 CJADLO Cc1[nH+]c2ccccc2n1CCCCCSC(C)C ZINC000461241564 331312072 /nfs/dbraw/zinc/31/20/72/331312072.db2.gz FAOBJPDJXVCLMX-UHFFFAOYSA-N 1 2 276.449 4.657 20 0 CJADLO Cc1[nH+]c2ccccc2n1CCCCCSCCCF ZINC000461245281 331312091 /nfs/dbraw/zinc/31/20/91/331312091.db2.gz LSCZBYFZLUOBTJ-UHFFFAOYSA-N 1 2 294.439 4.608 20 0 CJADLO CC(C)n1cc[nH+]c1CSC[C@@H]1C[C@H]1c1ccccc1 ZINC000461250543 331312185 /nfs/dbraw/zinc/31/21/85/331312185.db2.gz VWBMPRVHYSOTEC-HOTGVXAUSA-N 1 2 286.444 4.501 20 0 CJADLO Cc1cccc2[nH+]c(CNc3cccc(C4CCC4)c3)cn21 ZINC000461727379 331314203 /nfs/dbraw/zinc/31/42/03/331314203.db2.gz OIYYZJYOJHTADI-UHFFFAOYSA-N 1 2 291.398 4.522 20 0 CJADLO Cc1cccn2cc(CNc3cccc(C4CCC4)c3)[nH+]c12 ZINC000461743043 331314401 /nfs/dbraw/zinc/31/44/01/331314401.db2.gz PVGVWEXIQYWFII-UHFFFAOYSA-N 1 2 291.398 4.522 20 0 CJADLO Cc1ccc2[nH+]c(CNc3cccc(C4CCC4)c3)cn2c1 ZINC000461747819 331314463 /nfs/dbraw/zinc/31/44/63/331314463.db2.gz IQERGJXXQYQCRH-UHFFFAOYSA-N 1 2 291.398 4.522 20 0 CJADLO CCCN(c1cc[nH+]c(C)n1)[C@H](C)c1cc2ccccc2o1 ZINC000462375697 331320902 /nfs/dbraw/zinc/32/09/02/331320902.db2.gz NFXPDWVEEAOWDT-CYBMUJFWSA-N 1 2 295.386 4.509 20 0 CJADLO CCCN(c1cc[nH+]c(C)n1)[C@@H](C)c1cc2ccccc2o1 ZINC000462375701 331320887 /nfs/dbraw/zinc/32/08/87/331320887.db2.gz NFXPDWVEEAOWDT-ZDUSSCGKSA-N 1 2 295.386 4.509 20 0 CJADLO CCn1cc[nH+]c1CNc1c(C)cc(Cl)c2ccccc21 ZINC000462559513 331323456 /nfs/dbraw/zinc/32/34/56/331323456.db2.gz ZOLXBYPFQODIPY-UHFFFAOYSA-N 1 2 299.805 4.630 20 0 CJADLO Cc1nc(N[C@@H](CC(C)(C)C)c2ccc(F)cc2)cc[nH+]1 ZINC000462782469 331328736 /nfs/dbraw/zinc/32/87/36/331328736.db2.gz CYYBBKFOFFFKAD-HNNXBMFYSA-N 1 2 287.382 4.514 20 0 CJADLO Cc1nc(N[C@H](CC(C)(C)C)c2ccc(F)cc2)cc[nH+]1 ZINC000462782470 331328699 /nfs/dbraw/zinc/32/86/99/331328699.db2.gz CYYBBKFOFFFKAD-OAHLLOKOSA-N 1 2 287.382 4.514 20 0 CJADLO Cc1ccn2c(CNc3cccc(C4CCC4)c3)c[nH+]c2c1 ZINC000462855628 331332810 /nfs/dbraw/zinc/33/28/10/331332810.db2.gz OHBLRZYQPQEFBH-UHFFFAOYSA-N 1 2 291.398 4.522 20 0 CJADLO Cc1cccc2[nH+]cc(CNc3cccc(C4CCC4)c3)n21 ZINC000462857438 331332961 /nfs/dbraw/zinc/33/29/61/331332961.db2.gz HSQAVPVXSNEJKI-UHFFFAOYSA-N 1 2 291.398 4.522 20 0 CJADLO Cc1cccc([C@@H]2CCCN2c2cc[nH+]c(C(C)C)n2)c1C ZINC000462859939 331332863 /nfs/dbraw/zinc/33/28/63/331332863.db2.gz NFGIMTJXNNXTTD-KRWDZBQOSA-N 1 2 295.430 4.558 20 0 CJADLO Cc1cccc([C@H]2CCCN2c2cc[nH+]c(C(C)C)n2)c1C ZINC000462859940 331332979 /nfs/dbraw/zinc/33/29/79/331332979.db2.gz NFGIMTJXNNXTTD-QGZVFWFLSA-N 1 2 295.430 4.558 20 0 CJADLO Cc1cccn2c(CNc3cccc(C4CCC4)c3)c[nH+]c12 ZINC000462869734 331333251 /nfs/dbraw/zinc/33/32/51/331333251.db2.gz HRZIGPZNIHKPQR-UHFFFAOYSA-N 1 2 291.398 4.522 20 0 CJADLO Cc1ccc2[nH+]cc(CNc3cccc(C4CCC4)c3)n2c1 ZINC000462879474 331333834 /nfs/dbraw/zinc/33/38/34/331333834.db2.gz YBSLRIDAEZEXFZ-UHFFFAOYSA-N 1 2 291.398 4.522 20 0 CJADLO CC[C@@H](C)[C@@H](Nc1cc(C)[nH+]cn1)c1ccc(Cl)cc1 ZINC000462890525 331334120 /nfs/dbraw/zinc/33/41/20/331334120.db2.gz NZEQLOUIXPXZBW-BDJLRTHQSA-N 1 2 289.810 4.638 20 0 CJADLO CC[C@@H](C)[C@H](Nc1cc(C)[nH+]cn1)c1ccc(Cl)cc1 ZINC000462890526 331334057 /nfs/dbraw/zinc/33/40/57/331334057.db2.gz NZEQLOUIXPXZBW-BZNIZROVSA-N 1 2 289.810 4.638 20 0 CJADLO CC[C@H](C)[C@@H](Nc1cc(C)[nH+]cn1)c1ccc(Cl)cc1 ZINC000462890528 331334076 /nfs/dbraw/zinc/33/40/76/331334076.db2.gz NZEQLOUIXPXZBW-MEDUHNTESA-N 1 2 289.810 4.638 20 0 CJADLO CC[C@H](C)[C@H](Nc1cc(C)[nH+]cn1)c1ccc(Cl)cc1 ZINC000462890530 331334020 /nfs/dbraw/zinc/33/40/20/331334020.db2.gz NZEQLOUIXPXZBW-ZBEGNZNMSA-N 1 2 289.810 4.638 20 0 CJADLO CC[C@@H](C)[C@@H](Nc1cc[nH+]c(C)n1)c1ccc(Cl)cc1 ZINC000462893330 331334168 /nfs/dbraw/zinc/33/41/68/331334168.db2.gz YYGHWTRHOMUNET-BDJLRTHQSA-N 1 2 289.810 4.638 20 0 CJADLO CC[C@@H](C)[C@H](Nc1cc[nH+]c(C)n1)c1ccc(Cl)cc1 ZINC000462893331 331334141 /nfs/dbraw/zinc/33/41/41/331334141.db2.gz YYGHWTRHOMUNET-BZNIZROVSA-N 1 2 289.810 4.638 20 0 CJADLO CC[C@H](C)[C@@H](Nc1cc[nH+]c(C)n1)c1ccc(Cl)cc1 ZINC000462893332 331334236 /nfs/dbraw/zinc/33/42/36/331334236.db2.gz YYGHWTRHOMUNET-MEDUHNTESA-N 1 2 289.810 4.638 20 0 CJADLO CC[C@H](C)[C@H](Nc1cc[nH+]c(C)n1)c1ccc(Cl)cc1 ZINC000462893333 331334138 /nfs/dbraw/zinc/33/41/38/331334138.db2.gz YYGHWTRHOMUNET-ZBEGNZNMSA-N 1 2 289.810 4.638 20 0 CJADLO Cc1nc(N[C@@H](CC(C)C)c2ccc(Cl)cc2)cc[nH+]1 ZINC000463011461 331337054 /nfs/dbraw/zinc/33/70/54/331337054.db2.gz NUGOIUBAAQPJCY-HNNXBMFYSA-N 1 2 289.810 4.638 20 0 CJADLO Cc1nc(N[C@H](CC(C)C)c2ccc(Cl)cc2)cc[nH+]1 ZINC000463011462 331337007 /nfs/dbraw/zinc/33/70/07/331337007.db2.gz NUGOIUBAAQPJCY-OAHLLOKOSA-N 1 2 289.810 4.638 20 0 CJADLO Cc1cc(N[C@@H](CC(C)C)c2ccc(Cl)cc2)nc[nH+]1 ZINC000463020314 331337224 /nfs/dbraw/zinc/33/72/24/331337224.db2.gz OBQWCLVFZIDLNE-HNNXBMFYSA-N 1 2 289.810 4.638 20 0 CJADLO Cc1cc(N[C@H](CC(C)C)c2ccc(Cl)cc2)nc[nH+]1 ZINC000463020315 331337246 /nfs/dbraw/zinc/33/72/46/331337246.db2.gz OBQWCLVFZIDLNE-OAHLLOKOSA-N 1 2 289.810 4.638 20 0 CJADLO CCc1c[nH+]ccc1[C@H](C)[C@H]1C[C@@H](OC(C)C)C1(C)C ZINC000463029723 331337708 /nfs/dbraw/zinc/33/77/08/331337708.db2.gz SPHHIIZUTSZAKJ-IAOVAPTHSA-N 1 2 275.436 4.587 20 0 CJADLO CCc1c[nH+]ccc1[C@H](C)[C@@H]1C[C@H](OC(C)C)C1(C)C ZINC000463029724 331337672 /nfs/dbraw/zinc/33/76/72/331337672.db2.gz SPHHIIZUTSZAKJ-JQFCIGGWSA-N 1 2 275.436 4.587 20 0 CJADLO CCc1c[nH+]ccc1[C@H](C)[C@@H]1C[C@@H](OC(C)C)C1(C)C ZINC000463029725 331337732 /nfs/dbraw/zinc/33/77/32/331337732.db2.gz SPHHIIZUTSZAKJ-RRQGHBQHSA-N 1 2 275.436 4.587 20 0 CJADLO CCc1c[nH+]ccc1[C@H](C)[C@H]1C[C@H](OC(C)C)C1(C)C ZINC000463029726 331337666 /nfs/dbraw/zinc/33/76/66/331337666.db2.gz SPHHIIZUTSZAKJ-XKQJLSEDSA-N 1 2 275.436 4.587 20 0 CJADLO CCn1cc[nH+]c1CSc1ccc(Cl)c(Cl)c1 ZINC000463189570 331341792 /nfs/dbraw/zinc/34/17/92/331341792.db2.gz BYBQYQCVRRTLQB-UHFFFAOYSA-N 1 2 287.215 4.502 20 0 CJADLO CCC(C)(C)CC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000465127765 331379263 /nfs/dbraw/zinc/37/92/63/331379263.db2.gz JAZGXJZXJJFIQX-UHFFFAOYSA-N 1 2 298.386 4.639 20 0 CJADLO CCC(C)(C)CC(=O)Nc1ccc2[nH]c(C3CCC3)[nH+]c2c1 ZINC000465171662 331380169 /nfs/dbraw/zinc/38/01/69/331380169.db2.gz FILHPSULCYQTAI-UHFFFAOYSA-N 1 2 299.418 4.595 20 0 CJADLO CCC(C)(C)CC(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000465179460 331380327 /nfs/dbraw/zinc/38/03/27/331380327.db2.gz QBGFVOTVFSUBPN-UHFFFAOYSA-N 1 2 298.386 4.639 20 0 CJADLO CC/C=C\CCSCc1[nH+]ccn1Cc1ccccc1 ZINC000467302884 331414435 /nfs/dbraw/zinc/41/44/35/331414435.db2.gz OEKUJJUBLXPSOV-ARJAWSKDSA-N 1 2 286.444 4.521 20 0 CJADLO CC/C=C/CCSCc1[nH+]ccn1Cc1ccccc1 ZINC000467302885 331414461 /nfs/dbraw/zinc/41/44/61/331414461.db2.gz OEKUJJUBLXPSOV-ONEGZZNKSA-N 1 2 286.444 4.521 20 0 CJADLO Cc1ccc[nH+]c1[C@@H]1CCC[C@H](Nc2ccc(F)cc2)C1 ZINC000467350028 331415779 /nfs/dbraw/zinc/41/57/79/331415779.db2.gz MFQPWKVHWAIDTE-PBHICJAKSA-N 1 2 284.378 4.667 20 0 CJADLO Cc1ccc[nH+]c1[C@@H]1CCC[C@@H](Nc2ccc(F)cc2)C1 ZINC000467350029 331415744 /nfs/dbraw/zinc/41/57/44/331415744.db2.gz MFQPWKVHWAIDTE-RHSMWYFYSA-N 1 2 284.378 4.667 20 0 CJADLO Cc1ccc[nH+]c1[C@H]1CCC[C@@H](Nc2ccc(F)cc2)C1 ZINC000467350030 331415741 /nfs/dbraw/zinc/41/57/41/331415741.db2.gz MFQPWKVHWAIDTE-WMLDXEAASA-N 1 2 284.378 4.667 20 0 CJADLO Cc1ccc[nH+]c1[C@H]1CCC[C@@H](Nc2ccccc2)C1 