smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)c1cc(Cl)c(Cl)cc1O ZINC000817970276 1029309492 /nfs/dbraw/zinc/30/94/92/1029309492.db2.gz QHTXQZVSFWMONS-GUBZILKMSA-N 2 1 303.233 3.620 20 10 DHCDMP C[N@H+]1CCCC[C@@H](C[NH2+]Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000858245370 1032816665 /nfs/dbraw/zinc/81/66/65/1032816665.db2.gz RJVMNEGWZRUWHY-KRWDZBQOSA-N 2 1 324.468 3.881 20 10 DHCDMP CCCC[N@H+](CCCn1cc[nH+]c1C)Cc1ccccc1O ZINC000282571314 1020464160 /nfs/dbraw/zinc/46/41/60/1020464160.db2.gz ZOKVPBIDYJGGQF-UHFFFAOYSA-N 2 1 301.434 3.590 20 10 DHCDMP CCCC[N@@H+](CCCn1cc[nH+]c1C)Cc1ccccc1O ZINC000282571314 1020464165 /nfs/dbraw/zinc/46/41/65/1020464165.db2.gz ZOKVPBIDYJGGQF-UHFFFAOYSA-N 2 1 301.434 3.590 20 10 DHCDMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000743398920 1021284469 /nfs/dbraw/zinc/28/44/69/1021284469.db2.gz OSIXZGQDTSYMCG-INIZCTEOSA-N 2 1 304.478 3.598 20 10 DHCDMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000743398920 1021284482 /nfs/dbraw/zinc/28/44/82/1021284482.db2.gz OSIXZGQDTSYMCG-INIZCTEOSA-N 2 1 304.478 3.598 20 10 DHCDMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000743398920 1021284493 /nfs/dbraw/zinc/28/44/93/1021284493.db2.gz OSIXZGQDTSYMCG-INIZCTEOSA-N 2 1 304.478 3.598 20 10 DHCDMP CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC000125775554 1032969620 /nfs/dbraw/zinc/96/96/20/1032969620.db2.gz NUKDMQHPCQVNDV-ROUUACIJSA-N 2 1 317.521 3.914 20 10 DHCDMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1cc3ccccc3cc1O)C2 ZINC001172116273 1033014708 /nfs/dbraw/zinc/01/47/08/1033014708.db2.gz GOWCPXOMRAQOME-LDLYASANSA-N 2 1 310.441 3.650 20 10 DHCDMP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)cc1F ZINC000763603781 1021935364 /nfs/dbraw/zinc/93/53/64/1021935364.db2.gz DAUGWAGDOBXDGA-QGZVFWFLSA-N 2 1 321.484 3.588 20 10 DHCDMP CCN(CC)c1ccc(C[N@H+]2CCC[C@@H]([NH+](C)C)CC2)cc1F ZINC000763603781 1021935371 /nfs/dbraw/zinc/93/53/71/1021935371.db2.gz DAUGWAGDOBXDGA-QGZVFWFLSA-N 2 1 321.484 3.588 20 10 DHCDMP C[C@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccccc1O ZINC000183423019 1022139410 /nfs/dbraw/zinc/13/94/10/1022139410.db2.gz CGZOCYBAKQHYSF-BBWFWOEESA-N 2 1 304.478 3.801 20 10 DHCDMP C[C@H](CC[NH2+][C@@H](C)c1ccccc1O)[N@@H+](C)Cc1ccccc1 ZINC000183541040 1022181177 /nfs/dbraw/zinc/18/11/77/1022181177.db2.gz QMDWPXZUOFGKRC-SJORKVTESA-N 2 1 312.457 3.953 20 10 DHCDMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(N(C)C)cc1 ZINC000853241443 1022240969 /nfs/dbraw/zinc/24/09/69/1022240969.db2.gz VFFXRVDYUWOLLD-SJLPKXTDSA-N 2 1 315.505 3.525 20 10 DHCDMP CCCC[N@@H+](C)CC1CC[NH+](Cc2c(O)cccc2Cl)CC1 ZINC000768304209 1022942981 /nfs/dbraw/zinc/94/29/81/1022942981.db2.gz UOKSEPGCYOACLU-UHFFFAOYSA-N 2 1 324.896 3.990 20 10 DHCDMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cc(Cl)ccc2O)CC1 ZINC000768926821 1023058250 /nfs/dbraw/zinc/05/82/50/1023058250.db2.gz OGOZDVCLJPPQSC-UHFFFAOYSA-N 2 1 310.869 3.598 20 10 DHCDMP CCN(CC)c1ccc(C[NH+](C)[C@@H]2CC[N@H+](CC)C[C@@H]2C)cc1 ZINC000769481886 1023152129 /nfs/dbraw/zinc/15/21/29/1023152129.db2.gz ANRPKFDXLQNIKQ-FXAWDEMLSA-N 2 1 317.521 3.695 20 10 DHCDMP CCN(CC)c1ccc(C[NH+](C)[C@@H]2CC[N@@H+](CC)C[C@@H]2C)cc1 ZINC000769481886 1023152134 /nfs/dbraw/zinc/15/21/34/1023152134.db2.gz ANRPKFDXLQNIKQ-FXAWDEMLSA-N 2 1 317.521 3.695 20 10 DHCDMP CCN(CC)c1ccc(C[N@H+]2CCCC23CC[NH+](C)CC3)cc1 ZINC000789559335 1024123094 /nfs/dbraw/zinc/12/30/94/1024123094.db2.gz LTBNKSKUTALZNA-UHFFFAOYSA-N 2 1 315.505 3.593 20 10 DHCDMP CC[C@@H]([NH2+]C[C@H](C)C[NH+]1CCCCC1)c1ccc(F)cc1O ZINC000796696193 1024635314 /nfs/dbraw/zinc/63/53/14/1024635314.db2.gz RWZUYMYNNQYSBD-WMLDXEAASA-N 2 1 308.441 3.694 20 10 DHCDMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)C1 ZINC000248528625 1025967834 /nfs/dbraw/zinc/96/78/34/1025967834.db2.gz WGGGPJPFQKLBOA-CVEARBPZSA-N 2 1 316.489 3.654 20 10 DHCDMP Cc1cc(O)c(C[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)cc1C ZINC000809737264 1026609462 /nfs/dbraw/zinc/60/94/62/1026609462.db2.gz FCBNGANHVYPFMA-UHFFFAOYSA-N 2 1 312.457 3.703 20 10 DHCDMP C[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(N2CCCCC2)cc1 ZINC000271817244 1027152246 /nfs/dbraw/zinc/15/22/46/1027152246.db2.gz BVCNWNDBCPXWAK-QGZVFWFLSA-N 2 1 313.489 3.589 20 10 DHCDMP Cc1cc(O)c(C[NH+]2CCC([NH2+]C3CCCC3)CC2)cc1C ZINC000362375800 1027168535 /nfs/dbraw/zinc/16/85/35/1027168535.db2.gz ITOUCUBNDMQREF-UHFFFAOYSA-N 2 1 302.462 3.506 20 10 DHCDMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cc2c(cc1O)CCCC2 ZINC000296286400 1027596889 /nfs/dbraw/zinc/59/68/89/1027596889.db2.gz FHADAYOHSZLOLH-DXJOGWAWSA-N 2 1 314.473 3.547 20 10 DHCDMP C[N@H+]1CC[C@]2(CC[NH+](Cc3cc(-c4ccccc4)ccc3O)C2)C1 ZINC000814178113 1027913822 /nfs/dbraw/zinc/91/38/22/1027913822.db2.gz CGHOPBVLAGZMJM-NRFANRHFSA-N 2 1 322.452 3.587 20 10 DHCDMP C[NH+]1CC[C@]2(CC[N@H+](Cc3cc(-c4ccccc4)ccc3O)C2)C1 ZINC000814178113 1027913836 /nfs/dbraw/zinc/91/38/36/1027913836.db2.gz CGHOPBVLAGZMJM-NRFANRHFSA-N 2 1 322.452 3.587 20 10 DHCDMP C[NH+]1CC[C@]2(CC[N@@H+](Cc3cc(-c4ccccc4)ccc3O)C2)C1 ZINC000814178113 1027913849 /nfs/dbraw/zinc/91/38/49/1027913849.db2.gz CGHOPBVLAGZMJM-NRFANRHFSA-N 2 1 322.452 3.587 20 10 DHCDMP Cc1cc(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)ccc1N(C)C ZINC000815052158 1028334925 /nfs/dbraw/zinc/33/49/25/1028334925.db2.gz DZAHQIXMZGUWLO-LJQANCHMSA-N 2 1 315.505 3.511 20 10 DHCDMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C)[C@H]1c1ccccc1)c1ccccc1O ZINC000368484440 1028363445 /nfs/dbraw/zinc/36/34/45/1028363445.db2.gz YIPIBUJRXOEHSA-KNBMTAEXSA-N 2 1 310.441 3.736 20 10 DHCDMP C[C@H](CCCC[NH3+])[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000817976603 1029313752 /nfs/dbraw/zinc/31/37/52/1029313752.db2.gz OXHIVBKIGNDJPN-NXEZZACHSA-N 2 1 305.249 3.867 20 10 DHCDMP C[C@@H]([NH2+][C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1O ZINC000877755963 1033430947 /nfs/dbraw/zinc/43/09/47/1033430947.db2.gz UZWNTZWZAQVWAO-LMMKCTJWSA-N 2 1 324.468 3.953 20 10 DHCDMP CC[C@H]1CC[C@H]([NH2+]C2CC[NH+](Cc3ccccc3O)CC2)C1 ZINC001173270834 1033639825 /nfs/dbraw/zinc/63/98/25/1033639825.db2.gz CVEDZPZUSDAAQF-YJBOKZPZSA-N 2 1 302.462 3.525 20 10 DHCDMP C[C@@H]([NH2+]C1CC[NH+](CCc2ccccc2)CC1)c1ccccc1O ZINC000183413869 1034385925 /nfs/dbraw/zinc/38/59/25/1034385925.db2.gz YPSLKKVETJKBLQ-QGZVFWFLSA-N 2 1 324.468 3.750 20 10 DHCDMP C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1cc2c(cc1O)CCCC2 ZINC000184913151 1034513152 /nfs/dbraw/zinc/51/31/52/1034513152.db2.gz ZYQJMNSZPJTRRI-CQSZACIVSA-N 2 1 314.473 3.548 20 10 DHCDMP C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000186518288 1034638781 /nfs/dbraw/zinc/63/87/81/1034638781.db2.gz UGACFSIQHDCTFH-QLFBSQMISA-N 2 1 320.452 3.835 20 10 DHCDMP C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000186518288 1034638788 /nfs/dbraw/zinc/63/87/88/1034638788.db2.gz UGACFSIQHDCTFH-QLFBSQMISA-N 2 1 320.452 3.835 20 10 DHCDMP C[C@@H]([NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cc(F)ccc1O ZINC000186518977 1034639214 /nfs/dbraw/zinc/63/92/14/1034639214.db2.gz FPQLFRJDJAAAKD-RBSFLKMASA-N 2 1 320.452 3.835 20 10 DHCDMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(Cl)cc(C)c2O)C[C@@H]1C ZINC000775715832 1036532527 /nfs/dbraw/zinc/53/25/27/1036532527.db2.gz MIHRYYSLKIBPLM-BBRMVZONSA-N 2 1 310.869 3.659 20 10 DHCDMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(Cl)cc(C)c2O)C[C@@H]1C ZINC000775715832 1036532540 /nfs/dbraw/zinc/53/25/40/1036532540.db2.gz MIHRYYSLKIBPLM-BBRMVZONSA-N 2 1 310.869 3.659 20 10 DHCDMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(Cl)cc(C)c2O)C[C@@H]1C ZINC000775715832 1036532559 /nfs/dbraw/zinc/53/25/59/1036532559.db2.gz MIHRYYSLKIBPLM-BBRMVZONSA-N 2 1 310.869 3.659 20 10 DHCDMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000173489713 1040312343 /nfs/dbraw/zinc/31/23/43/1040312343.db2.gz ICGHEBOFQPNRSB-MRXNPFEDSA-N 2 1 318.505 3.772 20 