ZINC000467351552 331415736 /nfs/dbraw/zinc/41/57/36/331415736.db2.gz BRJCFOCNIXAKQM-DOTOQJQBSA-N 1 2 266.388 4.528 20 0 CJADLO Cc1ccc[nH+]c1[C@H]1CCC[C@H](Nc2ccccc2F)C1 ZINC000467353716 331415949 /nfs/dbraw/zinc/41/59/49/331415949.db2.gz KIAZCEGUIOBBFE-GJZGRUSLSA-N 1 2 284.378 4.667 20 0 CJADLO Cc1ccc[nH+]c1[C@@H]1CCC[C@@H](Nc2ccccc2F)C1 ZINC000467353717 331415913 /nfs/dbraw/zinc/41/59/13/331415913.db2.gz KIAZCEGUIOBBFE-HUUCEWRRSA-N 1 2 284.378 4.667 20 0 CJADLO Cc1cscc1N[C@@H]1CCC[C@@H](c2[nH+]cccc2C)C1 ZINC000467358408 331416174 /nfs/dbraw/zinc/41/61/74/331416174.db2.gz JYPRGWPDTPNISW-HUUCEWRRSA-N 1 2 286.444 4.898 20 0 CJADLO CCC(CC)CC(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000468923244 331442335 /nfs/dbraw/zinc/44/23/35/331442335.db2.gz KRNXJBWUEMXLFG-UHFFFAOYSA-N 1 2 298.386 4.639 20 0 CJADLO CCC(CC)CC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000468988742 331443746 /nfs/dbraw/zinc/44/37/46/331443746.db2.gz QAZHWDUSAWXRDE-UHFFFAOYSA-N 1 2 298.386 4.639 20 0 CJADLO Cc1ccc(CCCNc2csc3ccccc23)c[nH+]1 ZINC000474943127 331605840 /nfs/dbraw/zinc/60/58/40/331605840.db2.gz PHXUKCXOHXOHMD-UHFFFAOYSA-N 1 2 282.412 4.649 20 0 CJADLO Cc1cc2[nH+]cn([C@H](C)c3nc(C4CC4)cs3)c2cc1C ZINC000477837111 331691397 /nfs/dbraw/zinc/69/13/97/331691397.db2.gz HYEGUQFMCJQOHV-GFCCVEGCSA-N 1 2 297.427 4.596 20 0 CJADLO CCC[C@@](C)(CC)C(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C ZINC000477976737 331696099 /nfs/dbraw/zinc/69/60/99/331696099.db2.gz QDKKDWNCEAYUQC-GOSISDBHSA-N 1 2 299.418 4.540 20 0 CJADLO CCC[C@](C)(CC)C(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C ZINC000477976739 331696089 /nfs/dbraw/zinc/69/60/89/331696089.db2.gz QDKKDWNCEAYUQC-SFHVURJKSA-N 1 2 299.418 4.540 20 0 CJADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)CCCC(C)(C)C ZINC000477986627 331696077 /nfs/dbraw/zinc/69/60/77/331696077.db2.gz MTJXWDPCPJAIBU-UHFFFAOYSA-N 1 2 299.418 4.540 20 0 CJADLO Cc1ccc(CNc2ccc(C)c(C(F)(F)F)c2)c(C)[nH+]1 ZINC000478341587 331704353 /nfs/dbraw/zinc/70/43/53/331704353.db2.gz RRUMNUPGMMTXMZ-UHFFFAOYSA-N 1 2 294.320 4.638 20 0 CJADLO Cc1ccc(CNc2ccc(C(F)(F)F)c(C)c2)c(C)[nH+]1 ZINC000478357399 331704532 /nfs/dbraw/zinc/70/45/32/331704532.db2.gz GNJDTNFGRHACKS-UHFFFAOYSA-N 1 2 294.320 4.638 20 0 CJADLO Cc1ccc(CNc2ccccc2C(C)(C)C)c(C)[nH+]1 ZINC000478358903 331704556 /nfs/dbraw/zinc/70/45/56/331704556.db2.gz FLPNZKYWIOPXHT-UHFFFAOYSA-N 1 2 268.404 4.608 20 0 CJADLO Cc1ccc(CNc2ccccc2OC2CCCC2)c(C)[nH+]1 ZINC000478375398 331704965 /nfs/dbraw/zinc/70/49/65/331704965.db2.gz YUMCUTSVLAWOIV-UHFFFAOYSA-N 1 2 296.414 4.632 20 0 CJADLO Cc1ccc(CNc2ccc(Cl)cc2Cl)c(C)[nH+]1 ZINC000478392703 331705209 /nfs/dbraw/zinc/70/52/09/331705209.db2.gz OLLWYNKAQPPIGH-UHFFFAOYSA-N 1 2 281.186 4.617 20 0 CJADLO Cc1ccc(CNc2ccccc2-c2ccccc2)c(C)[nH+]1 ZINC000478394461 331705158 /nfs/dbraw/zinc/70/51/58/331705158.db2.gz GDVJWOMXNVDXDD-UHFFFAOYSA-N 1 2 288.394 4.978 20 0 CJADLO CCSCc1cc[nH+]c(NCc2ccsc2Cl)c1 ZINC000478569794 331708814 /nfs/dbraw/zinc/70/88/14/331708814.db2.gz AOVIFCGBVQWXIY-UHFFFAOYSA-N 1 2 298.864 4.662 20 0 CJADLO Cc1ccc(CS[C@H](C)c2ccccc2)c(C)[nH+]1 ZINC000478910041 331715820 /nfs/dbraw/zinc/71/58/20/331715820.db2.gz LJHNJRIFUXEHCR-CQSZACIVSA-N 1 2 257.402 4.693 20 0 CJADLO Cc1ccc(CSCCCCC(F)(F)F)c(C)[nH+]1 ZINC000478918565 331717170 /nfs/dbraw/zinc/71/71/70/331717170.db2.gz DKBURNXRKZBOOU-UHFFFAOYSA-N 1 2 277.355 4.664 20 0 CJADLO Cc1ccc(COc2c(Cl)cccc2Cl)c(C)[nH+]1 ZINC000479227261 331722328 /nfs/dbraw/zinc/72/23/28/331722328.db2.gz TZGQMEGCFHSOMB-UHFFFAOYSA-N 1 2 282.170 4.584 20 0 CJADLO Cc1ccc(CSc2cccc(Cl)c2)c(C)[nH+]1 ZINC000479232159 331722577 /nfs/dbraw/zinc/72/25/77/331722577.db2.gz NWEPAJNEVAUPHP-UHFFFAOYSA-N 1 2 263.793 4.644 20 0 CJADLO CCc1ccc([C@H](C)[NH2+][C@@H](C)c2c(F)cccc2F)o1 ZINC000480920775 331791564 /nfs/dbraw/zinc/79/15/64/331791564.db2.gz MYKGZIIRQPDNAN-QWRGUYRKSA-N 1 2 279.330 4.532 20 0 CJADLO CCc1ccc([C@@H](C)[NH2+]Cc2nc(C(C)C)c(C)s2)o1 ZINC000482898571 331851718 /nfs/dbraw/zinc/85/17/18/331851718.db2.gz IYUOIPJYIUSPKX-LLVKDONJSA-N 1 2 292.448 4.581 20 0 CJADLO CCc1ccc([C@H](C)[NH2+]Cc2nc(C(C)C)c(C)s2)o1 ZINC000482898574 331851586 /nfs/dbraw/zinc/85/15/86/331851586.db2.gz IYUOIPJYIUSPKX-NSHDSACASA-N 1 2 292.448 4.581 20 0 CJADLO Cc1cc[nH+]c(C)c1NC(=O)Nc1csc2ccccc12 ZINC000485478029 331915241 /nfs/dbraw/zinc/91/52/41/331915241.db2.gz GAKLCNKPTPFCOU-UHFFFAOYSA-N 1 2 297.383 4.557 20 0 CJADLO CCSCc1cc[nH+]c(NCc2cc(Cl)cs2)c1 ZINC000485984844 331928615 /nfs/dbraw/zinc/92/86/15/331928615.db2.gz UBIPIHHKKDXBMM-UHFFFAOYSA-N 1 2 298.864 4.662 20 0 CJADLO Cc1cc(OCCCCC(F)(F)F)c2ccccc2[nH+]1 ZINC000486206512 331933270 /nfs/dbraw/zinc/93/32/70/331933270.db2.gz QFJYRZFFTRRUQQ-UHFFFAOYSA-N 1 2 283.293 4.655 20 0 CJADLO Cc1cc(OCCCCOC(C)(C)C)c2ccccc2[nH+]1 ZINC000486229356 331933685 /nfs/dbraw/zinc/93/36/85/331933685.db2.gz KQELDUSAMFDJQL-UHFFFAOYSA-N 1 2 287.403 4.517 20 0 CJADLO CC(C)c1cnc(C[NH2+][C@H](C)c2ccccc2Cl)s1 ZINC000486685204 331941835 /nfs/dbraw/zinc/94/18/35/331941835.db2.gz PDVLCNLMHTXPMJ-LLVKDONJSA-N 1 2 294.851 4.771 20 0 CJADLO Cc1cccc2[nH+]cc(CNc3ccc(C4CCC4)cc3)n21 ZINC000487159933 331957573 /nfs/dbraw/zinc/95/75/73/331957573.db2.gz OBEJWELSLZDUQE-UHFFFAOYSA-N 1 2 291.398 4.522 20 0 CJADLO Cc1ccc(NC(=O)Nc2ccc(C3CCC3)cc2)c(C)[nH+]1 ZINC000488938783 332034424 /nfs/dbraw/zinc/03/44/24/332034424.db2.gz VLNDNSHMMNXGHK-UHFFFAOYSA-N 1 2 295.386 4.610 20 0 CJADLO CCC(C)(C)C(=O)Nc1ccc(Oc2cc[nH+]cc2)c(C)c1 ZINC000489370090 332049316 /nfs/dbraw/zinc/04/93/16/332049316.db2.gz IWUMIZJUDXKABX-UHFFFAOYSA-N 1 2 298.386 4.557 20 0 CJADLO CCC(CC)C(=O)Nc1ccc(Oc2cc[nH+]cc2)c(C)c1 ZINC000489665969 332063769 /nfs/dbraw/zinc/06/37/69/332063769.db2.gz JVSZEDKFAARMSF-UHFFFAOYSA-N 1 2 298.386 4.557 20 0 CJADLO FC(F)(F)[C@H]([NH2+]C1CCC(c2ccccc2)CC1)C1CC1 ZINC000489930008 332073155 /nfs/dbraw/zinc/07/31/55/332073155.db2.gz DFLOSHHMORRAGN-AVVWSFFYSA-N 1 2 297.364 4.643 20 0 CJADLO FC(F)(F)[C@@H]([NH2+]C1CCC(c2ccccc2)CC1)C1CC1 ZINC000489930010 332073141 /nfs/dbraw/zinc/07/31/41/332073141.db2.gz DFLOSHHMORRAGN-BCLQGDPASA-N 1 2 297.364 4.643 20 0 CJADLO Cc1ccc(CNc2cc(Cl)c(Cl)cc2F)c(C)[nH+]1 ZINC000490370875 332087754 /nfs/dbraw/zinc/08/77/54/332087754.db2.gz OSKSYQRRBCMLMT-UHFFFAOYSA-N 1 2 299.176 4.756 20 0 CJADLO Cc1ccc(F)cc1C[NH+](Cc1ccco1)Cc1ccco1 ZINC000491886986 332373669 /nfs/dbraw/zinc/37/36/69/332373669.db2.gz HWQMBFYEAFQRTG-UHFFFAOYSA-N 1 2 299.345 4.523 20 0 CJADLO Cc1sc(C[NH2+][C@H](C)c2ccccc2F)nc1C(C)C ZINC000495471401 332520025 /nfs/dbraw/zinc/52/00/25/332520025.db2.gz WWMPFUBVINQNJV-LLVKDONJSA-N 1 2 292.423 4.565 20 0 CJADLO Cc1sc(C[NH2+][C@@H](C)c2ccccc2F)nc1C(C)C ZINC000495471402 332520029 /nfs/dbraw/zinc/52/00/29/332520029.db2.gz WWMPFUBVINQNJV-NSHDSACASA-N 1 2 292.423 4.565 20 0 CJADLO Cc1ccc(SCc2[nH+]ccn2Cc2ccccc2)cc1 ZINC000497319222 262142799 /nfs/dbraw/zinc/14/27/99/262142799.db2.gz NTRKUUQBMGFQLL-UHFFFAOYSA-N 1 2 294.423 4.532 20 0 CJADLO C[N@@H+](Cc1ccoc1)Cc1sc2ccccc2c1Cl ZINC000497455298 262164163 /nfs/dbraw/zinc/16/41/63/262164163.db2.gz FXSIQIYVRMUTGU-UHFFFAOYSA-N 1 2 291.803 4.780 20 0 CJADLO C[N@H+](Cc1ccoc1)Cc1sc2ccccc2c1Cl ZINC000497455298 262164162 /nfs/dbraw/zinc/16/41/62/262164162.db2.gz FXSIQIYVRMUTGU-UHFFFAOYSA-N 