10 DHCDMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000173489713 1040312360 /nfs/dbraw/zinc/31/23/60/1040312360.db2.gz ICGHEBOFQPNRSB-MRXNPFEDSA-N 2 1 318.505 3.772 20 10 DHCDMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000173489713 1040312370 /nfs/dbraw/zinc/31/23/70/1040312370.db2.gz ICGHEBOFQPNRSB-MRXNPFEDSA-N 2 1 318.505 3.772 20 10 DHCDMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000273603171 130143080 /nfs/dbraw/zinc/14/30/80/130143080.db2.gz SLYMTLBYRZLBEH-HNNXBMFYSA-N 2 1 301.434 3.645 20 10 DHCDMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cc(C)c(C)cc1O ZINC000191278914 521662274 /nfs/dbraw/zinc/66/22/74/521662274.db2.gz DUDFQUJBYJWCHE-UHFFFAOYSA-N 2 1 315.461 3.680 20 10 DHCDMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cc(C)c(C)cc1O ZINC000191278914 521662277 /nfs/dbraw/zinc/66/22/77/521662277.db2.gz DUDFQUJBYJWCHE-UHFFFAOYSA-N 2 1 315.461 3.680 20 10 DHCDMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccccc1O ZINC000310343178 1014108931 /nfs/dbraw/zinc/10/89/31/1014108931.db2.gz DOXPGVGMLIKNDB-MJGOQNOKSA-N 2 1 324.468 3.955 20 10 DHCDMP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1)c1ccc(F)cc1O ZINC000796838668 1016418650 /nfs/dbraw/zinc/41/86/50/1016418650.db2.gz JJSKXZQANZYHBY-YJBOKZPZSA-N 2 1 322.468 3.940 20 10 DHCDMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1)c1ccc(F)cc1O ZINC000796838668 1016418658 /nfs/dbraw/zinc/41/86/58/1016418658.db2.gz JJSKXZQANZYHBY-YJBOKZPZSA-N 2 1 322.468 3.940 20 10 DHCDMP C[C@@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1ccc(F)cc1O ZINC000185036390 1016524897 /nfs/dbraw/zinc/52/48/97/1016524897.db2.gz RCJWTFGVMCBSSH-OAHLLOKOSA-N 2 1 308.441 3.694 20 10 DHCDMP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1ccc(F)cc1O ZINC000853241913 1022241360 /nfs/dbraw/zinc/24/13/60/1022241360.db2.gz YSFTWMVCEBYGTK-YJBOKZPZSA-N 2 1 320.452 3.694 20 10 DHCDMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(F)cc1O ZINC000853241913 1022241367 /nfs/dbraw/zinc/24/13/67/1022241367.db2.gz YSFTWMVCEBYGTK-YJBOKZPZSA-N 2 1 320.452 3.694 20 10 DHCDMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1cc(Cl)ccc1O ZINC000853240650 1022242058 /nfs/dbraw/zinc/24/20/58/1022242058.db2.gz QDXZMNFFNPOUGO-ZFWWWQNUSA-N 2 1 322.880 3.818 20 10 DHCDMP Cc1cccc(C[NH+]2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)c1O ZINC000179884735 1022572561 /nfs/dbraw/zinc/57/25/61/1022572561.db2.gz WNEFDOVKAXGTSA-ROUUACIJSA-N 2 1 316.489 3.787 20 10 DHCDMP Cc1cccc(C[N@H+]2CCC[C@H](C[NH+]3CCCC[C@@H]3C)C2)c1O ZINC000179884735 1022572568 /nfs/dbraw/zinc/57/25/68/1022572568.db2.gz WNEFDOVKAXGTSA-ROUUACIJSA-N 2 1 316.489 3.787 20 10 DHCDMP Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)c(O)c1 ZINC000788593628 1023910107 /nfs/dbraw/zinc/91/01/07/1023910107.db2.gz HBMCAVCKAKOKCM-DLBZAZTESA-N 2 1 304.478 3.780 20 10 DHCDMP CC[C@@H]([NH2+]CC[C@@H](C)[NH+]1CCCCC1)c1ccc(F)cc1O ZINC000796935706 1024347321 /nfs/dbraw/zinc/34/73/21/1024347321.db2.gz IGHVRBXJELRSQW-RHSMWYFYSA-N 2 1 308.441 3.837 20 10 DHCDMP CC[C@@H]([NH2+]C[C@@H](C)C[NH+]1CCCCC1)c1ccc(F)cc1O ZINC000796696191 1024635057 /nfs/dbraw/zinc/63/50/57/1024635057.db2.gz RWZUYMYNNQYSBD-RHSMWYFYSA-N 2 1 308.441 3.694 20 10 DHCDMP Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)c1O ZINC000808678620 1026356456 /nfs/dbraw/zinc/35/64/56/1026356456.db2.gz TWLDZNIPLNJMJJ-AEGPPILISA-N 2 1 308.853 3.631 20 10 DHCDMP C[C@H]([NH2+][C@@H]1CCc2cccc(O)c21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000296294402 1027600311 /nfs/dbraw/zinc/60/03/11/1027600311.db2.gz DFHSPMDFIXJIHW-YXJHDRRASA-N 2 1 314.473 3.622 20 10 DHCDMP C[N@H+]1CC[C@@]2(CC[NH+](Cc3cc(-c4ccccc4)ccc3O)C2)C1 ZINC000814178114 1027913039 /nfs/dbraw/zinc/91/30/39/1027913039.db2.gz CGHOPBVLAGZMJM-OAQYLSRUSA-N 2 1 322.452 3.587 20 10 DHCDMP C[NH+]1CC[C@@]2(CC[N@H+](Cc3cc(-c4ccccc4)ccc3O)C2)C1 ZINC000814178114 1027913061 /nfs/dbraw/zinc/91/30/61/1027913061.db2.gz CGHOPBVLAGZMJM-OAQYLSRUSA-N 2 1 322.452 3.587 20 10 DHCDMP C[NH+]1CC[C@@]2(CC[N@@H+](Cc3cc(-c4ccccc4)ccc3O)C2)C1 ZINC000814178114 1027913075 /nfs/dbraw/zinc/91/30/75/1027913075.db2.gz CGHOPBVLAGZMJM-OAQYLSRUSA-N 2 1 322.452 3.587 20 10 DHCDMP CC[C@H](c1ccccc1O)[N@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000367356509 1028172138 /nfs/dbraw/zinc/17/21/38/1028172138.db2.gz NOQYGAIODNCROT-QGZVFWFLSA-N 2 1 302.462 3.651 20 10 DHCDMP CC[C@@H](c1ccccc1O)[N@H+]1CC[C@H](C2CC[NH+](C)CC2)C1 ZINC000368137222 1028311555 /nfs/dbraw/zinc/31/15/55/1028311555.db2.gz YGDHAAGYDYYVEV-WMZOPIPTSA-N 2 1 302.462 3.507 20 10 DHCDMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C)[C@@H]1c1ccccc1)c1ccccc1O ZINC000368484443 1028362736 /nfs/dbraw/zinc/36/27/36/1028362736.db2.gz YIPIBUJRXOEHSA-XAUMDUMWSA-N 2 1 310.441 3.736 20 10 DHCDMP [NH3+][C@@H]1C[C@@H]([NH2+]Cc2ccc(N3CCCC3)cc2)c2ccccc21 ZINC000817900463 1029268263 /nfs/dbraw/zinc/26/82/63/1029268263.db2.gz SRSWYMAMQIVEBU-WOJBJXKFSA-N 2 1 307.441 3.521 20 10 DHCDMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(Cl)c(C)cc2O)C[C@@H]1C ZINC000824855900 1030655574 /nfs/dbraw/zinc/65/55/74/1030655574.db2.gz RVXXFLFFCSWFGE-ZFWWWQNUSA-N 2 1 310.869 3.659 20 10 DHCDMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(Cl)c(C)cc2O)C[C@@H]1C ZINC000824855900 1030655586 /nfs/dbraw/zinc/65/55/86/1030655586.db2.gz RVXXFLFFCSWFGE-ZFWWWQNUSA-N 2 1 310.869 3.659 20 10 DHCDMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(Cl)c(C)cc2O)C[C@@H]1C ZINC000824855900 1030655596 /nfs/dbraw/zinc/65/55/96/1030655596.db2.gz RVXXFLFFCSWFGE-ZFWWWQNUSA-N 2 1 310.869 3.659 20 10 DHCDMP COc1cccc([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)c1O ZINC000846140153 1031901228 /nfs/dbraw/zinc/90/12/28/1031901228.db2.gz HMYBMOBVXBSRQK-JKSUJKDBSA-N 2 1 320.477 3.706 20 10 DHCDMP C[C@H]([NH2+]C1CCC(C)([NH+]2CCC2)CC1)c1c(O)cccc1F ZINC000927036847 1033406198 /nfs/dbraw/zinc/40/61/98/1033406198.db2.gz JYDICHWFMKCIMM-VNSJNIRKSA-N 2 1 306.425 3.589 20 10 DHCDMP CC[C@@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)c1ccc(N(C)C)cc1 ZINC000178701590 1034257863 /nfs/dbraw/zinc/25/78/63/1034257863.db2.gz PYCLSIKHKZGWLN-HNAYVOBHSA-N 2 1 314.477 3.635 20 10 DHCDMP C[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1cc2c(cc1O)CCCC2 ZINC000184913136 1034513618 /nfs/dbraw/zinc/51/36/18/1034513618.db2.gz ZYQJMNSZPJTRRI-AWEZNQCLSA-N 2 1 314.473 3.548 20 10 DHCDMP Cc1cccc(C[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)c1O ZINC000775678728 1036408875 /nfs/dbraw/zinc/40/88/75/1036408875.db2.gz JCMDBENDIZPCST-GOSISDBHSA-N 2 1 316.489 3.789 20 10 DHCDMP CCc1cccc(C[N@H+]2CCCC[C@@H]2[C@H](C)C[NH+](C)C)c1O ZINC001183065918 1036516392 /nfs/dbraw/zinc/51/63/92/1036516392.db2.gz ROOGWVNLMYNYPT-CRAIPNDOSA-N 2 1 304.478 3.507 20 10 DHCDMP CCc1cccc(C[N@H+]2CCCC[C@H]2[C@@H](C)C[NH+](C)C)c1O ZINC001183065921 1036517187 /nfs/dbraw/zinc/51/71/87/1036517187.db2.gz ROOGWVNLMYNYPT-YJBOKZPZSA-N 2 1 304.478 3.507 20 10 DHCDMP C[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(Cl)c(Cl)c1[O-] ZINC000273533106 130134163 /nfs/dbraw/zinc/13/41/63/130134163.db2.gz WSULCIBMSJGNGT-SNVBAGLBSA-N 2 1 315.244 3.612 20 10 DHCDMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2[O-])C1 ZINC000192692052 333291474 /nfs/dbraw/zinc/29/14/74/333291474.db2.gz RHBVVYPMMXAXKU-WDEREUQCSA-N 2 1 317.260 3.691 20 10 DHCDMP Oc1cccc2c1[C@H]([NH2+]C1CC[NH+](Cc3ccccc3)CC1)CC2 ZINC000295853384 341715434 /nfs/dbraw/zinc/71/54/34/341715434.db2.gz GDIQIPRQKNATBF-LJQANCHMSA-N 2 1 322.452 3.634 20 10 DHCDMP CC(C)C[N@H+]1CCC[C@H](C[NH2+]Cc2c(O)cccc2Cl)C1 ZINC000120800624 1013273179 /nfs/dbraw/zinc/27/31/79/1013273179.db2.gz BUEZYXAEIDNILK-CQSZACIVSA-N 2 1 310.869 3.503 20 10 DHCDMP CC(C)c1cccc(NCc2ccc(N3CC[NH+](C)CC3)cc2)[nH+]1 ZINC001167431007 1014296044 /nfs/dbraw/zinc/29/60/44/1014296044.db2.gz BCPPMZBYPGCPAU-UHFFFAOYSA-N 2 1 324.472 3.569 20 10 DHCDMP C[C@H]1CCC[N@H+]1C1CC[NH+](Cc2c(O)ccc3ccccc32)CC1 ZINC000151633528 1016085558 /nfs/dbraw/zinc/08/55/58/1016085558.db2.gz APMWWKBVWJQILU-INIZCTEOSA-N 2 1 324.468 3.994 20 10 DHCDMP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ccc(F)cc1O ZINC000185034256 1016524698 /nfs/dbraw/zinc/52/46/98/1016524698.db2.gz FNUKFEGWKZASNT-GJZGRUSLSA-N 2 1 308.441 3.694 20 10 DHCDMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccc(F)cc1O ZINC000185034256 1016524705 /nfs/dbraw/zinc/52/47/05/1016524705.db2.gz FNUKFEGWKZASNT-GJZGRUSLSA-N 2 1 308.441 3.694 20 10 DHCDMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](CC)c2ccc(N(C)C)cc2)C1 ZINC000246852731 1012055692 /nfs/dbraw/zinc/05/56/92/1012055692.db2.gz CQGWGMKBZXIAOL-QFBILLFUSA-N 2 1 303.494 3.525 20 10 DHCDMP CCN(CC)c1ccc(C[NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)cc1F ZINC000858133383 1032778172 /nfs/dbraw/zinc/77/81/72/1032778172.db2.gz UQDAQQALKHIIAC-INIZCTEOSA-N 2 1 321.484 3.634 20 10 DHCDMP CCN(CC)c1ccc(C[NH2+][C@H]2CC[N@@H+](C)C(C)(C)C2)cc1F ZINC000858133383 1032778176 /nfs/dbraw/zinc/77/81/76/1032778176.db2.gz UQDAQQALKHIIAC-INIZCTEOSA-N 2 1 321.484 3.634 20 10 DHCDMP COc1ccc(C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1C ZINC000310077283 1020316272 /nfs/dbraw/zinc/31/62/72/1020316272.db2.gz GZOIOGRGQIPGAD-HXUWFJFHSA-N 2 1 324.468 3.615 20 10 DHCDMP CC[C@@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1ccc(F)cc1O ZINC000850585465 1021625112 /nfs/dbraw/zinc/62/51/12/1021625112.db2.gz WXWDKMKELQPKPQ-GOSISDBHSA-N 2 1 320.452 3.694 20 10 DHCDMP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2O)CC[N@@H+]1Cc1ccccc1 ZINC000379646478 1021656579 /nfs/dbraw/zinc/65/65/79/1021656579.db2.gz JEYVYTQYAOOPBX-VQIMIIECSA-N 2 1 310.441 3.535 20 10 DHCDMP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2O)CC[N@H+]1Cc1ccccc1 ZINC000379646478 1021656590 /nfs/dbraw/zinc/65/65/90/1021656590.db2.gz JEYVYTQYAOOPBX-VQIMIIECSA-N 2 1 310.441 3.535 20 10 DHCDMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1cc(Cl)ccc1O ZINC000853240648 1022242878 /nfs/dbraw/zinc/24/28/78/1022242878.db2.gz QDXZMNFFNPOUGO-HIFRSBDPSA-N 2 1 322.880 3.818 20 10 DHCDMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cccc(C)c2O)CC1 ZINC000179685172 1022509303 /nfs/dbraw/zinc/50/93/03/1022509303.db2.gz IOMVIKFUVFTIKU-UHFFFAOYSA-N 2 1 304.478 3.645 20 10 DHCDMP C[N@@H+](CC[C@H]1CCC[NH+]1C)Cc1ccc(N2CCCCC2)cc1 ZINC000767357903 1022695676 /nfs/dbraw/zinc/69/56/76/1022695676.db2.gz BXKQLHOJTSCFRV-LJQANCHMSA-N 2 1 315.505 3.593 20 10 DHCDMP C[NH+](CC[C@H]1CCC[N@@H+]1C)Cc1ccc(N2CCCCC2)cc1 ZINC000767357903 1022695679 /nfs/dbraw/zinc/69/56/79/1022695679.db2.gz BXKQLHOJTSCFRV-LJQANCHMSA-N 2 1 315.505 3.593 20 10 DHCDMP C[NH+](CC[C@H]1CCC[N@H+]1C)Cc1ccc(N2CCCCC2)cc1 ZINC000767357903 1022695682 /nfs/dbraw/zinc/69/56/82/1022695682.db2.gz BXKQLHOJTSCFRV-LJQANCHMSA-N 2 1 315.505 3.593 20 10 DHCDMP Cc1ccc(O)c(C[NH2+]C[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000310064376 1022747214 /nfs/dbraw/zinc/74/72/14/1022747214.db2.gz AVIFGOQPUXUFRU-NRFANRHFSA-N 2 1 324.468 3.702 20 10 DHCDMP C[C@@H]1CC[C@H]([NH2+]C2CC[NH+](Cc3ccccc3O)CC2)C[C@H]1C ZINC001172367582 1033146097 /nfs/dbraw/zinc/14/60/97/1033146097.db2.gz GRQVRGBHXYSNJV-MDZRGWNJSA-N 2 1 316.489 3.771 20 10 DHCDMP CCN(C)c1ccc([C@H](C)[NH2+]CCCCn2cc[nH+]c2C)cc1 ZINC000164608637 1023807845 /nfs/dbraw/zinc/80/78/45/1023807845.db2.gz YAMWKFBYTVKIDD-INIZCTEOSA-N 2 1 314.477 3.779 20 10 DHCDMP CC[C@@H]([NH2+]CCCCn1cc[nH+]c1C)c1ccc(N(C)C)cc1 ZINC000164646280 1023822698 /nfs/dbraw/zinc/82/26/98/1023822698.db2.gz ZYPCSGSTPVABNR-LJQANCHMSA-N 2 1 314.477 3.779 20 10 DHCDMP Cc1cccc(O)c1C[NH2+]Cc1ccccc1C[N@H+](C)C(C)C ZINC000877145324 1033256760 /nfs/dbraw/zinc/25/67/60/1033256760.db2.gz FODPYUBHRYYZLK-UHFFFAOYSA-N 2 1 312.457 3.831 20 10 DHCDMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000808677860 1026355426 /nfs/dbraw/zinc/35/54/26/1026355426.db2.gz GADSKKBGVBXPGY-LBPRGKRZSA-N 2 1 307.825 3.600 20 10 DHCDMP Cc1cc(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)ccc1N(C)C ZINC000815037671 1028339684 /nfs/dbraw/zinc/33/96/84/1028339684.db2.gz RVZHWMNKBYOAJT-UHFFFAOYSA-N 2 1 317.521 3.613 20 10 DHCDMP C[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1cc(Cl)c(Cl)cc1O ZINC000817966415 1029303281 /nfs/dbraw/zinc/30/32/81/1029303281.db2.gz NGWZLEPMHFMAGO-MEBBXXQBSA-N 2 1 317.260 3.739 20 10 DHCDMP CC[NH2+][C@H](C)C[NH2+][C@H](CCc1ccccc1)c1ccccc1O ZINC000817972932 1029311461 /nfs/dbraw/zinc/31/14/61/1029311461.db2.gz QCWDXWJBNQWZJN-VQIMIIECSA-N 2 1 312.457 3.654 20 10 DHCDMP C[NH+](C)C1(C)CCC([NH2+]Cc2c(O)ccc(Cl)c2F)CC1 ZINC000865765387 1030013460 /nfs/dbraw/zinc/01/34/60/1030013460.db2.gz SPIDRYUPHOMXJX-UHFFFAOYSA-N 2 1 314.832 3.537 20 10 DHCDMP C[C@@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1ccc(Cl)cc1O ZINC000866516856 1030341773 /nfs/dbraw/zinc/34/17/73/1030341773.db2.gz DGUFACAKXXBYQM-RFSCMCKOSA-N 2 1 310.869 3.959 20 10 DHCDMP CCC[N@@H+](C)C[C@H]1CCN(Cc2cc(Cl)c(C)cc2O)C1 ZINC000824888544 1030667606 /nfs/dbraw/zinc/66/76/06/1030667606.db2.gz FZEIQLCRRJANHG-CQSZACIVSA-N 2 1 310.869 3.518 20 10 DHCDMP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2cc(Cl)c(C)cc2O)C1 ZINC000824888544 1030667614 /nfs/dbraw/zinc/66/76/14/1030667614.db2.gz FZEIQLCRRJANHG-CQSZACIVSA-N 2 1 310.869 3.518 20 10 DHCDMP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2cc(Cl)c(C)cc2O)C1 ZINC000824888544 1030667622 /nfs/dbraw/zinc/66/76/22/1030667622.db2.gz FZEIQLCRRJANHG-CQSZACIVSA-N 2 1 310.869 3.518 20 10 DHCDMP [NH3+][C@@H](C[C@@H]1CCC[N@@H+](Cc2ccccc2O)C1)C1CCCC1 ZINC000873231715 1031767673 /nfs/dbraw/zinc/76/76/73/1031767673.db2.gz AYHVQWAPMROUGP-YJBOKZPZSA-N 2 1 302.462 3.512 20 10 DHCDMP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000173450074 1040290488 /nfs/dbraw/zinc/29/04/88/1040290488.db2.gz VAZNHQWUSJSBSD-QGZVFWFLSA-N 2 1 318.505 3.988 20 10 DHCDMP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000173450074 1040290501 /nfs/dbraw/zinc/29/05/01/1040290501.db2.gz VAZNHQWUSJSBSD-QGZVFWFLSA-N 2 1 318.505 3.988 20 10 DHCDMP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000173450074 1040290517 /nfs/dbraw/zinc/29/05/17/1040290517.db2.gz VAZNHQWUSJSBSD-QGZVFWFLSA-N 2 1 318.505 3.988 20 10 DHCDMP C[C@H]([NH2+]C1CC[NH+](C)CC1)c1ccc(N2CCCCCC2)cc1 ZINC000161496699 525292402 /nfs/dbraw/zinc/29/24/02/525292402.db2.gz YIYHWTIOPYNGTE-KRWDZBQOSA-N 2 1 315.505 3.812 20 10 DHCDMP Oc1ccc2ccccc2c1C[N@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001204741898 1013311440 /nfs/dbraw/zinc/31/14/40/1013311440.db2.gz FDIWZJUCZRIATK-UHFFFAOYSA-N 2 1 310.441 3.511 20 10 DHCDMP C[NH+](C)[C@H]1CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000277329131 1016206865 /nfs/dbraw/zinc/20/68/65/1016206865.db2.gz CNQWGUKYTDGPGN-IBGZPJMESA-N 2 1 315.505 3.593 20 10 DHCDMP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1ccc(F)cc1O ZINC000185033868 1016524171 /nfs/dbraw/zinc/52/41/71/1016524171.db2.gz SFEYHNRYNCQKNB-GJZGRUSLSA-N 2 1 308.441 3.837 20 10 DHCDMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1ccc(F)cc1O ZINC000185033868 1016524181 /nfs/dbraw/zinc/52/41/81/1016524181.db2.gz SFEYHNRYNCQKNB-GJZGRUSLSA-N 2 1 308.441 3.837 20 10 DHCDMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)C1 ZINC000185112529 1016577443 /nfs/dbraw/zinc/57/74/43/1016577443.db2.gz WGGGPJPFQKLBOA-HOTGVXAUSA-N 2 1 316.489 3.654 20 10 DHCDMP c1cc2c(cc1C[NH2+]C1CC[NH+](C3CCCC3)CC1)CCCO2 ZINC000921816178 1018899614 /nfs/dbraw/zinc/89/96/14/1018899614.db2.gz NADHKIJKRGTKPE-UHFFFAOYSA-N 2 1 314.473 3.508 20 10 DHCDMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000766167141 1019098882 /nfs/dbraw/zinc/09/88/82/1019098882.db2.gz SFNBUTQWFHCCRZ-JENIJYKNSA-N 2 1 315.505 3.810 20 10 DHCDMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000766167141 1019098898 /nfs/dbraw/zinc/09/88/98/1019098898.db2.gz SFNBUTQWFHCCRZ-JENIJYKNSA-N 2 1 315.505 3.810 20 10 DHCDMP CCCN(CCC)c1ccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000742374848 1021114020 /nfs/dbraw/zinc/11/40/20/1021114020.db2.gz IBRRLGJRAYCAFI-IEBWSBKVSA-N 2 1 317.521 3.885 20 10 DHCDMP Cc1cc(C[NH2+]C2CC[NH+](C)CC2)c(C)n1-c1cccc(C)c1 ZINC000743644074 1021336968 /nfs/dbraw/zinc/33/69/68/1021336968.db2.gz ACVWUCJRDQNHRS-UHFFFAOYSA-N 2 1 311.473 3.586 20 10 DHCDMP CC[C@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1ccc(F)cc1O ZINC000850585467 1021624137 /nfs/dbraw/zinc/62/41/37/1021624137.db2.gz WXWDKMKELQPKPQ-SFHVURJKSA-N 2 1 320.452 3.694 20 10 DHCDMP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1ccc(Cl)cc1O ZINC000853239125 1022239604 /nfs/dbraw/zinc/23/96/04/1022239604.db2.gz AKDOHSUEZDQAOY-UKRRQHHQSA-N 2 1 322.880 3.818 20 10 DHCDMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(Cl)cc1O ZINC000853239125 1022239614 /nfs/dbraw/zinc/23/96/14/1022239614.db2.gz AKDOHSUEZDQAOY-UKRRQHHQSA-N 2 1 322.880 3.818 20 10 DHCDMP Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)c(O)c1 ZINC000853239316 1022240912 /nfs/dbraw/zinc/24/09/12/1022240912.db2.gz DYYIFQHJLJRLBQ-WMZOPIPTSA-N 2 1 316.489 3.782 20 10 DHCDMP Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)c(O)c1 ZINC000853239314 1022243071 /nfs/dbraw/zinc/24/30/71/1022243071.db2.gz DYYIFQHJLJRLBQ-FUHWJXTLSA-N 2 1 316.489 3.782 20 10 DHCDMP Cc1cccc(C[NH2+][C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1O ZINC000272670386 1022511529 /nfs/dbraw/zinc/51/15/29/1022511529.db2.gz SVRBYKHLKWPPDE-FXAWDEMLSA-N 2 1 324.468 3.701 20 10 DHCDMP C[C@@H]1C[N@H+](Cc2c(O)ccc(Cl)c2Cl)CCC[C@H]1C[NH3+] ZINC001206022782 1022564306 /nfs/dbraw/zinc/56/43/06/1022564306.db2.gz CTEDRHYTSAZBIT-MNOVXSKESA-N 2 1 317.260 3.506 20 10 DHCDMP C[C@@H]1C[N@@H+](Cc2c(O)ccc(Cl)c2Cl)CCC[C@H]1C[NH3+] ZINC001206022782 1022564322 /nfs/dbraw/zinc/56/43/22/1022564322.db2.gz CTEDRHYTSAZBIT-MNOVXSKESA-N 2 1 317.260 3.506 20 10 DHCDMP Cc1cccc(C[NH+](C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)c1O ZINC000180197005 1022659554 /nfs/dbraw/zinc/65/95/54/1022659554.db2.gz COPWKSNBCSFFEG-LJQANCHMSA-N 2 1 324.468 3.655 20 10 DHCDMP Cc1cccc(C[NH+](C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1O ZINC000180197005 1022659560 /nfs/dbraw/zinc/65/95/60/1022659560.db2.gz COPWKSNBCSFFEG-LJQANCHMSA-N 2 1 324.468 3.655 20 10 DHCDMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2c(O)cccc2Cl)CC1 ZINC000768927152 1023058372 /nfs/dbraw/zinc/05/83/72/1023058372.db2.gz QGWNFJZJYGEKSU-UHFFFAOYSA-N 2 1 310.869 3.598 20 10 DHCDMP C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccccc2O)CC1 ZINC000770505252 1023316023 /nfs/dbraw/zinc/31/60/23/1023316023.db2.gz LWMRZCHGKLVYFA-KRWDZBQOSA-N 2 1 316.489 3.869 20 10 DHCDMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc2ccccc2c1O ZINC000193508371 1024162652 /nfs/dbraw/zinc/16/26/52/1024162652.db2.gz ZWZUKRKGZRJANU-GJZGRUSLSA-N 2 1 310.441 3.680 20 10 DHCDMP Cc1ccc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c(O)c1 ZINC000876980293 1033197621 /nfs/dbraw/zinc/19/76/21/1033197621.db2.gz CJVBIJZZCWZXLT-UHFFFAOYSA-N 2 1 312.457 3.831 20 10 DHCDMP Oc1ccccc1C[NH2+][C@@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000876995798 1033201205 /nfs/dbraw/zinc/20/12/05/1033201205.db2.gz INEBUDSZZBJINK-UYAOXDASSA-N 2 1 322.452 3.850 20 10 DHCDMP Oc1ccccc1C[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000876995798 1033201221 /nfs/dbraw/zinc/20/12/21/1033201221.db2.gz INEBUDSZZBJINK-UYAOXDASSA-N 2 1 322.452 3.850 20 10 DHCDMP Cc1cc(O)c(C[N@@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)cc1Cl ZINC000825927632 1033203340 /nfs/dbraw/zinc/20/33/40/1033203340.db2.gz GWPHRJMJQNYORG-OAHLLOKOSA-N 2 1 322.880 3.518 20 10 DHCDMP Cc1ccc(O)c(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c1 ZINC000113329478 1024796744 /nfs/dbraw/zinc/79/67/44/1024796744.db2.gz DKBBXAVKNLQDNT-UHFFFAOYSA-N 2 1 312.457 3.831 20 10 DHCDMP Cc1cc(C[NH+]2CC[C@]3(CC[N@H+](C)C3)C2)c(O)c(C(C)(C)C)c1 ZINC000793769278 1025159454 /nfs/dbraw/zinc/15/94/54/1025159454.db2.gz UFWHHEPMJNXRJN-FQEVSTJZSA-N 2 1 316.489 3.526 20 10 DHCDMP Cc1cc(C[N@H+]2CC[C@]3(CC[NH+](C)C3)C2)c(O)c(C(C)(C)C)c1 ZINC000793769278 1025159456 /nfs/dbraw/zinc/15/94/56/1025159456.db2.gz UFWHHEPMJNXRJN-FQEVSTJZSA-N 2 1 316.489 3.526 20 10 DHCDMP Cc1cc(C[N@@H+]2CC[C@]3(CC[NH+](C)C3)C2)c(O)c(C(C)(C)C)c1 ZINC000793769278 1025159473 /nfs/dbraw/zinc/15/94/73/1025159473.db2.gz UFWHHEPMJNXRJN-FQEVSTJZSA-N 2 1 316.489 3.526 20 10 DHCDMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000808691753 1026350528 /nfs/dbraw/zinc/35/05/28/1026350528.db2.gz NOMVWYGIKQZCIT-DGCLKSJQSA-N 2 1 321.852 3.846 20 10 DHCDMP Cc1cc(C)c([C@H](C)[NH2+]CCC[N@H+]2CCCC[C@H]2C)c(O)c1 ZINC000815555452 1028540291 /nfs/dbraw/zinc/54/02/91/1028540291.db2.gz ZUZWZQCGQQMVIC-SJORKVTESA-N 2 1 304.478 3.924 20 10 DHCDMP CC[C@@H]([NH2+]Cc1ccc([C@@H](C)[NH3+])cc1)c1ccc(F)cc1O ZINC000817962150 1029302529 /nfs/dbraw/zinc/30/25/29/1029302529.db2.gz GMNHXLOFOOBYAY-SJKOYZFVSA-N 2 1 302.393 3.792 20 10 DHCDMP C[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1cc(Cl)c(Cl)cc1O ZINC000817966416 1029304166 /nfs/dbraw/zinc/30/41/66/1029304166.db2.gz NGWZLEPMHFMAGO-ZUZCIYMTSA-N 2 1 317.260 3.739 20 10 DHCDMP Cc1cc(O)c(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc1Cl ZINC000824850294 1030655152 /nfs/dbraw/zinc/65/51/52/1030655152.db2.gz KUSLTZOYYRJXLQ-INIZCTEOSA-N 2 1 322.880 3.804 20 10 DHCDMP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2cc(Cl)c(C)cc2O)C1 ZINC000824870867 1030668745 /nfs/dbraw/zinc/66/87/45/1030668745.db2.gz YGBLHAZGSNDESV-AWEZNQCLSA-N 2 1 310.869 3.518 20 10 DHCDMP COc1cccc([C@@H](C)[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)c1O ZINC000846140473 1031901088 /nfs/dbraw/zinc/90/10/88/1031901088.db2.gz UDAWZGXIPMKFBP-JKSUJKDBSA-N 2 1 320.477 3.564 20 10 DHCDMP CC[C@@H]1CC[C@H]([NH2+]C2CC[NH+](Cc3ccccc3O)CC2)C1 ZINC001173270833 1033639933 /nfs/dbraw/zinc/63/99/33/1033639933.db2.gz CVEDZPZUSDAAQF-QAPCUYQASA-N 2 1 302.462 3.525 20 10 DHCDMP CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H](C)Cn2cc[nH+]c2C)cc1 ZINC000178697699 1034258302 /nfs/dbraw/zinc/25/83/02/1034258302.db2.gz LQIIEALQYNTGLX-CVEARBPZSA-N 2 1 314.477 3.635 20 10 DHCDMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccc1O ZINC000183489436 1034391566 /nfs/dbraw/zinc/39/15/66/1034391566.db2.gz ORJRQQWXVNRLON-HKUYNNGSSA-N 2 1 324.468 3.607 20 10 DHCDMP CCc1cccc(C[N@H+]2CCCC[C@H]2[C@H](C)C[NH+](C)C)c1O ZINC001183065920 1036516315 /nfs/dbraw/zinc/51/63/15/1036516315.db2.gz ROOGWVNLMYNYPT-QAPCUYQASA-N 2 1 304.478 3.507 20 10 DHCDMP Cc1cc(Cl)cc(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c1O ZINC000775720244 1036545847 /nfs/dbraw/zinc/54/58/47/1036545847.db2.gz JPURWHKIGBBOII-OAHLLOKOSA-N 2 1 322.880 3.662 20 10 DHCDMP Cc1cc(Cl)cc(C[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c1O ZINC000775720244 1036545853 /nfs/dbraw/zinc/54/58/53/1036545853.db2.gz JPURWHKIGBBOII-OAHLLOKOSA-N 2 1 322.880 3.662 20 10 DHCDMP Oc1ccc2ccccc2c1C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000153457321 1036602314 /nfs/dbraw/zinc/60/23/14/1036602314.db2.gz GCUNUSFFCDOXTK-GOSISDBHSA-N 2 1 324.468 3.996 20 10 DHCDMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(N(C)CC)cc2)C1 ZINC000151103832 1037725163 /nfs/dbraw/zinc/72/51/63/1037725163.db2.gz SAIAEUPVMFVMIS-IRXDYDNUSA-N 2 1 303.494 3.525 20 10 DHCDMP CC[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cc(Cl)ccc1O ZINC000775487048 1038553346 /nfs/dbraw/zinc/55/33/46/1038553346.db2.gz GYLJACKXCOJFIO-YCPHGPKFSA-N 2 1 308.853 3.713 20 10 DHCDMP CC[C@@H]([NH2+]CCC[N@@H+]1CCc2ccccc2C1)c1ccccc1O ZINC000775488326 1038562589 /nfs/dbraw/zinc/56/25/89/1038562589.db2.gz REXALGBPOLGNKB-HXUWFJFHSA-N 2 1 324.468 3.881 20 10 DHCDMP CC[C@@H]([NH2+]CCC[N@H+]1CCc2ccccc2C1)c1ccccc1O ZINC000775488326 1038562596 /nfs/dbraw/zinc/56/25/96/1038562596.db2.gz REXALGBPOLGNKB-HXUWFJFHSA-N 2 1 324.468 3.881 20 10 DHCDMP Oc1ccc2ccccc2c1C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000172957628 1040121275 /nfs/dbraw/zinc/12/12/75/1040121275.db2.gz LUNHJHCQIKCIEX-QGZVFWFLSA-N 2 1 324.468 3.853 20 10 DHCDMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000273563045 130137150 /nfs/dbraw/zinc/13/71/50/130137150.db2.gz ISEUGNVRSCYXPA-WFASDCNBSA-N 2 1 301.434 3.501 20 10 DHCDMP Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)c1 ZINC000186142422 1017930559 /nfs/dbraw/zinc/93/05/59/1017930559.db2.gz PONLVZHBYGYQKW-SJORKVTESA-N 2 1 304.478 3.719 20 10 DHCDMP CC[NH+]1CCC([N@H+](C)Cc2cccc(C(C)(C)C)c2O)CC1 ZINC001143110527 1019391034 /nfs/dbraw/zinc/39/10/34/1019391034.db2.gz IFARIQGMBIJPNS-UHFFFAOYSA-N 2 1 304.478 3.606 20 10 DHCDMP CC[NH+]1CCC([N@@H+](C)Cc2cccc(C(C)(C)C)c2O)CC1 ZINC001143110527 1019391045 /nfs/dbraw/zinc/39/10/45/1019391045.db2.gz IFARIQGMBIJPNS-UHFFFAOYSA-N 2 1 304.478 3.606 20 10 DHCDMP Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@@H]2CCCC[N@@H+](C)C2)c1O ZINC000858492355 1032921569 /nfs/dbraw/zinc/92/15/69/1032921569.db2.gz WHQKTKQSSYLCOH-KGLIPLIRSA-N 2 1 310.869 3.737 20 10 DHCDMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cc(C)c(C)cc2O)CC1 ZINC000738067331 1020858044 /nfs/dbraw/zinc/85/80/44/1020858044.db2.gz LEAHONMGGSSQPV-UHFFFAOYSA-N 2 1 318.505 3.953 20 10 DHCDMP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1ccc(N(C)C)cc1 ZINC000125856028 1033004121 /nfs/dbraw/zinc/00/41/21/1033004121.db2.gz KERPWVGPRIZUMR-XLIONFOSSA-N 2 1 317.521 3.914 20 10 DHCDMP CC[N@H+](Cc1ccc(N(C)C)cc1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172123369 1033025229 /nfs/dbraw/zinc/02/52/29/1033025229.db2.gz CDHVWGIBXKFYBU-PMOLBWCYSA-N 2 1 315.505 3.590 20 10 DHCDMP CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172123369 1033025243 /nfs/dbraw/zinc/02/52/43/1033025243.db2.gz CDHVWGIBXKFYBU-PMOLBWCYSA-N 2 1 315.505 3.590 20 10 DHCDMP CC[NH+](Cc1ccc(N(C)C)cc1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172123369 1033025258 /nfs/dbraw/zinc/02/52/58/1033025258.db2.gz CDHVWGIBXKFYBU-PMOLBWCYSA-N 2 1 315.505 3.590 20 10 DHCDMP CC[NH+](Cc1ccc(N(C)C)cc1)[C@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172123369 1033025266 /nfs/dbraw/zinc/02/52/66/1033025266.db2.gz CDHVWGIBXKFYBU-PMOLBWCYSA-N 2 1 315.505 3.590 20 10 DHCDMP C[NH+](C)[C@H]1CCC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)CC1 ZINC000763617004 1022125465 /nfs/dbraw/zinc/12/54/65/1022125465.db2.gz UMHXGFQOUKYQRJ-FQEVSTJZSA-N 2 1 324.468 3.975 20 10 DHCDMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cc(Cl)ccc2O)CC1 ZINC000768304470 1022942936 /nfs/dbraw/zinc/94/29/36/1022942936.db2.gz WQNNECYWPOOOLJ-UHFFFAOYSA-N 2 1 324.896 3.990 20 10 DHCDMP Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)c(O)c1 ZINC000788593631 1023910209 /nfs/dbraw/zinc/91/02/09/1023910209.db2.gz HBMCAVCKAKOKCM-SJORKVTESA-N 2 1 304.478 3.780 20 10 DHCDMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000808677859 1026355992 /nfs/dbraw/zinc/35/59/92/1026355992.db2.gz GADSKKBGVBXPGY-GFCCVEGCSA-N 2 1 307.825 3.600 20 10 DHCDMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000295814430 1027442381 /nfs/dbraw/zinc/44/23/81/1027442381.db2.gz CYTPILNWDMNZSH-NVXWUHKLSA-N 2 1 302.462 3.624 20 10 DHCDMP Cc1cc(C)c([C@@H](C)[NH2+]CCC[N@H+]2CCCC[C@@H]2C)c(O)c1 ZINC000815555449 1028539218 /nfs/dbraw/zinc/53/92/18/1028539218.db2.gz ZUZWZQCGQQMVIC-DLBZAZTESA-N 2 1 304.478 3.924 20 10 DHCDMP C[C@@H]([NH2+][C@@H]1CCCC[C@H]1[NH3+])c1ccc(N2CCCCC2)c(F)c1 ZINC000818618924 1029421899 /nfs/dbraw/zinc/42/18/99/1029421899.db2.gz UUEMRBBUACRHSA-ZTFGCOKTSA-N 2 1 319.468 3.737 20 10 DHCDMP C[N@@H+](CCCCCC[NH3+])Cc1ccc(N2CCCCC2)cc1 ZINC000846222634 1031934121 /nfs/dbraw/zinc/93/41/21/1031934121.db2.gz WPLRCXZDNUUGTG-UHFFFAOYSA-N 2 1 303.494 3.628 20 10 DHCDMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1O ZINC000195134654 1035414846 /nfs/dbraw/zinc/41/48/46/1035414846.db2.gz XPGHJKOOTMZXDK-WMZOPIPTSA-N 2 1 310.441 3.565 20 10 DHCDMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000273563039 130137599 /nfs/dbraw/zinc/13/75/99/130137599.db2.gz ISEUGNVRSCYXPA-DOMZBBRYSA-N 2 1 301.434 3.501 20 10 DHCDMP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cccc(Cl)c1[O-] ZINC000287319315 131275272 /nfs/dbraw/zinc/27/52/72/131275272.db2.gz DIEPMFUUKGWGBT-LRDDRELGSA-N 2 1 308.853 3.571 20 10 DHCDMP CC[C@H]([NH2+]C[C@@H]1CCN(C2CC2)C1)c1cccc(Cl)c1[O-] ZINC000287319315 131275273 /nfs/dbraw/zinc/27/52/73/131275273.db2.gz DIEPMFUUKGWGBT-LRDDRELGSA-N 2 1 308.853 3.571 20 10 DHCDMP CN(C)c1ccc(C[NH2+]C[C@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)cc1 ZINC000377757674 337060184 /nfs/dbraw/zinc/06/01/84/337060184.db2.gz AIZJDMGEGGNQFS-TZIWHRDSSA-N 2 1 323.484 3.535 20 10 DHCDMP CC[N@@H+](Cc1ccccc1O)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171642882 1032840286 /nfs/dbraw/zinc/84/02/86/1032840286.db2.gz ODJDSEZHIKCHAR-UHFFFAOYSA-N 2 1 304.478 3.866 20 10 DHCDMP CC[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1cc(Cl)ccc1O ZINC000858490706 1032918259 /nfs/dbraw/zinc/91/82/59/1032918259.db2.gz MHSJNFYLBHJNGX-XJKSGUPXSA-N 2 1 310.869 3.818 20 10 DHCDMP CC[N@H+](Cc1ccc(N(C)C)cc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172123368 1033023126 /nfs/dbraw/zinc/02/31/26/1033023126.db2.gz CDHVWGIBXKFYBU-ACDBMABISA-N 2 1 315.505 3.590 20 10 DHCDMP CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172123368 1033023140 /nfs/dbraw/zinc/02/31/40/1033023140.db2.gz CDHVWGIBXKFYBU-ACDBMABISA-N 2 1 315.505 3.590 20 10 DHCDMP CC[NH+](Cc1ccc(N(C)C)cc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172123368 1033023154 /nfs/dbraw/zinc/02/31/54/1033023154.db2.gz CDHVWGIBXKFYBU-ACDBMABISA-N 2 1 315.505 3.590 20 10 DHCDMP CC[NH+](Cc1ccc(N(C)C)cc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC001172123368 1033023163 /nfs/dbraw/zinc/02/31/63/1033023163.db2.gz CDHVWGIBXKFYBU-ACDBMABISA-N 2 1 315.505 3.590 20 10 DHCDMP C[N@H+]1CCC[C@@H]1CC[NH+](Cc1ccccc1O)C1CCCC1 ZINC000767396347 1022710978 /nfs/dbraw/zinc/71/09/78/1022710978.db2.gz DKQXMMBWSNZKMS-QGZVFWFLSA-N 2 1 302.462 3.621 20 10 DHCDMP C[NH+]1CCC[C@@H]1CC[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000767396347 1022710988 /nfs/dbraw/zinc/71/09/88/1022710988.db2.gz DKQXMMBWSNZKMS-QGZVFWFLSA-N 2 1 302.462 3.621 20 10 DHCDMP C[NH+]1CCC[C@@H]1CC[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000767396347 1022711011 /nfs/dbraw/zinc/71/10/11/1022711011.db2.gz DKQXMMBWSNZKMS-QGZVFWFLSA-N 2 1 302.462 3.621 20 10 DHCDMP CCCN(CCC)c1ccc(C[N@H+]2CC[C@@H](C[NH+](C)C)C2)cc1 ZINC000769405560 1023142828 /nfs/dbraw/zinc/14/28/28/1023142828.db2.gz XTTRUGHCENSYBV-IBGZPJMESA-N 2 1 317.521 3.697 20 10 DHCDMP CCN(CC)c1ccc(C[NH+](C)[C@H]2CC[N@H+](CC)C[C@H]2C)cc1 ZINC000769481888 1023151594 /nfs/dbraw/zinc/15/15/94/1023151594.db2.gz ANRPKFDXLQNIKQ-XLIONFOSSA-N 2 1 317.521 3.695 20 10 DHCDMP CCN(CC)c1ccc(C[NH+](C)[C@H]2CC[N@@H+](CC)C[C@H]2C)cc1 ZINC000769481888 1023151599 /nfs/dbraw/zinc/15/15/99/1023151599.db2.gz ANRPKFDXLQNIKQ-XLIONFOSSA-N 2 1 317.521 3.695 20 10 DHCDMP C[C@@H]1CC[C@@H]([NH2+]C2CC[NH+](Cc3ccccc3O)CC2)C[C@H]1C ZINC001172367580 1033147383 /nfs/dbraw/zinc/14/73/83/1033147383.db2.gz GRQVRGBHXYSNJV-GPMSIDNRSA-N 2 1 316.489 3.771 20 10 DHCDMP CC[NH+](CC)CCC[C@@H](C)[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC001167841663 1024661821 /nfs/dbraw/zinc/66/18/21/1024661821.db2.gz NTUCMWIVGCYBEP-QGZVFWFLSA-N 2 1 305.510 3.695 20 10 DHCDMP Cc1ccc(C[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)c(O)c1 ZINC000877146723 1033257424 /nfs/dbraw/zinc/25/74/24/1033257424.db2.gz ZPJKVIVPDUBFCJ-UHFFFAOYSA-N 2 1 312.457 3.831 20 10 DHCDMP Oc1ccc(F)cc1C[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000779008838 1027771031 /nfs/dbraw/zinc/77/10/31/1027771031.db2.gz ADHMPJPWBYMRAS-INIZCTEOSA-N 2 1 320.452 3.619 20 10 DHCDMP Oc1ccc(F)cc1C[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000779008838 1027771053 /nfs/dbraw/zinc/77/10/53/1027771053.db2.gz ADHMPJPWBYMRAS-INIZCTEOSA-N 2 1 320.452 3.619 20 10 DHCDMP