1 2 291.803 4.780 20 0 CJADLO C[C@@H](c1ccc(F)c(Cl)c1)[N@H+]1CCc2sccc2C1 ZINC000497615371 262182158 /nfs/dbraw/zinc/18/21/58/262182158.db2.gz NBKZGYWGZPZSGH-JTQLQIEISA-N 1 2 295.810 4.660 20 0 CJADLO C[C@@H](c1ccc(F)c(Cl)c1)[N@@H+]1CCc2sccc2C1 ZINC000497615371 262182156 /nfs/dbraw/zinc/18/21/56/262182156.db2.gz NBKZGYWGZPZSGH-JTQLQIEISA-N 1 2 295.810 4.660 20 0 CJADLO Cc1ccc([C@@H](C)[NH2+][C@H](CCc2ccccc2)C(F)F)o1 ZINC000497808940 327878810 /nfs/dbraw/zinc/87/88/10/327878810.db2.gz KVIMKNFPOZBOPR-UKRRQHHQSA-N 1 2 293.357 4.505 20 0 CJADLO CC(C)c1nc(N(C)[C@H](C)c2cc3ccccc3o2)cc[nH+]1 ZINC000498830115 332573828 /nfs/dbraw/zinc/57/38/28/332573828.db2.gz FYLGBLKCIXDCSG-CYBMUJFWSA-N 1 2 295.386 4.544 20 0 CJADLO CCCN(c1cc(C)[nH+]cn1)[C@H](C)c1cc2ccccc2o1 ZINC000498863323 332574353 /nfs/dbraw/zinc/57/43/53/332574353.db2.gz YZOYVZUDXFUYGO-CQSZACIVSA-N 1 2 295.386 4.509 20 0 CJADLO CC(C)(C)C[C@H](Nc1cccc[nH+]1)c1ccc(F)cc1 ZINC000498868679 332574511 /nfs/dbraw/zinc/57/45/11/332574511.db2.gz STTQZPBDECHABH-HNNXBMFYSA-N 1 2 272.367 4.810 20 0 CJADLO CCC[C@@H]([NH2+]Cc1c(F)cccc1Cl)c1ccccn1 ZINC000500619630 332614501 /nfs/dbraw/zinc/61/45/01/332614501.db2.gz XASMKUCVWWBKHN-OAHLLOKOSA-N 1 2 292.785 4.505 20 0 CJADLO CCCC[C@H](C)C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000500866865 332620738 /nfs/dbraw/zinc/62/07/38/332620738.db2.gz NIGTYPSBTSIXGG-AWEZNQCLSA-N 1 2 298.386 4.639 20 0 CJADLO CCCC[C@H](C)C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000500875524 332620931 /nfs/dbraw/zinc/62/09/31/332620931.db2.gz LRLDMWTZKCOMHC-AWEZNQCLSA-N 1 2 298.386 4.639 20 0 CJADLO C[C@@H](Nc1ccc2ccccc2[nH+]1)c1cc2ccccc2o1 ZINC000501868710 332642070 /nfs/dbraw/zinc/64/20/70/332642070.db2.gz VQBFAONCWSXFCX-CYBMUJFWSA-N 1 2 288.350 4.576 20 0 CJADLO C[C@H](Nc1ccc2ccccc2[nH+]1)c1cc2ccccc2o1 ZINC000501868711 332642207 /nfs/dbraw/zinc/64/22/07/332642207.db2.gz VQBFAONCWSXFCX-ZDUSSCGKSA-N 1 2 288.350 4.576 20 0 CJADLO CCc1c[nH+]ccc1[C@@H](C)[C@@H](C)c1cnn(C2CCCC2)c1 ZINC000502465080 332661799 /nfs/dbraw/zinc/66/17/99/332661799.db2.gz UAURFRUNTUMFOC-CABCVRRESA-N 1 2 297.446 4.863 20 0 CJADLO CCc1c[nH+]ccc1[C@@H](C)[C@H](C)c1cnn(C2CCCC2)c1 ZINC000502465081 332661920 /nfs/dbraw/zinc/66/19/20/332661920.db2.gz UAURFRUNTUMFOC-GJZGRUSLSA-N 1 2 297.446 4.863 20 0 CJADLO CCc1c[nH+]ccc1[C@H](C)[C@@H](C)c1cnn(C2CCCC2)c1 ZINC000502465082 332661820 /nfs/dbraw/zinc/66/18/20/332661820.db2.gz UAURFRUNTUMFOC-HUUCEWRRSA-N 1 2 297.446 4.863 20 0 CJADLO CCc1c[nH+]ccc1[C@H](C)[C@H](C)c1cnn(C2CCCC2)c1 ZINC000502465083 332661816 /nfs/dbraw/zinc/66/18/16/332661816.db2.gz UAURFRUNTUMFOC-LSDHHAIUSA-N 1 2 297.446 4.863 20 0 CJADLO Cc1cc([C@@H](C)[NH2+][C@@H](c2ccco2)c2ccccc2)oc1C ZINC000502687430 332668856 /nfs/dbraw/zinc/66/88/56/332668856.db2.gz ZLPXJLMAXRQKFD-AUUYWEPGSA-N 1 2 295.382 4.930 20 0 CJADLO Cc1cc([C@H](C)[NH2+][C@@H](c2ccco2)c2ccccc2)oc1C ZINC000502687431 332669056 /nfs/dbraw/zinc/66/90/56/332669056.db2.gz ZLPXJLMAXRQKFD-IFXJQAMLSA-N 1 2 295.382 4.930 20 0 CJADLO Cc1cc([C@@H](C)[NH2+][C@H](c2ccco2)c2ccccc2)oc1C ZINC000502687432 332668939 /nfs/dbraw/zinc/66/89/39/332668939.db2.gz ZLPXJLMAXRQKFD-KUHUBIRLSA-N 1 2 295.382 4.930 20 0 CJADLO Cc1cc([C@H](C)[NH2+][C@H](c2ccco2)c2ccccc2)oc1C ZINC000502687433 332668933 /nfs/dbraw/zinc/66/89/33/332668933.db2.gz ZLPXJLMAXRQKFD-LIRRHRJNSA-N 1 2 295.382 4.930 20 0 CJADLO Cc1cc([C@@H](C)[NH2+][C@H](C)c2c(F)cccc2F)oc1C ZINC000502700103 332670010 /nfs/dbraw/zinc/67/00/10/332670010.db2.gz VCVPCFCICZQWHV-GHMZBOCLSA-N 1 2 279.330 4.586 20 0 CJADLO Cc1cc([C@@H](C)[NH2+]Cc2c(F)cccc2Cl)oc1C ZINC000502733608 332672006 /nfs/dbraw/zinc/67/20/06/332672006.db2.gz CFBJZDLMGMWMDY-SNVBAGLBSA-N 1 2 281.758 4.540 20 0 CJADLO C[C@H]([NH2+]C1(C(F)F)CC1)c1ccc(-c2ccccc2)s1 ZINC000503920946 332699260 /nfs/dbraw/zinc/69/92/60/332699260.db2.gz QCBYZGIGXHPRTE-NSHDSACASA-N 1 2 293.382 4.863 20 0 CJADLO FC(F)C1([NH2+][C@H]2CCCc3c4ccccc4sc32)CC1 ZINC000503920988 332699344 /nfs/dbraw/zinc/69/93/44/332699344.db2.gz QMRAFPUJGWMPBS-LBPRGKRZSA-N 1 2 293.382 4.666 20 0 CJADLO C[C@@H]([NH2+]C1(C(F)F)CC1)c1ccc(-c2cccs2)cc1 ZINC000503938585 332700196 /nfs/dbraw/zinc/70/01/96/332700196.db2.gz VDNFYLLBKVKJGP-LLVKDONJSA-N 1 2 293.382 4.863 20 0 CJADLO C[C@H]([NH2+]Cc1c(F)cccc1F)c1ccc(F)cc1Cl ZINC000505464718 332741491 /nfs/dbraw/zinc/74/14/91/332741491.db2.gz NMPXMDPTHVIRLQ-VIFPVBQESA-N 1 2 299.723 4.608 20 0 CJADLO Cc1cc(F)ccc1C[NH+](Cc1ccco1)Cc1ccco1 ZINC000506086716 332761747 /nfs/dbraw/zinc/76/17/47/332761747.db2.gz OMOQMVKEUSKOIH-UHFFFAOYSA-N 1 2 299.345 4.523 20 0 CJADLO Cc1ccc(F)c(C[NH+](Cc2ccco2)Cc2ccco2)c1 ZINC000506101174 332762464 /nfs/dbraw/zinc/76/24/64/332762464.db2.gz NZTJAWOHTFVQQB-UHFFFAOYSA-N 1 2 299.345 4.523 20 0 CJADLO Cc1cc(C)c(NC(=O)C[C@H]2CCCCC2(C)C)c(C)[nH+]1 ZINC000507727003 332820869 /nfs/dbraw/zinc/82/08/69/332820869.db2.gz PKIKSKCSWNCALQ-OAHLLOKOSA-N 1 2 288.435 4.552 20 0 CJADLO CC[C@H](C)CCC(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000509504161 332872008 /nfs/dbraw/zinc/87/20/08/332872008.db2.gz ALMDUJBNUJTLFP-AWEZNQCLSA-N 1 2 298.386 4.639 20 0 CJADLO Cc1ccc(SCCc2[nH+]c3ccccc3n2C)cc1C ZINC000509953290 332886715 /nfs/dbraw/zinc/88/67/15/332886715.db2.gz RQMZEMGKXHMWKP-UHFFFAOYSA-N 1 2 296.439 4.525 20 0 CJADLO FC(F)c1ccc(C[NH2+]C2(C(F)F)CCCCC2)cc1 ZINC000510097533 332892129 /nfs/dbraw/zinc/89/21/29/332892129.db2.gz GPYNVVYUMTUXRY-UHFFFAOYSA-N 1 2 289.316 4.682 20 0 CJADLO Cc1cc(C)c(NC(=O)[C@@H](C)CC2CCCCC2)c(C)[nH+]1 ZINC000510796078 332917355 /nfs/dbraw/zinc/91/73/55/332917355.db2.gz SQAMBRXESLTNAL-ZDUSSCGKSA-N 1 2 288.435 4.552 20 0 CJADLO CC[C@@H](C)CCC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000512683763 332980180 /nfs/dbraw/zinc/98/01/80/332980180.db2.gz XCUAPEGPOVIDIV-CQSZACIVSA-N 1 2 298.386 4.639 20 0 CJADLO CC(C)c1ccc(CNc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000512985127 332996940 /nfs/dbraw/zinc/99/69/40/332996940.db2.gz MWTFHHZPURPNTR-UHFFFAOYSA-N 1 2 291.398 4.608 20 0 CJADLO CCCC[N@@H+](Cc1nccs1)Cc1ccccc1Cl ZINC000513295466 333012836 /nfs/dbraw/zinc/01/28/36/333012836.db2.gz HEEDIGQDPSKQCM-UHFFFAOYSA-N 1 2 294.851 4.599 20 0 CJADLO CCCC[N@H+](Cc1nccs1)Cc1ccccc1Cl ZINC000513295466 333012835 /nfs/dbraw/zinc/01/28/35/333012835.db2.gz HEEDIGQDPSKQCM-UHFFFAOYSA-N 1 2 294.851 4.599 20 0 CJADLO Fc1cccc(F)c1C[NH2+]Cc1ccc(-c2ccccc2)o1 ZINC000513627101 333027457 /nfs/dbraw/zinc/02/74/57/333027457.db2.gz KSKMTDDMWQNMMH-UHFFFAOYSA-N 1 2 299.320 4.515 20 0 CJADLO CCCCc1nc(C[N@@H+](CC)Cc2cccs2)cs1 ZINC000514541529 265178293 /nfs/dbraw/zinc/17/82/93/265178293.db2.gz JWKDHVFHYYCOPD-UHFFFAOYSA-N 1 2 294.489 4.569 20 0 CJADLO CCCCc1nc(C[N@H+](CC)Cc2cccs2)cs1 ZINC000514541529 265178291 /nfs/dbraw/zinc/17/82/91/265178291.db2.gz JWKDHVFHYYCOPD-UHFFFAOYSA-N 1 2 294.489 4.569 20 0 CJADLO Cc1ccc(C[NH2+]Cc2nc(C(C)C)cs2)c(Cl)c1 ZINC000514608418 266019375 /nfs/dbraw/zinc/01/93/75/266019375.db2.gz BAAGAQZANKEZFP-UHFFFAOYSA-N 1 2 294.851 4.518 20 0 CJADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+][C@@H](C)c1cscn1 ZINC000516849577 333084150 /nfs/dbraw/zinc/08/41/50/333084150.db2.gz JOKGUXQXEMVCGS-NWDGAFQWSA-N 1 2 286.400 4.610 20 0 CJADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+][C@H](C)c1cscn1 ZINC000516849578 333084306 /nfs/dbraw/zinc/08/43/06/333084306.db2.gz JOKGUXQXEMVCGS-VXGBXAGGSA-N 1 2 286.400 4.610 20 0 CJADLO c1ccc(SC2(CNc3cccc[nH+]3)CCCC2)cc1 ZINC000518321500 260376050 /nfs/dbraw/zinc/37/60/50/260376050.db2.gz QHZRJQBPOYMLBP-UHFFFAOYSA-N 1 2 284.428 4.599 20 0 CJADLO CCCCc1nc(Cn2c[nH+]c3cc(C)c(C)cc32)cs1 ZINC000518716264 260508162 /nfs/dbraw/zinc/50/81/62/260508162.db2.gz JWOWWLGVKPYGGJ-UHFFFAOYSA-N 1 2 299.443 4.501 20 0 CJADLO Cc1cc(C)c(NC(=O)CCCC2CCCCC2)c(C)[nH+]1 ZINC000518977624 265271096 /nfs/dbraw/zinc/27/10/96/265271096.db2.gz JYOKSYKFYAKKRN-UHFFFAOYSA-N 1 2 288.435 4.696 20 0 CJADLO FC(F)c1ccc(C[NH2+]CC(F)(F)c2ccccc2)cc1 ZINC000520462811 265829763 /nfs/dbraw/zinc/82/97/63/265829763.db2.gz ANJBMZDPLYRRDJ-UHFFFAOYSA-N 1 2 297.295 4.506 20 0 CJADLO C[C@@H]([NH2+]Cc1ccc(Cl)o1)c1nc(C(C)(C)C)cs1 ZINC000520973855 333109072 /nfs/dbraw/zinc/10/90/72/333109072.db2.gz HOPDAOQVIQHONU-SECBINFHSA-N 1 2 298.839 4.538 20 0 CJADLO C[C@H]([NH2+]Cc1ccc(Cl)o1)c1nc(C(C)(C)C)cs1 ZINC000520973856 333109058 /nfs/dbraw/zinc/10/90/58/333109058.db2.gz HOPDAOQVIQHONU-VIFPVBQESA-N 1 2 298.839 4.538 20 0 CJADLO CC(C)CCc1nc(C[N@@H+](C)[C@H](C)c2ccco2)cs1 ZINC000521198640 333114806 /nfs/dbraw/zinc/11/48/06/333114806.db2.gz SCZXQTCTPFXYDO-CYBMUJFWSA-N 1 2 292.448 4.518 20 0 CJADLO CC(C)CCc1nc(C[N@H+](C)[C@H](C)c2ccco2)cs1 ZINC000521198640 333114804 /nfs/dbraw/zinc/11/48/04/333114804.db2.gz SCZXQTCTPFXYDO-CYBMUJFWSA-N 1 2 292.448 4.518 20 0 CJADLO CC(C)CCc1nc(C[N@@H+](C)[C@@H](C)c2ccco2)cs1 ZINC000521198641 333114685 /nfs/dbraw/zinc/11/46/85/333114685.db2.gz SCZXQTCTPFXYDO-ZDUSSCGKSA-N 1 2 292.448 4.518 20 0 CJADLO CC(C)CCc1nc(C[N@H+](C)[C@@H](C)c2ccco2)cs1 ZINC000521198641 333114684 /nfs/dbraw/zinc/11/46/84/333114684.db2.gz SCZXQTCTPFXYDO-ZDUSSCGKSA-N 1 2 292.448 4.518 20 0 CJADLO C[C@H](c1ccco1)[N@@H+](C)Cc1ccc(Cl)cc1Cl ZINC000521814188 333189131 /nfs/dbraw/zinc/18/91/31/333189131.db2.gz MVLVWWUGORWNQX-SNVBAGLBSA-N 1 2 284.186 4.779 20 0 CJADLO C[C@H](c1ccco1)[N@H+](C)Cc1ccc(Cl)cc1Cl ZINC000521814188 333189130 /nfs/dbraw/zinc/18/91/30/333189130.db2.gz MVLVWWUGORWNQX-SNVBAGLBSA-N 1 2 284.186 4.779 20 0 CJADLO CC[N@@H+](Cc1csc(C(C)C)n1)Cc1ccc(C)cc1 ZINC000521860713 333193993 /nfs/dbraw/zinc/19/39/93/333193993.db2.gz HLCRCMUAHJGUFU-UHFFFAOYSA-N 1 2 288.460 4.597 20 0 CJADLO CC[N@H+](Cc1csc(C(C)C)n1)Cc1ccc(C)cc1 ZINC000521860713 333193992 /nfs/dbraw/zinc/19/39/92/333193992.db2.gz HLCRCMUAHJGUFU-UHFFFAOYSA-N 1 2 288.460 4.597 20 0 CJADLO CCCC[C@H](CC)CC(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000522669191 333296052 /nfs/dbraw/zinc/29/60/52/333296052.db2.gz IPRRXFPHGQIMQI-AWEZNQCLSA-N 1 2 299.418 4.622 20 0 CJADLO CCCC[C@@H](CC)CC(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000522669192 333295982 /nfs/dbraw/zinc/29/59/82/333295982.db2.gz IPRRXFPHGQIMQI-CQSZACIVSA-N 1 2 299.418 4.622 20 0 CJADLO CC(C)(C)CCC(=O)Nc1ccc2[nH]c(C3CCC3)[nH+]c2c1 ZINC000523122047 333310027 /nfs/dbraw/zinc/31/00/27/333310027.db2.gz DPZDUBAKYZEZCU-UHFFFAOYSA-N 1 2 299.418 4.595 20 0 CJADLO Cc1cc(C[N@H+](C)[C@H](C)c2c(F)cccc2F)c(C)s1 ZINC000524648054 333369929 /nfs/dbraw/zinc/36/99/29/333369929.db2.gz YIBWSRJHLGLNTD-LLVKDONJSA-N 1 2 295.398 4.836 20 0 CJADLO Cc1cc(C[N@@H+](C)[C@H](C)c2c(F)cccc2F)c(C)s1 ZINC000524648054 333369927 /nfs/dbraw/zinc/36/99/27/333369927.db2.gz YIBWSRJHLGLNTD-LLVKDONJSA-N 1 2 295.398 4.836 20 0 CJADLO Cc1cc(C[N@H+](C)[C@@H](C)c2c(F)cccc2F)c(C)s1 ZINC000524648055 333370018 /nfs/dbraw/zinc/37/00/18/333370018.db2.gz YIBWSRJHLGLNTD-NSHDSACASA-N 1 2 295.398 4.836 20 0 CJADLO Cc1cc(C[N@@H+](C)[C@@H](C)c2c(F)cccc2F)c(C)s1 ZINC000524648055 333370017 /nfs/dbraw/zinc/37/00/17/333370017.db2.gz YIBWSRJHLGLNTD-NSHDSACASA-N 1 2 295.398 4.836 20 0 CJADLO CCC[N@@H+](CCC(F)(F)F)Cc1c(F)cccc1Cl ZINC000524907046 333393321 /nfs/dbraw/zinc/39/33/21/333393321.db2.gz PSZODEKFYDHLFH-UHFFFAOYSA-N 1 2 297.723 4.644 20 0 CJADLO CCC[N@H+](CCC(F)(F)F)Cc1c(F)cccc1Cl ZINC000524907046 333393320 /nfs/dbraw/zinc/39/33/20/333393320.db2.gz PSZODEKFYDHLFH-UHFFFAOYSA-N 1 2 297.723 4.644 20 0 CJADLO Cc1ccc2nc(/C=C/c3c[nH+]c4c(C)cccn34)ccc2c1 ZINC000525045829 333397041 /nfs/dbraw/zinc/39/70/41/333397041.db2.gz GNMATKQGOCPOBX-CMDGGOBGSA-N 1 2 299.377 4.670 20 0 CJADLO Cc1ccc2nc(/C=C\c3c[nH+]c4c(C)cccn34)ccc2c1 ZINC000525045830 333396980 /nfs/dbraw/zinc/39/69/80/333396980.db2.gz GNMATKQGOCPOBX-HJWRWDBZSA-N 1 2 299.377 4.670 20 0 CJADLO C[C@H]([NH2+]Cc1cc(F)ccc1Cl)c1c(F)cccc1F ZINC000527076157 328824330 /nfs/dbraw/zinc/82/43/30/328824330.db2.gz JWGIUZQIQDOPKP-VIFPVBQESA-N 1 2 299.723 4.608 20 0 CJADLO Cc1ccc2cc([C@@H](C)[NH2+][C@@H](C)c3ncccc3F)oc2c1 ZINC000528035663 330302449 /nfs/dbraw/zinc/30/24/49/330302449.db2.gz JNXXFUXXHQOLFF-OLZOCXBDSA-N 1 2 298.361 4.687 20 0 CJADLO Cc1ccc2cc([C@H](C)[NH2+][C@@H](C)c3ncccc3F)oc2c1 ZINC000528035664 330302461 /nfs/dbraw/zinc/30/24/61/330302461.db2.gz JNXXFUXXHQOLFF-STQMWFEESA-N 1 2 298.361 4.687 20 0 CJADLO FC(F)(F)c1cc[nH+]c(N2CCC[C@H]2c2ccsc2)c1 ZINC000530934081 326897596 /nfs/dbraw/zinc/89/75/96/326897596.db2.gz VRYYQHDAXWRYEE-LBPRGKRZSA-N 1 2 298.333 4.503 20 0 CJADLO Clc1cccc(Cl)c1C1([NH2+]Cc2ccsc2)CC1 ZINC000531595577 328016174 /nfs/dbraw/zinc/01/61/74/328016174.db2.gz ZFYNRVLNUXRFQR-UHFFFAOYSA-N 1 2 298.238 4.834 20 0 CJADLO CC(C)CCc1ccccc1NCc1[nH+]ccn1C(C)C ZINC000531823204 328040054 /nfs/dbraw/zinc/04/00/54/328040054.db2.gz IHBGMNDIIHFIMU-UHFFFAOYSA-N 1 2 285.435 4.665 20 0 CJADLO Cc1ccoc1C[NH2+]C1(c2c(Cl)cccc2Cl)CC1 ZINC000531848758 328045915 /nfs/dbraw/zinc/04/59/15/328045915.db2.gz ODGVLBVQLUGDDJ-UHFFFAOYSA-N 1 2 296.197 4.674 20 0 CJADLO Cc1ccc(C[N@H+](C)[C@H](C)c2c(F)cccc2F)s1 ZINC000532952804 330322923 /nfs/dbraw/zinc/32/29/23/330322923.db2.gz MWDHWKWSGPUUQA-LLVKDONJSA-N 1 2 281.371 4.528 20 0 CJADLO Cc1ccc(C[N@@H+](C)[C@H](C)c2c(F)cccc2F)s1 ZINC000532952804 330322922 /nfs/dbraw/zinc/32/29/22/330322922.db2.gz MWDHWKWSGPUUQA-LLVKDONJSA-N 1 2 281.371 4.528 20 0 CJADLO Cc1ccc(C[N@H+](C)[C@@H](C)c2c(F)cccc2F)s1 ZINC000532952805 330322920 /nfs/dbraw/zinc/32/29/20/330322920.db2.gz MWDHWKWSGPUUQA-NSHDSACASA-N 1 2 281.371 4.528 20 0 CJADLO Cc1ccc(C[N@@H+](C)[C@@H](C)c2c(F)cccc2F)s1 ZINC000532952805 330322919 /nfs/dbraw/zinc/32/29/19/330322919.db2.gz MWDHWKWSGPUUQA-NSHDSACASA-N 1 2 281.371 4.528 20 0 CJADLO C[C@H](SCCn1cc[nH+]c1)c1ccc2ccccc2c1 ZINC000534132273 328035276 /nfs/dbraw/zinc/03/52/76/328035276.db2.gz CXNPBABYRCEXMK-AWEZNQCLSA-N 1 2 282.412 4.531 20 0 CJADLO C[C@@H](SCCn1cc[nH+]c1)c1ccc2ccccc2c1 ZINC000534132274 328035177 /nfs/dbraw/zinc/03/51/77/328035177.db2.gz CXNPBABYRCEXMK-CQSZACIVSA-N 1 2 282.412 4.531 20 0 CJADLO Cc1cc(C)c(NC(=O)C[C@@H]2CCCC(C)(C)C2)c(C)[nH+]1 ZINC000534469982 328300321 /nfs/dbraw/zinc/30/03/21/328300321.db2.gz ONHPJDQGLNXTML-HNNXBMFYSA-N 1 2 288.435 4.552 20 0 CJADLO Cc1cc(C)c(NC(=O)C[C@H]2CCCC(C)(C)C2)c(C)[nH+]1 ZINC000534469986 328300326 /nfs/dbraw/zinc/30/03/26/328300326.db2.gz ONHPJDQGLNXTML-OAHLLOKOSA-N 1 2 288.435 4.552 20 0 CJADLO Cc1c2ccccc2oc1[C@H](C)[NH2+][C@H](C)c1cscn1 ZINC000535777622 328630998 /nfs/dbraw/zinc/63/09/98/328630998.db2.gz JOKGUXQXEMVCGS-NEPJUHHUSA-N 1 2 286.400 4.610 20 0 CJADLO Cc1c2ccccc2oc1[C@H](C)[NH2+][C@@H](C)c1cscn1 ZINC000535777624 328631002 /nfs/dbraw/zinc/63/10/02/328631002.db2.gz