Oc1ccc(F)cc1C[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000779008839 1027772503 /nfs/dbraw/zinc/77/25/03/1027772503.db2.gz ADHMPJPWBYMRAS-MRXNPFEDSA-N 2 1 320.452 3.619 20 10 DHCDMP Oc1ccc(F)cc1C[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000779008839 1027772519 /nfs/dbraw/zinc/77/25/19/1027772519.db2.gz ADHMPJPWBYMRAS-MRXNPFEDSA-N 2 1 320.452 3.619 20 10 DHCDMP Oc1ccc(Cl)c(F)c1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000815151834 1028384174 /nfs/dbraw/zinc/38/41/74/1028384174.db2.gz VBDCPLUANFWZEP-UHFFFAOYSA-N 2 1 314.832 3.540 20 10 DHCDMP CCC[NH2+]CC[NH2+][C@@H](CCc1ccccc1)c1ccccc1O ZINC000817963246 1029300880 /nfs/dbraw/zinc/30/08/80/1029300880.db2.gz SUJBRQNSPJYEDG-IBGZPJMESA-N 2 1 312.457 3.655 20 10 DHCDMP CC(C)[C@H]([NH3+])C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000817959435 1029301711 /nfs/dbraw/zinc/30/17/11/1029301711.db2.gz RGVDXZSNKKNOBE-QFBILLFUSA-N 2 1 303.494 3.701 20 10 DHCDMP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1cc(Cl)c(Cl)cc1O ZINC000817970277 1029311538 /nfs/dbraw/zinc/31/15/38/1029311538.db2.gz QHTXQZVSFWMONS-IVZWLZJFSA-N 2 1 303.233 3.620 20 10 DHCDMP C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1cccc(C(F)(F)F)c1O ZINC000817976766 1029314750 /nfs/dbraw/zinc/31/47/50/1029314750.db2.gz SXFSRLATRDXDKI-WDEREUQCSA-N 2 1 304.356 3.579 20 10 DHCDMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](C)[C@H]1c1cccs1)c1ccccc1O ZINC000374711565 1029442067 /nfs/dbraw/zinc/44/20/67/1029442067.db2.gz RKMNOXSFHVTKSP-SUNYJGFJSA-N 2 1 316.470 3.797 20 10 DHCDMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C)[C@H]1c1cccs1)c1ccccc1O ZINC000374711565 1029442069 /nfs/dbraw/zinc/44/20/69/1029442069.db2.gz RKMNOXSFHVTKSP-SUNYJGFJSA-N 2 1 316.470 3.797 20 10 DHCDMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(Cl)c(C)cc2O)C[C@H]1C ZINC000824855899 1030655757 /nfs/dbraw/zinc/65/57/57/1030655757.db2.gz RVXXFLFFCSWFGE-UKRRQHHQSA-N 2 1 310.869 3.659 20 10 DHCDMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(Cl)c(C)cc2O)C[C@H]1C ZINC000824855899 1030655765 /nfs/dbraw/zinc/65/57/65/1030655765.db2.gz RVXXFLFFCSWFGE-UKRRQHHQSA-N 2 1 310.869 3.659 20 10 DHCDMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(Cl)c(C)cc2O)C[C@H]1C ZINC000824855899 1030655772 /nfs/dbraw/zinc/65/57/72/1030655772.db2.gz RVXXFLFFCSWFGE-UKRRQHHQSA-N 2 1 310.869 3.659 20 10 DHCDMP C[C@H]([NH2+]C1CCC(C)([NH+]2CCC2)CC1)c1ccc(F)cc1O ZINC000927036594 1031046577 /nfs/dbraw/zinc/04/65/77/1031046577.db2.gz DGICBPSYFHTSAY-UQHVZDHRSA-N 2 1 306.425 3.589 20 10 DHCDMP C[C@@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1cc(Cl)c(Cl)cc1O ZINC000873272978 1031785352 /nfs/dbraw/zinc/78/53/52/1031785352.db2.gz XPLWBHCGQZRXPY-VHSXEESVSA-N 2 1 317.260 3.738 20 10 DHCDMP CCC[NH+](CCC)CCC[NH2+]Cc1c(O)cc(C)cc1Cl ZINC001177060991 1035346189 /nfs/dbraw/zinc/34/61/89/1035346189.db2.gz GIFBEBMPKQBEIK-UHFFFAOYSA-N 2 1 312.885 3.956 20 10 DHCDMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(Cl)cc(C)c2O)C[C@@H]1C ZINC000775715931 1036533442 /nfs/dbraw/zinc/53/34/42/1036533442.db2.gz MIHRYYSLKIBPLM-XJKSGUPXSA-N 2 1 310.869 3.659 20 10 DHCDMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(Cl)cc(C)c2O)C[C@@H]1C ZINC000775715931 1036533457 /nfs/dbraw/zinc/53/34/57/1036533457.db2.gz MIHRYYSLKIBPLM-XJKSGUPXSA-N 2 1 310.869 3.659 20 10 DHCDMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(Cl)cc(C)c2O)C[C@@H]1C ZINC000775715931 1036533482 /nfs/dbraw/zinc/53/34/82/1036533482.db2.gz MIHRYYSLKIBPLM-XJKSGUPXSA-N 2 1 310.869 3.659 20 10 DHCDMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](CC)c2ccc(N(C)C)cc2)C1 ZINC000151117904 1037727045 /nfs/dbraw/zinc/72/70/45/1037727045.db2.gz CQGWGMKBZXIAOL-LPHOPBHVSA-N 2 1 303.494 3.525 20 10 DHCDMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000273399778 130117362 /nfs/dbraw/zinc/11/73/62/130117362.db2.gz MUZWCTBDKWFZOB-AWEZNQCLSA-N 2 1 313.445 3.517 20 10 DHCDMP C[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc(F)cc1O ZINC000185634397 333210996 /nfs/dbraw/zinc/21/09/96/333210996.db2.gz BWZWCPMYGZEJKZ-AWEZNQCLSA-N 2 1 320.452 3.979 20 10 DHCDMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CCc2cccc(O)c21 ZINC000295814436 1013190213 /nfs/dbraw/zinc/19/02/13/1013190213.db2.gz CYTPILNWDMNZSH-WBVHZDCISA-N 2 1 302.462 3.624 20 10 DHCDMP CC[C@@H]([NH2+]CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1O ZINC000796675374 1013935074 /nfs/dbraw/zinc/93/50/74/1013935074.db2.gz NSBONVLRJQIRBS-QGZVFWFLSA-N 2 1 308.441 3.694 20 10 DHCDMP Cn1c[nH+]cc1CCC[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000846803723 1032087979 /nfs/dbraw/zinc/08/79/79/1032087979.db2.gz GIDWNWXGEFRPOE-UHFFFAOYSA-N 2 1 313.445 3.503 20 10 DHCDMP Cn1c[nH+]cc1CCC[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000846803723 1032087993 /nfs/dbraw/zinc/08/79/93/1032087993.db2.gz GIDWNWXGEFRPOE-UHFFFAOYSA-N 2 1 313.445 3.503 20 10 DHCDMP CC(C)[NH+]1CCC([NH2+][C@H](C)c2cc3c(cc2O)CCCC3)CC1 ZINC000185881611 1017491698 /nfs/dbraw/zinc/49/16/98/1017491698.db2.gz YMQFPLXQZMASCM-OAHLLOKOSA-N 2 1 316.489 3.794 20 10 DHCDMP Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)c(O)c1 ZINC000186142602 1017932091 /nfs/dbraw/zinc/93/20/91/1017932091.db2.gz JNKRDHQLGAZGTE-IAGOWNOFSA-N 2 1 304.478 3.719 20 10 DHCDMP Cc1cc(C[NH2+]C2CC[NH+](C3CC3)CC2)c(C)n1-c1ccccc1 ZINC000325114404 1017935479 /nfs/dbraw/zinc/93/54/79/1017935479.db2.gz KOWSXDBHKHATPT-UHFFFAOYSA-N 2 1 323.484 3.811 20 10 DHCDMP Cc1cc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)c(C)n1-c1ccccc1 ZINC000325414291 1018469088 /nfs/dbraw/zinc/46/90/88/1018469088.db2.gz UWGNBDZJMYBSKG-TZIWHRDSSA-N 2 1 323.484 3.811 20 10 DHCDMP Cc1cc(O)c(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)cc1C ZINC000738089760 1020860804 /nfs/dbraw/zinc/86/08/04/1020860804.db2.gz LWPNFFOAFGDKGV-UHFFFAOYSA-N 2 1 304.478 3.561 20 10 DHCDMP C[NH+](C)C[C@H]1CC[N@@H+](Cc2cc3oc4ccccc4c3cc2O)C1 ZINC000738225803 1020865643 /nfs/dbraw/zinc/86/56/43/1020865643.db2.gz CZCUMOWYZFVYSB-CQSZACIVSA-N 2 1 324.424 3.675 20 10 DHCDMP C[C@@H]1C[C@H]([NH2+]Cc2cc(-c3ccccc3)ccc2O)CC[N@@H+]1C ZINC000742375629 1021114166 /nfs/dbraw/zinc/11/41/66/1021114166.db2.gz SRFYMWWKYLFNRA-DNVCBOLYSA-N 2 1 310.441 3.632 20 10 DHCDMP C[C@@H]1C[C@H]([NH2+]Cc2cc(-c3ccccc3)ccc2O)CC[N@H+]1C ZINC000742375629 1021114170 /nfs/dbraw/zinc/11/41/70/1021114170.db2.gz SRFYMWWKYLFNRA-DNVCBOLYSA-N 2 1 310.441 3.632 20 10 DHCDMP C[C@H](CC[NH2+][C@H](C)c1ccccc1O)[N@@H+](C)Cc1ccccc1 ZINC000183541069 1022180293 /nfs/dbraw/zinc/18/02/93/1022180293.db2.gz QMDWPXZUOFGKRC-IAGOWNOFSA-N 2 1 312.457 3.953 20 10 DHCDMP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)c(O)c1C ZINC000853239111 1022240470 /nfs/dbraw/zinc/24/04/70/1022240470.db2.gz AFSNOHMGARPHOJ-AEFFLSMTSA-N 2 1 316.489 3.782 20 10 DHCDMP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1ccc(F)cc1O ZINC000853241909 1022241707 /nfs/dbraw/zinc/24/17/07/1022241707.db2.gz YSFTWMVCEBYGTK-QAPCUYQASA-N 2 1 320.452 3.694 20 10 DHCDMP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(F)cc1O ZINC000853241909 1022241715 /nfs/dbraw/zinc/24/17/15/1022241715.db2.gz YSFTWMVCEBYGTK-QAPCUYQASA-N 2 1 320.452 3.694 20 10 DHCDMP CC(C)[C@H]([NH3+])CC[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000854230356 1022436061 /nfs/dbraw/zinc/43/60/61/1022436061.db2.gz NRDWDJAQIKEBPL-TVQRCGJNSA-N 2 1 305.249 3.723 20 10 DHCDMP CC(C)[C@H]([NH3+])CC[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000854230355 1022435799 /nfs/dbraw/zinc/43/57/99/1022435799.db2.gz NRDWDJAQIKEBPL-NOZJJQNGSA-N 2 1 305.249 3.723 20 10 DHCDMP Cc1cccc(C[NH2+][C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1O ZINC000272670389 1022512154 /nfs/dbraw/zinc/51/21/54/1022512154.db2.gz SVRBYKHLKWPPDE-PXNSSMCTSA-N 2 1 324.468 3.701 20 10 DHCDMP CC[C@H](c1ccccc1O)[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000364008377 1022575074 /nfs/dbraw/zinc/57/50/74/1022575074.db2.gz