JOKGUXQXEMVCGS-RYUDHWBXSA-N 1 2 286.400 4.610 20 0 CJADLO C[C@H](Nc1ccc2c(c1)C(C)(C)CC2(C)C)c1[nH+]ccn1C ZINC000536303083 326935593 /nfs/dbraw/zinc/93/55/93/326935593.db2.gz XKSMMUFWXXXPEO-ZDUSSCGKSA-N 1 2 297.446 4.552 20 0 CJADLO CC(C)[C@H]([NH2+][C@H](C)c1cscn1)c1ccccc1Cl ZINC000536624565 328669811 /nfs/dbraw/zinc/66/98/11/328669811.db2.gz QSIHFFSJTMZFES-ABAIWWIYSA-N 1 2 294.851 4.844 20 0 CJADLO CC(C)[C@H]([NH2+][C@@H](C)c1cscn1)c1ccccc1Cl ZINC000536624567 328669867 /nfs/dbraw/zinc/66/98/67/328669867.db2.gz QSIHFFSJTMZFES-NHYWBVRUSA-N 1 2 294.851 4.844 20 0 CJADLO CC(C)[C@@H]([NH2+][C@@H](C)c1cscn1)c1ccccc1Cl ZINC000536624568 328669714 /nfs/dbraw/zinc/66/97/14/328669714.db2.gz QSIHFFSJTMZFES-XHDPSFHLSA-N 1 2 294.851 4.844 20 0 CJADLO CCSc1ccc([C@@H](C)Nc2ccc(C)[nH+]c2)cc1 ZINC000537450041 330437393 /nfs/dbraw/zinc/43/73/93/330437393.db2.gz QDEKRVBUTWCAMF-CYBMUJFWSA-N 1 2 272.417 4.675 20 0 CJADLO CCSc1ccc([C@H](C)Nc2ccc(C)[nH+]c2)cc1 ZINC000537450042 330437482 /nfs/dbraw/zinc/43/74/82/330437482.db2.gz QDEKRVBUTWCAMF-ZDUSSCGKSA-N 1 2 272.417 4.675 20 0 CJADLO CC[C@H](Nc1ccc(C)[nH+]c1)c1ccccc1OC(F)F ZINC000537450751 330437411 /nfs/dbraw/zinc/43/74/11/330437411.db2.gz QRJZXUUGECJAGH-AWEZNQCLSA-N 1 2 292.329 4.555 20 0 CJADLO Cc1ccc(N[C@@H](CC(C)C)c2cccs2)c[nH+]1 ZINC000537450753 330437363 /nfs/dbraw/zinc/43/73/63/330437363.db2.gz QSBDEYVPQKKOIG-AWEZNQCLSA-N 1 2 260.406 4.651 20 0 CJADLO C[C@H]([NH2+]C1(c2c(Cl)cccc2Cl)CC1)c1ccco1 ZINC000537488918 518183155 /nfs/dbraw/zinc/18/31/55/518183155.db2.gz GAKJURABOOJMHW-JTQLQIEISA-N 1 2 296.197 4.926 20 0 CJADLO C[C@@H]([NH2+]C1(c2c(Cl)cccc2Cl)CC1)c1ccco1 ZINC000537488922 330438272 /nfs/dbraw/zinc/43/82/72/330438272.db2.gz GAKJURABOOJMHW-SNVBAGLBSA-N 1 2 296.197 4.926 20 0 CJADLO C[C@@H]([NH2+]Cc1c(F)cccc1Cl)c1cccc(F)c1F ZINC000538231873 333580533 /nfs/dbraw/zinc/58/05/33/333580533.db2.gz ILVWERRCTSUSLL-SECBINFHSA-N 1 2 299.723 4.608 20 0 CJADLO CCCCCc1ccc(N[C@@H](CC)c2[nH+]ccn2C)cc1 ZINC000539611059 333680978 /nfs/dbraw/zinc/68/09/78/333680978.db2.gz YQPAOTNNLHAMOI-KRWDZBQOSA-N 1 2 285.435 4.716 20 0 CJADLO COc1ccc([C@@H](C)Nc2ccc(C)[nH+]c2)c2ccccc12 ZINC000539650134 333683045 /nfs/dbraw/zinc/68/30/45/333683045.db2.gz CNWQMRIHMCXREN-CQSZACIVSA-N 1 2 292.382 4.725 20 0 CJADLO C[C@H]([NH2+]C1(c2c(Cl)cccc2Cl)CC1)c1ccoc1 ZINC000539689168 333685519 /nfs/dbraw/zinc/68/55/19/333685519.db2.gz BVELJHMWJZFSNT-JTQLQIEISA-N 1 2 296.197 4.926 20 0 CJADLO CCCC[C@@H](C)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000539691899 333685811 /nfs/dbraw/zinc/68/58/11/333685811.db2.gz NWBGAKPRAHMEDZ-OAHLLOKOSA-N 1 2 295.430 4.592 20 0 CJADLO CC[C@@H](Nc1ccc(CCC(C)C)cc1)c1[nH+]ccn1C ZINC000539732929 333687960 /nfs/dbraw/zinc/68/79/60/333687960.db2.gz HMNHOTUMSSYNCJ-QGZVFWFLSA-N 1 2 285.435 4.572 20 0 CJADLO CC[C@@H](Nc1ccc(-n2cc[nH+]c2)c(F)c1)c1ccccc1 ZINC000539735769 333688444 /nfs/dbraw/zinc/68/84/44/333688444.db2.gz VCWQWVCMJPKTFX-QGZVFWFLSA-N 1 2 295.361 4.575 20 0 CJADLO C[C@H](Nc1cccc([NH+]2CCCCCC2)c1)c1ccco1 ZINC000539737414 333688413 /nfs/dbraw/zinc/68/84/13/333688413.db2.gz QDAZZOXSQYXMSG-HNNXBMFYSA-N 1 2 284.403 4.833 20 0 CJADLO CCc1c[nH+]ccc1[C@H](C)[C@H](c1cccnc1)C(C)C ZINC000540317787 333725060 /nfs/dbraw/zinc/72/50/60/333725060.db2.gz GCZOYQAMXSWOIM-KBXCAEBGSA-N 1 2 268.404 4.582 20 0 CJADLO CCc1c[nH+]ccc1[C@@H](C)[C@H](c1cccnc1)C(C)C ZINC000540317790 327862087 /nfs/dbraw/zinc/86/20/87/327862087.db2.gz GCZOYQAMXSWOIM-RDTXWAMCSA-N 1 2 268.404 4.582 20 0 CJADLO CC[C@@H](Nc1ccc(C)[nH+]c1)c1ccc(OC(F)F)cc1 ZINC000540749131 333744958 /nfs/dbraw/zinc/74/49/58/333744958.db2.gz CYYJTYVRSRHSQT-OAHLLOKOSA-N 1 2 292.329 4.555 20 0 CJADLO Cc1ccc(N[C@H](C)[C@@H](C)c2nc3ccccc3s2)c[nH+]1 ZINC000540749607 333745038 /nfs/dbraw/zinc/74/50/38/333745038.db2.gz LHFSZYROOXHUII-CHWSQXEVSA-N 1 2 297.427 4.604 20 0 CJADLO Cc1ccc(N[C@H](C)[C@H](C)c2nc3ccccc3s2)c[nH+]1 ZINC000540749616 333744996 /nfs/dbraw/zinc/74/49/96/333744996.db2.gz LHFSZYROOXHUII-QWHCGFSZSA-N 1 2 297.427 4.604 20 0 CJADLO Cc1ccc(N[C@@H](C)[C@H](C)c2nc3ccccc3s2)c[nH+]1 ZINC000540749618 333745035 /nfs/dbraw/zinc/74/50/35/333745035.db2.gz LHFSZYROOXHUII-STQMWFEESA-N 1 2 297.427 4.604 20 0 CJADLO CC(C)c1ccc([C@H](C)SCCn2cc[nH+]c2)cc1 ZINC000541291235 333770599 /nfs/dbraw/zinc/77/05/99/333770599.db2.gz PCWHOLLOSOGTHY-AWEZNQCLSA-N 1 2 274.433 4.501 20 0 CJADLO CC(C)c1ccc([C@@H](C)SCCn2cc[nH+]c2)cc1 ZINC000541291252 333770661 /nfs/dbraw/zinc/77/06/61/333770661.db2.gz PCWHOLLOSOGTHY-CQSZACIVSA-N 1 2 274.433 4.501 20 0 CJADLO CC[C@H]([NH2+]Cc1ncc(C2CC2)o1)c1ccc(Cl)s1 ZINC000542559098 333832021 /nfs/dbraw/zinc/83/20/21/333832021.db2.gz JIWWHRSAEQDYSJ-JTQLQIEISA-N 1 2 296.823 4.508 20 0 CJADLO CC[C@@H]([NH2+]Cc1ncc(C2CC2)o1)c1ccc(Cl)s1 ZINC000542559099 333831967 /nfs/dbraw/zinc/83/19/67/333831967.db2.gz JIWWHRSAEQDYSJ-SNVBAGLBSA-N 1 2 296.823 4.508 20 0 CJADLO CC[C@@H](Nc1cccc(C(F)F)c1Cl)c1[nH+]ccn1C ZINC000543597530 333883080 /nfs/dbraw/zinc/88/30/80/333883080.db2.gz OFZXBEJFSZJYFG-SNVBAGLBSA-N 1 2 299.752 4.574 20 0 CJADLO CC[C@@H]([NH2+][C@H](C)c1ccon1)c1ccc(Cl)cc1Cl ZINC000543627418 333885794 /nfs/dbraw/zinc/88/57/94/333885794.db2.gz WBNNJOYKZMFLSG-NOZJJQNGSA-N 1 2 299.201 4.783 20 0 CJADLO CC[C@H]([NH2+][C@H](C)c1ccon1)c1ccc(Cl)cc1Cl ZINC000543627424 333885779 /nfs/dbraw/zinc/88/57/79/333885779.db2.gz WBNNJOYKZMFLSG-RNCFNFMXSA-N 1 2 299.201 4.783 20 0 CJADLO CC[C@H]([NH2+][C@@H](C)c1ccon1)c1ccc(Cl)cc1Cl ZINC000543627427 333885840 /nfs/dbraw/zinc/88/58/40/333885840.db2.gz WBNNJOYKZMFLSG-ZANVPECISA-N 1 2 299.201 4.783 20 0 CJADLO CCc1c2cc(C)ccc2oc1[C@@H](C)[NH2+][C@H](C)c1ccon1 ZINC000544604893 333939668 /nfs/dbraw/zinc/93/96/68/333939668.db2.gz OJBGRSBSHJFDRH-CHWSQXEVSA-N 1 2 298.386 4.703 20 0 CJADLO CCC[N@@H+](Cc1ncc(Cl)s1)Cc1ccc(C)cc1 ZINC000546035479 334013822 /nfs/dbraw/zinc/01/38/22/334013822.db2.gz XEKFIYHQOZYKDE-UHFFFAOYSA-N 1 2 294.851 4.517 20 0 CJADLO CCC[N@H+](Cc1ncc(Cl)s1)Cc1ccc(C)cc1 ZINC000546035479 334013821 /nfs/dbraw/zinc/01/38/21/334013821.db2.gz XEKFIYHQOZYKDE-UHFFFAOYSA-N 1 2 294.851 4.517 20 0 CJADLO Cc1ccc(CNc2cccc(Cl)c2Cl)c(C)[nH+]1 ZINC000547490261 334093422 /nfs/dbraw/zinc/09/34/22/334093422.db2.gz WFVOMRNCJLTIHQ-UHFFFAOYSA-N 1 2 281.186 4.617 20 0 CJADLO CC(C)CCc1ccc(N[C@@H](c2[nH+]ccn2C)C2CC2)cc1 ZINC000548586016 334162985 /nfs/dbraw/zinc/16/29/85/334162985.db2.gz DVSYUBOXQGDUDD-GOSISDBHSA-N 1 2 297.446 4.572 20 0 CJADLO CC(C)CCc1ccc(N[C@H](c2[nH+]ccn2C)C2CC2)cc1 ZINC000548586017 334163037 /nfs/dbraw/zinc/16/30/37/334163037.db2.gz DVSYUBOXQGDUDD-SFHVURJKSA-N 1 2 297.446 4.572 20 0 CJADLO C[C@@H](c1ccco1)[N@@H+](Cc1sccc1Cl)C1CC1 ZINC000549066151 334184292 /nfs/dbraw/zinc/18/42/92/334184292.db2.gz KUQYKDJGYWKRLO-JTQLQIEISA-N 1 2 281.808 4.720 20 0 CJADLO C[C@@H](c1ccco1)[N@H+](Cc1sccc1Cl)C1CC1 ZINC000549066151 334184290 /nfs/dbraw/zinc/18/42/90/334184290.db2.gz KUQYKDJGYWKRLO-JTQLQIEISA-N 1 2 281.808 4.720 20 0 CJADLO C[C@H](c1ccco1)[N@@H+](Cc1sccc1Cl)C1CC1 ZINC000549066152 334184283 /nfs/dbraw/zinc/18/42/83/334184283.db2.gz KUQYKDJGYWKRLO-SNVBAGLBSA-N 1 2 281.808 4.720 20 0 CJADLO C[C@H](c1ccco1)[N@H+](Cc1sccc1Cl)C1CC1 ZINC000549066152 334184282 /nfs/dbraw/zinc/18/42/82/334184282.db2.gz KUQYKDJGYWKRLO-SNVBAGLBSA-N 1 2 281.808 4.720 20 0 CJADLO