IHUARACTQTVUOU-FUHWJXTLSA-N 2 1 302.462 3.651 20 10 DHCDMP CC[C@H]([NH2+]C[C@H](C)C[NH+]1CCCCC1)c1ccc(F)cc1O ZINC000796696197 1024635699 /nfs/dbraw/zinc/63/56/99/1024635699.db2.gz RWZUYMYNNQYSBD-YOEHRIQHSA-N 2 1 308.441 3.694 20 10 DHCDMP C[C@@H]([NH2+]CCCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccccc1O ZINC000248384037 1025954693 /nfs/dbraw/zinc/95/46/93/1025954693.db2.gz CGZOCYBAKQHYSF-IXDOHACOSA-N 2 1 304.478 3.801 20 10 DHCDMP Oc1ccccc1C[NH2+]C[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000380137712 1027247415 /nfs/dbraw/zinc/24/74/15/1027247415.db2.gz PORMNJYWCYPYTC-IBGZPJMESA-N 2 1 324.468 3.784 20 10 DHCDMP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2ccc3ccccc3c2O)C1 ZINC000816516646 1028917411 /nfs/dbraw/zinc/91/74/11/1028917411.db2.gz LXXQMZSYSJUZAC-KRWDZBQOSA-N 2 1 324.468 3.709 20 10 DHCDMP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816516646 1028917425 /nfs/dbraw/zinc/91/74/25/1028917425.db2.gz LXXQMZSYSJUZAC-KRWDZBQOSA-N 2 1 324.468 3.709 20 10 DHCDMP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816516646 1028917435 /nfs/dbraw/zinc/91/74/35/1028917435.db2.gz LXXQMZSYSJUZAC-KRWDZBQOSA-N 2 1 324.468 3.709 20 10 DHCDMP CC(C)[C@H]([NH3+])C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000817959437 1029300317 /nfs/dbraw/zinc/30/03/17/1029300317.db2.gz RGVDXZSNKKNOBE-VQIMIIECSA-N 2 1 303.494 3.701 20 10 DHCDMP C[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccc(F)cc1O ZINC000817984017 1029322143 /nfs/dbraw/zinc/32/21/43/1029322143.db2.gz UVUMQUJIGBNQIF-SUMWQHHRSA-N 2 1 302.393 3.662 20 10 DHCDMP CC[C@@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1ccc(F)cc1O ZINC000866516468 1030342076 /nfs/dbraw/zinc/34/20/76/1030342076.db2.gz AAOZOUHGPADAHM-BFHRDPOASA-N 2 1 308.441 3.835 20 10 DHCDMP CC[C@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1ccc(F)cc1O ZINC000866516470 1030343188 /nfs/dbraw/zinc/34/31/88/1030343188.db2.gz AAOZOUHGPADAHM-HQVVEAJESA-N 2 1 308.441 3.835 20 10 DHCDMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(Cl)c(C)cc2O)C[C@@H]1C ZINC000824855897 1030654897 /nfs/dbraw/zinc/65/48/97/1030654897.db2.gz RVXXFLFFCSWFGE-DZGCQCFKSA-N 2 1 310.869 3.659 20 10 DHCDMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(Cl)c(C)cc2O)C[C@@H]1C ZINC000824855897 1030654907 /nfs/dbraw/zinc/65/49/07/1030654907.db2.gz RVXXFLFFCSWFGE-DZGCQCFKSA-N 2 1 310.869 3.659 20 10 DHCDMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(Cl)c(C)cc2O)C[C@@H]1C ZINC000824855897 1030654914 /nfs/dbraw/zinc/65/49/14/1030654914.db2.gz RVXXFLFFCSWFGE-DZGCQCFKSA-N 2 1 310.869 3.659 20 10 DHCDMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000293708845 1031580664 /nfs/dbraw/zinc/58/06/64/1031580664.db2.gz LVNCOFJNXFUGAE-UKRRQHHQSA-N 2 1 301.434 3.501 20 10 DHCDMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000293708846 1031581349 /nfs/dbraw/zinc/58/13/49/1031581349.db2.gz LVNCOFJNXFUGAE-ZFWWWQNUSA-N 2 1 301.434 3.501 20 10 DHCDMP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000173427809 1033662259 /nfs/dbraw/zinc/66/22/59/1033662259.db2.gz JBKKBEHUGGUQHU-MRXNPFEDSA-N 2 1 312.457 3.709 20 10 DHCDMP CC[C@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)c1ccc(N(C)C)cc1 ZINC000178701579 1034258432 /nfs/dbraw/zinc/25/84/32/1034258432.db2.gz PYCLSIKHKZGWLN-KXBFYZLASA-N 2 1 314.477 3.635 20 10 DHCDMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cccc(Cl)c2[O-])CC1 ZINC000775652740 1036242169 /nfs/dbraw/zinc/24/21/69/1036242169.db2.gz QFXGBCYXZBJSMX-UHFFFAOYSA-N 2 1 324.896 3.990 20 10 DHCDMP Cc1cc(Cl)cc(C[NH+]2CC[C@H](C[N@H+](C)CC3CC3)C2)c1O ZINC000775726713 1036576908 /nfs/dbraw/zinc/57/69/08/1036576908.db2.gz XPGHGLCLBVPHRN-OAHLLOKOSA-N 2 1 322.880 3.518 20 10 DHCDMP Cc1cc(Cl)cc(C[NH+]2CC[C@H](C[N@@H+](C)CC3CC3)C2)c1O ZINC000775726713 1036576915 /nfs/dbraw/zinc/57/69/15/1036576915.db2.gz XPGHGLCLBVPHRN-OAHLLOKOSA-N 2 1 322.880 3.518 20 10 DHCDMP Cc1cc(Cl)cc(C[N@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)c1O ZINC000775726713 1036576928 /nfs/dbraw/zinc/57/69/28/1036576928.db2.gz XPGHGLCLBVPHRN-OAHLLOKOSA-N 2 1 322.880 3.518 20 10 DHCDMP Cc1cc(Cl)cc(C[N@@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)c1O ZINC000775726713 1036576938 /nfs/dbraw/zinc/57/69/38/1036576938.db2.gz XPGHGLCLBVPHRN-OAHLLOKOSA-N 2 1 322.880 3.518 20 10 DHCDMP Oc1ccc2ccccc2c1C[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000172957634 1040119961 /nfs/dbraw/zinc/11/99/61/1040119961.db2.gz LUNHJHCQIKCIEX-KRWDZBQOSA-N 2 1 324.468 3.853 20 10 DHCDMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@@H]1C)c1cc(F)ccc1O ZINC000185034071 1016523721 /nfs/dbraw/zinc/52/37/21/1016523721.db2.gz IJERLEQERFCPBV-GJZGRUSLSA-N 2 1 308.441 3.837 20 10 DHCDMP CC(C)[NH+]1CCC([NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)CC1 ZINC000185881592 1017491540 /nfs/dbraw/zinc/49/15/40/1017491540.db2.gz YMQFPLXQZMASCM-HNNXBMFYSA-N 2 1 316.489 3.794 20 10 DHCDMP Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)c1 ZINC000186142435 1017930791 /nfs/dbraw/zinc/93/07/91/1017930791.db2.gz PONLVZHBYGYQKW-IRXDYDNUSA-N 2 1 304.478 3.719 20 10 DHCDMP C[C@H]1C[C@@H]([NH+](C)Cc2ccccc2O)CC[N@@H+]1Cc1ccccc1 ZINC000179573380 1020411184 /nfs/dbraw/zinc/41/11/84/1020411184.db2.gz BUTSHQBQXOJHAN-PXNSSMCTSA-N 2 1 324.468 3.877 20 10 DHCDMP C[C@H]1C[C@@H]([NH+](C)Cc2ccccc2O)CC[N@H+]1Cc1ccccc1 ZINC000179573380 1020411188 /nfs/dbraw/zinc/41/11/88/1020411188.db2.gz BUTSHQBQXOJHAN-PXNSSMCTSA-N 2 1 324.468 3.877 20 10 DHCDMP C[C@H]1C[C@@H]([N@H+](C)Cc2ccccc2O)CC[NH+]1Cc1ccccc1 ZINC000179573380 1020411191 /nfs/dbraw/zinc/41/11/91/1020411191.db2.gz BUTSHQBQXOJHAN-PXNSSMCTSA-N 2 1 324.468 3.877 20 10 DHCDMP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccccc2O)CC[NH+]1Cc1ccccc1 ZINC000179573380 1020411195 /nfs/dbraw/zinc/41/11/95/1020411195.db2.gz BUTSHQBQXOJHAN-PXNSSMCTSA-N 2 1 324.468 3.877 20 10 DHCDMP c1c[nH]c([C@@H]2CCC[N@H+](Cc3ccc(N4CCCCC4)cc3)C2)n1 ZINC000092071565 1020735091 /nfs/dbraw/zinc/73/50/91/1020735091.db2.gz UQEIVHNXMUSVAA-GOSISDBHSA-N 2 1 324.472 3.780 20 10 DHCDMP Cc1ccc(O)c(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000080371144 1021464114 /nfs/dbraw/zinc/46/41/14/1021464114.db2.gz PIEVLRYFWVMHRK-XLIONFOSSA-N 2 1 324.468 3.843 20 10 DHCDMP Cc1ccc(O)c(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000080371144 1021464119 /nfs/dbraw/zinc/46/41/19/1021464119.db2.gz PIEVLRYFWVMHRK-XLIONFOSSA-N 2 1 324.468 3.843 20 10 DHCDMP C[C@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1ccc(Cl)cc1O ZINC000850585749 1021625011 /nfs/dbraw/zinc/62/50/11/1021625011.db2.gz ZJGPXDCRMGKOTO-ZDUSSCGKSA-N 2 1 322.880 3.818 20 10 DHCDMP CC[C@H](c1ccccc1O)[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000364008379 1022575551 /nfs/dbraw/zinc/57/55/51/1022575551.db2.gz IHUARACTQTVUOU-SJLPKXTDSA-N 2 1 302.462 3.651 20 10 DHCDMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc2ccccc2c1O ZINC000296599683 1023012859 /nfs/dbraw/zinc/01/28/59/1023012859.db2.gz VMOAWEQRIDSMJR-HZTRTUMWSA-N 2 1 310.441 3.821 20 10 DHCDMP CCN(CC)c1ccc(C[N@@H+](C)[C@@H]2CC[NH+](CC)[C@H](C)C2)cc1 ZINC000769470651 1023161752 /nfs/dbraw/zinc/16/17/52/1023161752.db2.gz NEBXSSDZPTXTAB-YLJYHZDGSA-N 2 1 317.521 3.837 20 10 DHCDMP CCN(CC)c1ccc(C[NH+](C)[C@@H]2CC[N@H+](CC)[C@H](C)C2)cc1 ZINC000769470651 1023161754 /nfs/dbraw/zinc/16/17/54/1023161754.db2.gz NEBXSSDZPTXTAB-YLJYHZDGSA-N 2 1 317.521 3.837 20 10 DHCDMP CCN(CC)c1ccc(C[NH+](C)[C@@H]2CC[N@@H+](CC)[C@H](C)C2)cc1 ZINC000769470651 1023161758 /nfs/dbraw/zinc/16/17/58/1023161758.db2.gz NEBXSSDZPTXTAB-YLJYHZDGSA-N 2 1 317.521 3.837 20 10 DHCDMP CC[NH+](CC)CCC[C@H](C)[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC001167841662 1024660928 /nfs/dbraw/zinc/66/09/28/1024660928.db2.gz NTUCMWIVGCYBEP-KRWDZBQOSA-N 2 1 305.510 3.695 20 10 DHCDMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cc(C)ccc2O)CC1 ZINC000134168760 1025005980 /nfs/dbraw/zinc/00/59/80/1025005980.db2.gz