Cc1[nH+]c(C(C)C)ccc1CSCc1ccco1 ZINC000549299276 334189714 /nfs/dbraw/zinc/18/97/14/334189714.db2.gz GIHMMLAQRZZWOY-UHFFFAOYSA-N 1 2 261.390 4.540 20 0 CJADLO Cc1[nH+]c(C(C)C)ccc1CSc1nccn1C(C)C ZINC000549345814 334190385 /nfs/dbraw/zinc/19/03/85/334190385.db2.gz VZGAVYPUWKQKJU-UHFFFAOYSA-N 1 2 289.448 4.583 20 0 CJADLO Cc1[nH+]c(C(C)C)ccc1CSc1cccs1 ZINC000549350061 334191079 /nfs/dbraw/zinc/19/10/79/334191079.db2.gz LUFNECIOSFDTHR-UHFFFAOYSA-N 1 2 263.431 4.867 20 0 CJADLO Cc1nc(C(C)C)ccc1C[NH2+]C1(C(F)F)CCCCC1 ZINC000549708941 334202296 /nfs/dbraw/zinc/20/22/96/334202296.db2.gz JHMALIBLJCCZHU-UHFFFAOYSA-N 1 2 296.405 4.571 20 0 CJADLO C[N@@H+](Cc1cccc(C(F)F)c1)Cc1c(F)cccc1F ZINC000549947288 334210073 /nfs/dbraw/zinc/21/00/73/334210073.db2.gz SYOBHLYWEIYYQF-UHFFFAOYSA-N 1 2 297.295 4.534 20 0 CJADLO C[N@H+](Cc1cccc(C(F)F)c1)Cc1c(F)cccc1F ZINC000549947288 334210071 /nfs/dbraw/zinc/21/00/71/334210071.db2.gz SYOBHLYWEIYYQF-UHFFFAOYSA-N 1 2 297.295 4.534 20 0 CJADLO CC(C)c1cnc(C[NH2+][C@@H](C)c2ccccc2Cl)s1 ZINC000550286691 334219041 /nfs/dbraw/zinc/21/90/41/334219041.db2.gz PDVLCNLMHTXPMJ-NSHDSACASA-N 1 2 294.851 4.771 20 0 CJADLO C[N@@H+](Cc1ccc(C(F)F)cc1)Cc1c(F)cccc1F ZINC000550331226 334220311 /nfs/dbraw/zinc/22/03/11/334220311.db2.gz RBELDTQMKFDREH-UHFFFAOYSA-N 1 2 297.295 4.534 20 0 CJADLO C[N@H+](Cc1ccc(C(F)F)cc1)Cc1c(F)cccc1F ZINC000550331226 334220308 /nfs/dbraw/zinc/22/03/08/334220308.db2.gz RBELDTQMKFDREH-UHFFFAOYSA-N 1 2 297.295 4.534 20 0 CJADLO C[C@@H](Nc1cc(-c2ccccc2)ccc1Cl)c1[nH]cc[nH+]1 ZINC000552055649 334282363 /nfs/dbraw/zinc/28/23/63/334282363.db2.gz XQUSOJMTFPKGAP-GFCCVEGCSA-N 1 2 297.789 4.903 20 0 CJADLO C[C@H](Nc1cc(-c2ccccc2)ccc1Cl)c1[nH]cc[nH+]1 ZINC000552055650 334282313 /nfs/dbraw/zinc/28/23/13/334282313.db2.gz XQUSOJMTFPKGAP-LBPRGKRZSA-N 1 2 297.789 4.903 20 0 CJADLO CCOc1cccc(N[C@H](c2[nH]cc[nH+]2)C2CCCCC2)c1 ZINC000552063237 334283871 /nfs/dbraw/zinc/28/38/71/334283871.db2.gz UOSGTMQSUNJVGD-KRWDZBQOSA-N 1 2 299.418 4.542 20 0 CJADLO CCOc1cccc(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)c1 ZINC000552063238 334283984 /nfs/dbraw/zinc/28/39/84/334283984.db2.gz UOSGTMQSUNJVGD-QGZVFWFLSA-N 1 2 299.418 4.542 20 0 CJADLO Clc1cccc(N[C@H](c2[nH]cc[nH+]2)C2CCCCC2)c1 ZINC000552275060 334311415 /nfs/dbraw/zinc/31/14/15/334311415.db2.gz JRVNJNJHNGVFHZ-HNNXBMFYSA-N 1 2 289.810 4.797 20 0 CJADLO Clc1cccc(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)c1 ZINC000552275061 334311335 /nfs/dbraw/zinc/31/13/35/334311335.db2.gz JRVNJNJHNGVFHZ-OAHLLOKOSA-N 1 2 289.810 4.797 20 0 CJADLO CC[C@@H](C)Sc1ccc(N[C@H](C)c2[nH]cc[nH+]2)c(C)c1 ZINC000552282032 334312812 /nfs/dbraw/zinc/31/28/12/334312812.db2.gz SQYKSDUMFRUAMK-CHWSQXEVSA-N 1 2 289.448 4.782 20 0 CJADLO CC[C@@H](C)Sc1ccc(N[C@@H](C)c2[nH]cc[nH+]2)c(C)c1 ZINC000552282033 334312702 /nfs/dbraw/zinc/31/27/02/334312702.db2.gz SQYKSDUMFRUAMK-OLZOCXBDSA-N 1 2 289.448 4.782 20 0 CJADLO CC[C@H](C)Sc1ccc(N[C@H](C)c2[nH]cc[nH+]2)c(C)c1 ZINC000552282034 334312713 /nfs/dbraw/zinc/31/27/13/334312713.db2.gz SQYKSDUMFRUAMK-QWHCGFSZSA-N 1 2 289.448 4.782 20 0 CJADLO CC[C@H](C)Sc1ccc(N[C@@H](C)c2[nH]cc[nH+]2)c(C)c1 ZINC000552282035 334312738 /nfs/dbraw/zinc/31/27/38/334312738.db2.gz SQYKSDUMFRUAMK-STQMWFEESA-N 1 2 289.448 4.782 20 0 CJADLO Clc1ccc(N[C@H](c2[nH]cc[nH+]2)C2CCCCC2)cc1 ZINC000552288314 334313604 /nfs/dbraw/zinc/31/36/04/334313604.db2.gz NNGYELHKFPXYTJ-HNNXBMFYSA-N 1 2 289.810 4.797 20 0 CJADLO Clc1ccc(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)cc1 ZINC000552288315 334313726 /nfs/dbraw/zinc/31/37/26/334313726.db2.gz NNGYELHKFPXYTJ-OAHLLOKOSA-N 1 2 289.810 4.797 20 0 CJADLO CCSc1ccc([C@@H](C)[NH2+][C@H](C)c2ncc(C)o2)cc1 ZINC000552351536 334319472 /nfs/dbraw/zinc/31/94/72/334319472.db2.gz XVYAYQNBVSHDKA-CHWSQXEVSA-N 1 2 290.432 4.507 20 0 CJADLO CCSc1ccc([C@@H](C)[NH2+][C@@H](C)c2ncc(C)o2)cc1 ZINC000552351537 334319576 /nfs/dbraw/zinc/31/95/76/334319576.db2.gz XVYAYQNBVSHDKA-OLZOCXBDSA-N 1 2 290.432 4.507 20 0 CJADLO CCSc1ccc([C@H](C)[NH2+][C@H](C)c2ncc(C)o2)cc1 ZINC000552351538 334319599 /nfs/dbraw/zinc/31/95/99/334319599.db2.gz XVYAYQNBVSHDKA-QWHCGFSZSA-N 1 2 290.432 4.507 20 0 CJADLO CCSc1ccc([C@H](C)[NH2+][C@@H](C)c2ncc(C)o2)cc1 ZINC000552351539 334319507 /nfs/dbraw/zinc/31/95/07/334319507.db2.gz XVYAYQNBVSHDKA-STQMWFEESA-N 1 2 290.432 4.507 20 0 CJADLO C[C@H](c1c(F)cccc1F)[N@@H+](C)C/C=C/c1ccccc1 ZINC000552606878 334339047 /nfs/dbraw/zinc/33/90/47/334339047.db2.gz UHKACVKFPBANSR-DNGMOHDESA-N 1 2 287.353 4.671 20 0 CJADLO C[C@H](c1c(F)cccc1F)[N@H+](C)C/C=C/c1ccccc1 ZINC000552606878 334339045 /nfs/dbraw/zinc/33/90/45/334339045.db2.gz UHKACVKFPBANSR-DNGMOHDESA-N 1 2 287.353 4.671 20 0 CJADLO C[C@H](c1c(F)cccc1F)[N@@H+](C)C/C=C\c1ccccc1 ZINC000552606879 334339036 /nfs/dbraw/zinc/33/90/36/334339036.db2.gz UHKACVKFPBANSR-JKEYDSJLSA-N 1 2 287.353 4.671 20 0 CJADLO C[C@H](c1c(F)cccc1F)[N@H+](C)C/C=C\c1ccccc1 ZINC000552606879 334339035 /nfs/dbraw/zinc/33/90/35/334339035.db2.gz UHKACVKFPBANSR-JKEYDSJLSA-N 1 2 287.353 4.671 20 0 CJADLO C[C@@H](c1c(F)cccc1F)[N@@H+](C)C/C=C/c1ccccc1 ZINC000552606880 334339062 /nfs/dbraw/zinc/33/90/62/334339062.db2.gz UHKACVKFPBANSR-RNVIBTMRSA-N 1 2 287.353 4.671 20 0 CJADLO C[C@@H](c1c(F)cccc1F)[N@H+](C)C/C=C/c1ccccc1 ZINC000552606880 334339061 /nfs/dbraw/zinc/33/90/61/334339061.db2.gz UHKACVKFPBANSR-RNVIBTMRSA-N 1 2 287.353 4.671 20 0 CJADLO C[C@@H](c1c(F)cccc1F)[N@@H+](C)C/C=C\c1ccccc1 ZINC000552606881 334339080 /nfs/dbraw/zinc/33/90/80/334339080.db2.gz UHKACVKFPBANSR-YHAOYDPOSA-N 1 2 287.353 4.671 20 0 CJADLO C[C@@H](c1c(F)cccc1F)[N@H+](C)C/C=C\c1ccccc1 ZINC000552606881 334339078 /nfs/dbraw/zinc/33/90/78/334339078.db2.gz UHKACVKFPBANSR-YHAOYDPOSA-N 1 2 287.353 4.671 20 0 CJADLO Cc1[nH]ncc1C[NH2+][C@@H](C)c1ccc(C2CCCCC2)cc1 ZINC000552911651 334350578 /nfs/dbraw/zinc/35/05/78/334350578.db2.gz JXJISWDPPVNRBT-AWEZNQCLSA-N 1 2 297.446 4.617 20 0 CJADLO Cc1[nH]ncc1C[NH2+][C@H](C)c1ccc(C2CCCCC2)cc1 ZINC000552911652 334350525 /nfs/dbraw/zinc/35/05/25/334350525.db2.gz JXJISWDPPVNRBT-CQSZACIVSA-N 1 2 297.446 4.617 20 0 CJADLO Cc1cc[nH+]c(NCc2ccc(C(F)F)cc2)c1Cl ZINC000553162267 334365946 /nfs/dbraw/zinc/36/59/46/334365946.db2.gz LHUQZESSCMKYJZ-UHFFFAOYSA-N 1 2 282.721 4.593 20 0 CJADLO Clc1cccc2c(NCc3ccsc3)cc[nH+]c12 ZINC000553272698 334373035 /nfs/dbraw/zinc/37/30/35/334373035.db2.gz JEDSXTVGTHGLGP-UHFFFAOYSA-N 1 2 274.776 4.562 20 0 CJADLO CC(F)(F)C[NH2+][C@H]1CCCSc2ccc(Cl)cc21 ZINC000556220538 334500883 /nfs/dbraw/zinc/50/08/83/334500883.db2.gz LFKFGFKEMLOYRN-NSHDSACASA-N 1 2 291.794 4.512 20 0 CJADLO C[C@@H](Nc1csc2ccccc12)c1cn2ccccc2[nH+]1 ZINC000556264710 334505180 /nfs/dbraw/zinc/50/51/80/334505180.db2.gz UYKPWSGSEACMTA-GFCCVEGCSA-N 1 2 293.395 4.722 20 0 CJADLO FC(F)(F)CCCNc1cc[nH+]c2c(Cl)cccc12 ZINC000557629510 327017209 /nfs/dbraw/zinc/01/72/09/327017209.db2.gz SWCWFVOSDZHWQH-UHFFFAOYSA-N 1 2 288.700 4.643 20 0 CJADLO COc1cc[nH+]cc1CSc1ccc2ccccc2c1 ZINC000557757963 327025408 /nfs/dbraw/zinc/02/54/08/327025408.db2.gz ORUTVVQNXAYHBS-UHFFFAOYSA-N 1 2 281.380 4.536 20 0 CJADLO C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1ccc(Cl)cn1 ZINC000558404265 327091473 /nfs/dbraw/zinc/09/14/73/327091473.db2.gz OXLXPCLMXGJZKP-LLVKDONJSA-N 1 2 295.213 4.581 20 0 CJADLO C[C@H](c1ccccc1Cl)[N@H+](C)Cc1ccc(Cl)cn1 ZINC000558404265 327091472 /nfs/dbraw/zinc/09/14/72/327091472.db2.gz OXLXPCLMXGJZKP-LLVKDONJSA-N 1 2 295.213 4.581 20 0 CJADLO C[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1ccc(Cl)cn1 ZINC000558404269 327091504 /nfs/dbraw/zinc/09/15/04/327091504.db2.gz OXLXPCLMXGJZKP-NSHDSACASA-N 1 2 295.213 4.581 20 0 CJADLO C[C@@H](c1ccccc1Cl)[N@H+](C)Cc1ccc(Cl)cn1 ZINC000558404269 327091503 /nfs/dbraw/zinc/09/15/03/327091503.db2.gz OXLXPCLMXGJZKP-NSHDSACASA-N 1 2 295.213 4.581 20 0 CJADLO CCC(=O)c1ccc(OCc2ccc(C(C)C)[nH+]c2C)cc1 ZINC000558808224 327121545 /nfs/dbraw/zinc/12/15/45/327121545.db2.gz MNOHQBOQJRQJFZ-UHFFFAOYSA-N 1 2 297.398 4.685 20 0 CJADLO Cc1[nH+]c(C(C)C)ccc1CSc1ccccc1O ZINC000558825547 327123388 /nfs/dbraw/zinc/12/33/88/327123388.db2.gz NRAHEQNHBGZWOY-UHFFFAOYSA-N 1 2 273.401 4.511 20 0 CJADLO CC(=O)c1ccc(OCc2ccc(C(C)C)[nH+]c2C)c(C)c1 ZINC000558826485 327123092 /nfs/dbraw/zinc/12/30/92/327123092.db2.gz YNJQFBVKCJRJIM-UHFFFAOYSA-N 1 2 297.398 4.603 20 0 CJADLO Cc1[nH+]c(C(C)C)ccc1CSc1ccc(O)cc1 ZINC000558831129 327123585 /nfs/dbraw/zinc/12/35/85/327123585.db2.gz BBCZPOKNKAMQKQ-UHFFFAOYSA-N 1 2 273.401 4.511 20 0 CJADLO COc1ccccc1SCc1ccc(C(C)C)[nH+]c1C ZINC000558832103 327124038 /nfs/dbraw/zinc/12/40/38/327124038.db2.gz YVTGQBKQSVCGGD-UHFFFAOYSA-N 1 2 287.428 4.814 20 0 CJADLO Cc1[nH+]c(C(C)C)ccc1CSc1cccc(O)c1 ZINC000558851738 327127137 /nfs/dbraw/zinc/12/71/37/327127137.db2.gz YQRVGFJZLFWIMY-UHFFFAOYSA-N 1 2 273.401 4.511 20 0 CJADLO C[C@@H]([NH2+]Cc1cccc(F)c1Cl)c1c(F)cccc1F ZINC000559147744 327143168 /nfs/dbraw/zinc/14/31/68/327143168.db2.gz CRDBFNQBQKQWQL-SECBINFHSA-N 1 2 299.723 4.608 20 0 CJADLO C[C@H]([NH2+]Cc1cccc(F)c1Cl)c1c(F)cccc1F ZINC000559147745 327143388 /nfs/dbraw/zinc/14/33/88/327143388.db2.gz CRDBFNQBQKQWQL-VIFPVBQESA-N 1 2 299.723 4.608 20 0 CJADLO Clc1ccc(C[NH2+]Cc2c(Cl)cccc2Cl)o1 ZINC000559872085 327266241 /nfs/dbraw/zinc/26/62/41/327266241.db2.gz YEJZFMJUXVBSJO-UHFFFAOYSA-N 1 2 290.577 4.530 20 0 CJADLO Cc1cc([C@H](C)[NH2+][C@@H](c2ccccc2Cl)C(C)C)no1 ZINC000559895397 327269250 /nfs/dbraw/zinc/26/92/50/327269250.db2.gz UZNBVHKNTMPOTK-BLLLJJGKSA-N 1 2 292.810 4.684 20 0 CJADLO Cc1cc([C@H](C)[NH2+][C@H](c2ccccc2Cl)C(C)C)no1 ZINC000559895402 327269299 /nfs/dbraw/zinc/26/92/99/327269299.db2.gz UZNBVHKNTMPOTK-LRDDRELGSA-N 1 2 292.810 4.684 20 0 CJADLO Cc1cc([C@@H](C)[NH2+][C@@H](c2ccccc2Cl)C(C)C)no1 ZINC000559895403 327269424 /nfs/dbraw/zinc/26/94/24/327269424.db2.gz UZNBVHKNTMPOTK-MLGOLLRUSA-N 1 2 292.810 4.684 20 0 CJADLO Cc1cc([C@@H](C)[NH2+][C@H](c2ccccc2Cl)C(C)C)no1 ZINC000559895404 327269374 /nfs/dbraw/zinc/26/93/74/327269374.db2.gz UZNBVHKNTMPOTK-WBMJQRKESA-N 1 2 292.810 4.684 20 0 CJADLO Cc1ccc(N[C@H](c2[nH]cc[nH+]2)C2CCCCC2)cc1F ZINC000560546328 327322782 /nfs/dbraw/zinc/32/27/82/327322782.db2.gz ZFGFXRDZUBLYGS-INIZCTEOSA-N 1 2 287.382 4.591 20 0 CJADLO Cc1ccc(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)cc1F ZINC000560546329 327322866 /nfs/dbraw/zinc/32/28/66/327322866.db2.gz ZFGFXRDZUBLYGS-MRXNPFEDSA-N 1 2 287.382 4.591 20 0 CJADLO Cc1ccc(F)c(N[C@H](c2[nH]cc[nH+]2)C2CCCCC2)c1 ZINC000560553660 327324123 /nfs/dbraw/zinc/32/41/23/327324123.db2.gz XNFPKUSDYMFWTN-INIZCTEOSA-N 1 2 287.382 4.591 20 0 CJADLO Cc1ccc(F)c(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)c1 ZINC000560553661 327324120 /nfs/dbraw/zinc/32/41/20/327324120.db2.gz XNFPKUSDYMFWTN-MRXNPFEDSA-N 1 2 287.382 4.591 20 0 CJADLO Cc1cc(N[C@H](c2[nH]cc[nH+]2)C2CCCCC2)ccc1F ZINC000560554081 327324238 /nfs/dbraw/zinc/32/42/38/327324238.db2.gz RACHSSAJDRDVJY-INIZCTEOSA-N 1 2 287.382 4.591 20 0 CJADLO Cc1cc(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)ccc1F ZINC000560554082 327324157 /nfs/dbraw/zinc/32/41/57/327324157.db2.gz RACHSSAJDRDVJY-MRXNPFEDSA-N 1 2 287.382 4.591 20 0 CJADLO Clc1ccc(C[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)o1 ZINC000560586694 327328447 /nfs/dbraw/zinc/32/84/47/327328447.db2.gz KQKFMTSPMBJIRB-CYBMUJFWSA-N 1 2 282.170 4.533 20 0 CJADLO Clc1ccc(C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)o1 ZINC000560586694 327328446 /nfs/dbraw/zinc/32/84/46/327328446.db2.gz KQKFMTSPMBJIRB-CYBMUJFWSA-N 1 2 282.170 4.533 20 0 CJADLO Clc1ccc(C[N@H+]2CC[C@H]2c2ccc(Cl)cc2)o1 ZINC000560586695 327328434 /nfs/dbraw/zinc/32/84/34/327328434.db2.gz KQKFMTSPMBJIRB-ZDUSSCGKSA-N 1 2 282.170 4.533 20 0 CJADLO Clc1ccc(C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)o1 ZINC000560586695 327328433 /nfs/dbraw/zinc/32/84/33/327328433.db2.gz KQKFMTSPMBJIRB-ZDUSSCGKSA-N 1 2 282.170 4.533 20 0 CJADLO Cc1nc([C@@H](C)[NH2+][C@@H](C)c2c(F)cccc2Cl)cs1 ZINC000560904816 327351433 /nfs/dbraw/zinc/35/14/33/327351433.db2.gz XAWGWDBUARCXDJ-BDAKNGLRSA-N 1 2 298.814 4.656 20 0 CJADLO Cc1nc([C@H](C)[NH2+][C@H](C)c2c(F)cccc2Cl)cs1 ZINC000560904817 327351336 /nfs/dbraw/zinc/35/13/36/327351336.db2.gz XAWGWDBUARCXDJ-DTWKUNHWSA-N 1 2 298.814 4.656 20 0 CJADLO Cc1nc([C@H](C)[NH2+][C@@H](C)c2c(F)cccc2Cl)cs1 ZINC000560904818 327351355 /nfs/dbraw/zinc/35/13/55/327351355.db2.gz XAWGWDBUARCXDJ-IUCAKERBSA-N 1 2 298.814 4.656 20 0 CJADLO Cc1nc([C@@H](C)[NH2+][C@H](C)c2c(F)cccc2Cl)cs1 ZINC000560904819 327351362 /nfs/dbraw/zinc/35/13/62/327351362.db2.gz XAWGWDBUARCXDJ-RKDXNWHRSA-N 1 2 298.814 4.656 20 0 CJADLO C[C@H](Nc1cc[nH+]c2c(Cl)cccc12)c1cccc(O)c1 ZINC000561323750 327385796 /nfs/dbraw/zinc/38/57/96/327385796.db2.gz LYFUOYYVHBGHOU-NSHDSACASA-N 1 2 298.773 4.767 20 0 CJADLO C/C=C\c1ccc(NCc2cc(-n3cc[nH+]c3)cs2)cc1 ZINC000563770427 328512615 /nfs/dbraw/zinc/51/26/15/328512615.db2.gz PKARQYNBVGQSMG-IHWYPQMZSA-N 1 2 295.411 4.579 20 0 CJADLO Clc1cccc(Cl)c1[C@@H]([NH2+]Cc1ccco1)C1CC1 ZINC000564405969 327261129 /nfs/dbraw/zinc/26/11/29/327261129.db2.gz MZUYWOWVTDIWKG-HNNXBMFYSA-N 1 2 296.197 4.827 20 0 CJADLO Clc1cccc(Cl)c1[C@H]([NH2+]Cc1ccco1)C1CC1 ZINC000564405970 327261157 /nfs/dbraw/zinc/26/11/57/327261157.db2.gz MZUYWOWVTDIWKG-OAHLLOKOSA-N 1 2 296.197 4.827 20 0 CJADLO Cc1ccc2cc([C@@H](C)[NH2+][C@@H](C)c3cscn3)oc2c1 ZINC000565243236 334547780 /nfs/dbraw/zinc/54/77/80/334547780.db2.gz BQNHMRZHRQSDQT-NWDGAFQWSA-N 1 2 286.400 4.610 20 0 CJADLO Cc1ccc2cc([C@@H](C)[NH2+][C@H](C)c3cscn3)oc2c1 ZINC000565243238 334547725 /nfs/dbraw/zinc/54/77/25/334547725.db2.gz BQNHMRZHRQSDQT-VXGBXAGGSA-N 1 2 286.400 4.610 20 0 CJADLO Cc1ccc(NC(=O)c2ccc(C3CCCC3)cc2)c(C)[nH+]1 ZINC000565510540 334569747 /nfs/dbraw/zinc/56/97/47/334569747.db2.gz HPZJPTJQFHKEPZ-UHFFFAOYSA-N 1 2 294.398 4.608 20 0 CJADLO CCSc1cccc(NCCCc2c[nH+]ccc2C)c1 ZINC000567280846 334700435 /nfs/dbraw/zinc/70/04/35/334700435.db2.gz WRNBVEUQHZFZKR-UHFFFAOYSA-N 1 2 286.444 4.547 20 0 CJADLO Cc1cc(F)cc(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)c1 ZINC000568753904 334839262 /nfs/dbraw/zinc/83/92/62/334839262.db2.gz AESQQSNKJLQAAB-MRXNPFEDSA-N 1 2 287.382 4.591 20 0 CJADLO CCc1nc([C@@H](C)[NH2+]Cc2ccc(C)cc2Cl)cs1 ZINC000568890882 334845589 /nfs/dbraw/zinc/84/55/89/334845589.db2.gz ZPZGLLQYJUECDQ-LLVKDONJSA-N 1 2 294.851 4.518 20 0 CJADLO CCc1nc([C@H](C)[NH2+]Cc2ccc(C)cc2Cl)cs1 ZINC000568890900 334845585 /nfs/dbraw/zinc/84/55/85/334845585.db2.gz ZPZGLLQYJUECDQ-NSHDSACASA-N 1 2 294.851 4.518 20 0 CJADLO Cc1cc(C)c(NC(=O)CCCCC(C)(C)C)c(C)[nH+]1 ZINC000569264250 334864580 /nfs/dbraw/zinc/86/45/80/334864580.db2.gz ZYRXIIAOIDRQJZ-UHFFFAOYSA-N 1 2 276.424 4.552 20 0 CJADLO Cc1ccc([C@H]2CCCN2c2cc[nH+]c(C(C)C)n2)cc1C ZINC000570115228 327570061 /nfs/dbraw/zinc/57/00/61/327570061.db2.gz FBSXZPIQDHMWBV-QGZVFWFLSA-N 1 2 295.430 4.558 20 0 CJADLO Cc1ccc(N[C@H](c2[nH]cc[nH+]2)C2CCCCC2)c(F)c1 ZINC000570503091 327596333 /nfs/dbraw/zinc/59/63/33/327596333.db2.gz MJOOSBDFTJZYNT-INIZCTEOSA-N 1 2 287.382 4.591 20 0 CJADLO Cc1ccc(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)c(F)c1 ZINC000570503092 327596293 /nfs/dbraw/zinc/59/62/93/327596293.db2.gz MJOOSBDFTJZYNT-MRXNPFEDSA-N 1 2 287.382 4.591 20 0 CJADLO C[C@@H]([NH2+]C(C)(C)c1cccs1)c1ncc(C(C)(C)C)o1 ZINC000570603607 327603196 /nfs/dbraw/zinc/60/31/96/327603196.db2.gz AXTLBQQCDWUIKV-LLVKDONJSA-N 1 2 292.448 4.620 20 0 CJADLO Cc1cc[nH+]cc1CCCNc1cccc2ccccc21 ZINC000570605043 327603179 /nfs/dbraw/zinc/60/31/79/327603179.db2.gz OLGMZRDGCSLNMD-UHFFFAOYSA-N 1 2 276.383 4.588 20 0 CJADLO CC[C@@H]([NH2+][C@H](C)c1cscn1)c1cccc(Cl)c1F ZINC000571464502 328123724 /nfs/dbraw/zinc/12/37/24/328123724.db2.gz WAMSIERLICQRMV-BXKDBHETSA-N 1 2 298.814 4.738 20 0 CJADLO CC[C@H]([NH2+][C@@H](C)c1cscn1)c1cccc(Cl)c1F ZINC000571464503 328123711 /nfs/dbraw/zinc/12/37/11/328123711.db2.gz WAMSIERLICQRMV-CABZTGNLSA-N 1 2 298.814 4.738 20 0 CJADLO CC[C@@H]([NH2+][C@@H](C)c1cscn1)c1cccc(Cl)c1F ZINC000571464504 328123625 /nfs/dbraw/zinc/12/36/25/328123625.db2.gz WAMSIERLICQRMV-JOYOIKCWSA-N 1 2 298.814 4.738 20 0 CJADLO CC[C@H]([NH2+][C@H](C)c1cscn1)c1cccc(Cl)c1F ZINC000571464505 328123653 /nfs/dbraw/zinc/12/36/53/328123653.db2.gz WAMSIERLICQRMV-SKDRFNHKSA-N 1 2 298.814 4.738 20 0 CJADLO Cc1cc[nH+]cc1CCCNc1cccc(C(C)C)c1 ZINC000572205575 329954930 /nfs/dbraw/zinc/95/49/30/329954930.db2.gz PXJRYSVCYUKQAI-UHFFFAOYSA-N 1 2 268.404 4.558 20 0 CJADLO CC(C)CCc1ccccc1N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000572355748 329999711 /nfs/dbraw/zinc/99/97/11/329999711.db2.gz ZZTCNOZOMVYJKE-YOEHRIQHSA-N 1 2 283.419 4.590 20 0 CJADLO Cc1cccc(CCS[C@H](C)c2nc3ccccc3o2)[nH+]1 ZINC000572363783 330004772 /nfs/dbraw/zinc/00/47/72/330004772.db2.gz GLMJXGPGRBPWBV-CYBMUJFWSA-N 1 2 298.411 4.568 20 0 CJADLO Cc1cccc(CCS[C@@H](C)c2nc3ccccc3o2)[nH+]1 ZINC000572363784 330004747 /nfs/dbraw/zinc/00/47/47/330004747.db2.gz GLMJXGPGRBPWBV-ZDUSSCGKSA-N 1 2 298.411 4.568 20 0 CJADLO CC=Cc1ccc(N[C@H](c2[nH]cc[nH+]2)c2ccccc2)cc1 ZINC000572708677 327392332 /nfs/dbraw/zinc/39/23/32/327392332.db2.gz YERSXIVZIJBDON-VBAWXRRRSA-N 1 2 289.382 4.644 20 0 CJADLO C/C=C/c1ccc(N[C@H](c2[nH]cc[nH+]2)c2ccccc2)cc1 ZINC000572708677 327392330 /nfs/dbraw/zinc/39/23/30/327392330.db2.gz YERSXIVZIJBDON-VBAWXRRRSA-N 1 2 289.382 4.644 20 0 CJADLO CC=Cc1ccc(N[C@@H](c2[nH]cc[nH+]2)c2ccccc2)cc1 ZINC000572708678 327392478 /nfs/dbraw/zinc/39/24/78/327392478.db2.gz YERSXIVZIJBDON-VGLFAYCPSA-N 1 2 289.382 4.644 20 0 CJADLO C/C=C\c1ccc(N[C@@H](c2[nH]cc[nH+]2)c2ccccc2)cc1 ZINC000572708678 327392477 /nfs/dbraw/zinc/39/24/77/327392477.db2.gz YERSXIVZIJBDON-VGLFAYCPSA-N 1 2 289.382 4.644 20 0 CJADLO Cc1c[nH+]c(CCSCCCCOC(C)(C)C)c(C)c1 ZINC000573206514 334917842 /nfs/dbraw/zinc/91/78/42/334917842.db2.gz CHWJRQLQSOIGEX-UHFFFAOYSA-N 1 2 295.492 4.569 20 0 CJADLO Cc1[nH+]c(C(C)C)ccc1CNc1cccc2cc[nH]c21 ZINC000574012655 334984711 /nfs/dbraw/zinc/98/47/11/334984711.db2.gz XYIPJPOZSQAYQW-UHFFFAOYSA-N 1 2 279.387 4.607 20 0 CJADLO Cc1ccoc1CNc1cccc([NH+]2CCCCCC2)c1 ZINC000574506679 335024615 /nfs/dbraw/zinc/02/46/15/335024615.db2.gz SIQICOZFAMOKLX-UHFFFAOYSA-N 1 2 284.403 4.581 20 0 CJADLO Cc1cc[nH+]c(C)c1NC(=O)Nc1ccc(C2CCC2)cc1 ZINC000575130943 335070640 /nfs/dbraw/zinc/07/06/40/335070640.db2.gz NHQOHLKYJKFRQT-UHFFFAOYSA-N 1 2 295.386 4.610 20 0 CJADLO C[C@H](CC(F)(F)F)Nc1cc[nH+]c2c(Cl)cccc12 ZINC000577089026 335298201 /nfs/dbraw/zinc/29/82/01/335298201.db2.gz HJXSQOWYJYXEED-MRVPVSSYSA-N 1 2 288.700 4.641 20 0 CJADLO C[C@@H](CC(F)(F)F)Nc1cc[nH+]c2c(Cl)cccc12 ZINC000577089027 335298213 /nfs/dbraw/zinc/29/82/13/335298213.db2.gz HJXSQOWYJYXEED-QMMMGPOBSA-N 1 2 288.700 4.641 20 0 CJADLO Cc1cc[nH+]cc1CCCNc1ccc(C(C)C)cc1 ZINC000577304975 335337290 /nfs/dbraw/zinc/33/72/90/335337290.db2.gz OEOXIBBPMVVKQU-UHFFFAOYSA-N 1 2 268.404 4.558 20 0 CJADLO C[C@@H](Nc1ccc2c(c1)C(C)(C)CC2(C)C)c1[nH]cc[nH+]1 ZINC000579017311 335701239 /nfs/dbraw/zinc/70/12/39/335701239.db2.gz YNLJBQZICICWHE-GFCCVEGCSA-N 1 2 283.419 4.542 20 0 CJADLO C[C@H](Nc1ccc2c(c1)C(C)(C)CC2(C)C)c1[nH]cc[nH+]1 ZINC000579017312 335701134 /nfs/dbraw/zinc/70/11/34/335701134.db2.gz YNLJBQZICICWHE-LBPRGKRZSA-N 1 2 283.419 4.542 20 0 CJADLO Cc1cc[nH+]cc1CCCNc1cccc(C(C)(F)F)c1 ZINC000580363778 328796615 /nfs/dbraw/zinc/79/66/15/328796615.db2.gz NGUVNEZYBOSQAT-UHFFFAOYSA-N 1 2 290.357 4.546 20 0 CJADLO Cc1nsc(C)c1C[N@H+](C)[C@H](C)c1ccccc1Cl ZINC000580614980 335301602 /nfs/dbraw/zinc/30/16/02/335301602.db2.gz YKFQPTCYZUGWOV-LLVKDONJSA-N 1 2 294.851 4.606 20 0 CJADLO Cc1nsc(C)c1C[N@@H+](C)[C@H](C)c1ccccc1Cl ZINC000580614980 335301601 /nfs/dbraw/zinc/30/16/01/335301601.db2.gz YKFQPTCYZUGWOV-LLVKDONJSA-N 1 2 294.851 4.606 20 0 CJADLO Cc1nsc(C)c1C[N@H+](C)[C@@H](C)c1ccccc1Cl ZINC000580614981 335301576 /nfs/dbraw/zinc/30/15/76/335301576.db2.gz YKFQPTCYZUGWOV-NSHDSACASA-N 1 2 294.851 4.606 20 0 CJADLO Cc1nsc(C)c1C[N@@H+](C)[C@@H](C)c1ccccc1Cl ZINC000580614981 335301574 /nfs/dbraw/zinc/30/15/74/335301574.db2.gz YKFQPTCYZUGWOV-NSHDSACASA-N 1 2 294.851 4.606 20 0 CJADLO FC(F)(F)c1cccc([C@H](Nc2cccc[nH+]2)C2CC2)c1 ZINC000582015213 336192678 /nfs/dbraw/zinc/19/26/78/336192678.db2.gz AWRLOBAAFVEQEL-OAHLLOKOSA-N 1 2 292.304 4.664 20 0 CJADLO Cc1ccc(CNc2ccc(-c3ccco3)cc2F)c(C)[nH+]1 ZINC000582526190 329107111 /nfs/dbraw/zinc/10/71/11/329107111.db2.gz YGPZTXJLAATJGY-UHFFFAOYSA-N 1 2 296.345 4.710 20 0 CJADLO FC(F)(F)c1cscc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000582996183 329299912 /nfs/dbraw/zinc/29/99/12/329299912.db2.gz PCVJTYUFZIOXDJ-AWEZNQCLSA-N 1 2 297.345 4.714 20 0 CJADLO FC(F)(F)c1cscc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000582996183 329299910 /nfs/dbraw/zinc/29/99/10/329299910.db2.gz PCVJTYUFZIOXDJ-AWEZNQCLSA-N 1 2 297.345 4.714 20 0 CJADLO FC(F)(F)c1cscc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000582996377 329299801 /nfs/dbraw/zinc/29/98/01/329299801.db2.gz PCVJTYUFZIOXDJ-CQSZACIVSA-N 1 2 297.345 4.714 20 0 CJADLO FC(F)(F)c1cscc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000582996377 329299800 /nfs/dbraw/zinc/29/98/00/329299800.db2.gz PCVJTYUFZIOXDJ-CQSZACIVSA-N 1 2 297.345 4.714 20 0 CJADLO C[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc(Cl)c(F)c1 ZINC000583375459 327331929 /nfs/dbraw/zinc/33/19/29/327331929.db2.gz LENZBVVEZCZLFV-JTQLQIEISA-N 1 2 290.769 4.620 20 0 CJADLO C[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc(Cl)c(F)c1 ZINC000583375460 327331894 /nfs/dbraw/zinc/33/18/94/327331894.db2.gz LENZBVVEZCZLFV-SNVBAGLBSA-N 1 2 290.769 4.620 20 0 CJADLO C/C=C\c1ccc(NCc2cn3cc(Cl)ccc3[nH+]2)cc1 ZINC000583622246 328684542 /nfs/dbraw/zinc/68/45/42/328684542.db2.gz BCEBZENRLLXKNX-IHWYPQMZSA-N 1 2 297.789 4.633 20 0 CJADLO C/C=C/c1ccc(NCc2cn3cc(Cl)ccc3[nH+]2)cc1 ZINC000583622247 328684379 /nfs/dbraw/zinc/68/43/79/328684379.db2.gz BCEBZENRLLXKNX-NSCUHMNNSA-N 1 2 297.789 4.633 20 0 CJADLO