DEWLQWSKKZPPNV-UHFFFAOYSA-N 2 1 304.478 3.645 20 10 DHCDMP Oc1ccccc1C[NH2+]C[C@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000380137739 1027247283 /nfs/dbraw/zinc/24/72/83/1027247283.db2.gz PORMNJYWCYPYTC-LJQANCHMSA-N 2 1 324.468 3.784 20 10 DHCDMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C)[C@H]1c1ccccc1)c1ccccc1O ZINC000368484442 1028361143 /nfs/dbraw/zinc/36/11/43/1028361143.db2.gz YIPIBUJRXOEHSA-VPWXQRGCSA-N 2 1 310.441 3.736 20 10 DHCDMP CC[C@@H]([NH2+]CCCCC[NH+]1CCCC1)c1ccc(F)cc1O ZINC000815647649 1028592845 /nfs/dbraw/zinc/59/28/45/1028592845.db2.gz QPNFQOKXDIHSDB-QGZVFWFLSA-N 2 1 308.441 3.838 20 10 DHCDMP Cc1[nH+]ccn1CCCC[NH2+]Cc1ccc2ccccc2c1O ZINC000816553342 1028942318 /nfs/dbraw/zinc/94/23/18/1028942318.db2.gz RKHSMMZDGHQKST-UHFFFAOYSA-N 2 1 309.413 3.620 20 10 DHCDMP CCN(CC)c1ccc(C[NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)cc1 ZINC000817888600 1029264367 /nfs/dbraw/zinc/26/43/67/1029264367.db2.gz MWKNOEQEWZDMBT-WOJBJXKFSA-N 2 1 309.457 3.767 20 10 DHCDMP C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C[NH3+])c1cccc(C(F)(F)F)c1O ZINC000817960629 1029299438 /nfs/dbraw/zinc/29/94/38/1029299438.db2.gz OLSAWBJGEGWEMR-MISXGVKJSA-N 2 1 316.367 3.579 20 10 DHCDMP CC(C)C[C@@H](C[NH3+])[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000817960486 1029299464 /nfs/dbraw/zinc/29/94/64/1029299464.db2.gz ZQMUFGBUBNACAH-WMZOPIPTSA-N 2 1 303.494 3.701 20 10 DHCDMP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000817976764 1029313522 /nfs/dbraw/zinc/31/35/22/1029313522.db2.gz SXFSRLATRDXDKI-MNOVXSKESA-N 2 1 304.356 3.579 20 10 DHCDMP C[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccc(F)cc1O ZINC000817984015 1029324390 /nfs/dbraw/zinc/32/43/90/1029324390.db2.gz UVUMQUJIGBNQIF-DYVFJYSZSA-N 2 1 302.393 3.662 20 10 DHCDMP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2cc(Cl)c(C)cc2O)C1 ZINC000824870878 1030666937 /nfs/dbraw/zinc/66/69/37/1030666937.db2.gz YGBLHAZGSNDESV-CQSZACIVSA-N 2 1 310.869 3.518 20 10 DHCDMP C[NH+]1CCC([NH2+][C@@H](CCc2ccccc2)c2ccccc2O)CC1 ZINC000293758323 1031606277 /nfs/dbraw/zinc/60/62/77/1031606277.db2.gz OTMVCSIEKSJJNB-FQEVSTJZSA-N 2 1 324.468 3.750 20 10 DHCDMP CCCOc1ccc(C[NH2+]C2CC[NH+](C3CC3)CC2)cc1C ZINC000873009668 1031689945 /nfs/dbraw/zinc/68/99/45/1031689945.db2.gz QVZDZERUGMQXPU-UHFFFAOYSA-N 2 1 302.462 3.500 20 10 DHCDMP [NH3+][C@@H](C[C@H]1CCC[N@@H+](Cc2ccccc2O)C1)C1CCCC1 ZINC000873231714 1031766115 /nfs/dbraw/zinc/76/61/15/1031766115.db2.gz AYHVQWAPMROUGP-QAPCUYQASA-N 2 1 302.462 3.512 20 10 DHCDMP [NH3+][C@H](C[C@@H]1CCC[N@@H+](Cc2ccccc2O)C1)C1CCCC1 ZINC000873231713 1031766727 /nfs/dbraw/zinc/76/67/27/1031766727.db2.gz AYHVQWAPMROUGP-MAUKXSAKSA-N 2 1 302.462 3.512 20 10 DHCDMP C[C@@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1cccc(C(F)(F)F)c1O ZINC000873239220 1031769965 /nfs/dbraw/zinc/76/99/65/1031769965.db2.gz QALBMTIDHMDGKR-IJLUTSLNSA-N 2 1 316.367 3.579 20 10 DHCDMP C[C@@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1cc(Cl)c(Cl)cc1O ZINC000873239076 1031770688 /nfs/dbraw/zinc/77/06/88/1031770688.db2.gz NHGIYOUUHSPSKF-GMTAPVOTSA-N 2 1 317.260 3.867 20 10 DHCDMP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000185352369 1034542497 /nfs/dbraw/zinc/54/24/97/1034542497.db2.gz XJQLPNCVUYJQIN-CQSZACIVSA-N 2 1 316.420 3.834 20 10 DHCDMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(F)cc2O)c1 ZINC000185352369 1034542508 /nfs/dbraw/zinc/54/25/08/1034542508.db2.gz XJQLPNCVUYJQIN-CQSZACIVSA-N 2 1 316.420 3.834 20 10 DHCDMP CCN(CC)c1ccc(C[N@H+](C)CCCn2cc[nH+]c2C)cc1 ZINC000762918856 1037069125 /nfs/dbraw/zinc/06/91/25/1037069125.db2.gz PNIMPLGFVSTGLI-UHFFFAOYSA-N 2 1 314.477 3.560 20 10 DHCDMP CCN(CC)c1ccc(C[N@@H+](C)CCCn2cc[nH+]c2C)cc1 ZINC000762918856 1037069138 /nfs/dbraw/zinc/06/91/38/1037069138.db2.gz PNIMPLGFVSTGLI-UHFFFAOYSA-N 2 1 314.477 3.560 20 10 DHCDMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2[O-])C1 ZINC000192692065 333291555 /nfs/dbraw/zinc/29/15/55/333291555.db2.gz RHBVVYPMMXAXKU-QWRGUYRKSA-N 2 1 317.260 3.691 20 10 DHCDMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1)c1ccc(F)cc1O ZINC000286138802 535804781 /nfs/dbraw/zinc/80/47/81/535804781.db2.gz OUIMVYOLLVCSRO-WMLDXEAASA-N 2 1 308.441 3.692 20 10 DHCDMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1ccc(F)cc1O ZINC000286138802 535804782 /nfs/dbraw/zinc/80/47/82/535804782.db2.gz OUIMVYOLLVCSRO-WMLDXEAASA-N 2 1 308.441 3.692 20 10 DHCDMP CC(C)(C)c1ccc(O)c(C[N@H+]2CCCC3(CC[NH2+]CC3)C2)c1 ZINC001204743030 1013389505 /nfs/dbraw/zinc/38/95/05/1013389505.db2.gz XVUDSCJCJGZYOS-UHFFFAOYSA-N 2 1 316.489 3.655 20 10 DHCDMP Cc1ccc([C@@H](C)[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)c(O)c1 ZINC000185034335 1016524579 /nfs/dbraw/zinc/52/45/79/1016524579.db2.gz HWQSBBHHHOFEOR-DLBZAZTESA-N 2 1 304.478 3.863 20 10 DHCDMP Oc1ccc(-c2ccccc2)cc1C[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000263676193 1032752818 /nfs/dbraw/zinc/75/28/18/1032752818.db2.gz KYDRPKLOZBNLEB-MRXNPFEDSA-N 2 1 322.452 3.633 20 10 DHCDMP C[C@H]([NH2+]CCCCCC[NH3+])c1cccc(C(F)(F)F)c1O ZINC000843340641 1018495372 /nfs/dbraw/zinc/49/53/72/1018495372.db2.gz CWHYLVSEEHQORO-NSHDSACASA-N 2 1 304.356 3.581 20 10 DHCDMP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000743398921 1021283543 /nfs/dbraw/zinc/28/35/43/1021283543.db2.gz OSIXZGQDTSYMCG-MRXNPFEDSA-N 2 1 304.478 3.598 20 10 DHCDMP CC[NH+](C)C[C@H]1CC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000743398921 1021283549 /nfs/dbraw/zinc/28/35/49/1021283549.db2.gz OSIXZGQDTSYMCG-MRXNPFEDSA-N 2 1 304.478 3.598 20 10 DHCDMP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000743398921 1021283558 /nfs/dbraw/zinc/28/35/58/1021283558.db2.gz OSIXZGQDTSYMCG-MRXNPFEDSA-N 2 1 304.478 3.598 20 10 DHCDMP CCN(CC)c1ccc(C[N@@H+]2CCC[C@H]([NH+](C)C)CC2)cc1F ZINC000763603772 1021934698 /nfs/dbraw/zinc/93/46/98/1021934698.db2.gz DAUGWAGDOBXDGA-KRWDZBQOSA-N 2 1 321.484 3.588 20 10 DHCDMP CCN(CC)c1ccc(C[N@H+]2CCC[C@H]([NH+](C)C)CC2)cc1F ZINC000763603772 1021934706 /nfs/dbraw/zinc/93/47/06/1021934706.db2.gz DAUGWAGDOBXDGA-KRWDZBQOSA-N 2 1 321.484 3.588 20 10 DHCDMP CC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(C)cc1O ZINC000853239381 1022242013 /nfs/dbraw/zinc/24/20/13/1022242013.db2.gz GLYHQPVTWIBAHK-IEBWSBKVSA-N 2 1 316.489 3.863 20 10 DHCDMP C[C@@H]([NH2+][C@@H](C)c1ccccc1O)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183723241 1022316332 /nfs/dbraw/zinc/31/63/32/1022316332.db2.gz KLHNBIKETDBICT-OWCLPIDISA-N 2 1 302.462 3.696 20 10 DHCDMP C[C@@H]1C[C@H]([NH+](C)Cc2ccccc2O)CC[N@@H+]1Cc1ccccc1 ZINC000179573347 1022467913 /nfs/dbraw/zinc/46/79/13/1022467913.db2.gz BUTSHQBQXOJHAN-YLJYHZDGSA-N 2 1 324.468 3.877 20 10 DHCDMP C[C@@H]1C[C@H]([NH+](C)Cc2ccccc2O)CC[N@H+]1Cc1ccccc1 ZINC000179573347 1022467925 /nfs/dbraw/zinc/46/79/25/1022467925.db2.gz BUTSHQBQXOJHAN-YLJYHZDGSA-N 2 1 324.468 3.877 20 10 DHCDMP C[C@@H]1C[C@H]([N@H+](C)Cc2ccccc2O)CC[NH+]1Cc1ccccc1 ZINC000179573347 1022467937 /nfs/dbraw/zinc/46/79/37/1022467937.db2.gz BUTSHQBQXOJHAN-YLJYHZDGSA-N 2 1 324.468 3.877 20 10 DHCDMP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccccc2O)CC[NH+]1Cc1ccccc1 ZINC000179573347 1022467942 /nfs/dbraw/zinc/46/79/42/1022467942.db2.gz BUTSHQBQXOJHAN-YLJYHZDGSA-N 2 1 324.468 3.877 20 10 DHCDMP CCC[NH+]1CCC([N@@H+](C)Cc2ccc(N(CC)CC)cc2)CC1 ZINC000768919711 1023055810 /nfs/dbraw/zinc/05/58/10/1023055810.db2.gz AAUVBZLUJVOGTB-UHFFFAOYSA-N 2 1 317.521 3.839 20 10 DHCDMP Cc1cc(C)c([C@@H](C)[NH2+]C2CC([NH+]3CCCCC3)C2)c(O)c1 ZINC000788804509 1023936278 /nfs/dbraw/zinc/93/62/78/1023936278.db2.gz ILXGPZQWJOZIGV-KLAILNCOSA-N 2 1 302.462 3.677 20 10 DHCDMP C[N@H+](Cc1ccccc1)CC1CC[NH+](Cc2ccc(N)cc2)CC1 ZINC000717636408 1024058393 /nfs/dbraw/zinc/05/83/93/1024058393.db2.gz FHWGRAIKJIRSJY-UHFFFAOYSA-N 2 1 323.484 3.613 20 10 DHCDMP CC(C)[N@@H+](C)CCC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000319118349 1025168944 /nfs/dbraw/zinc/16/89/44/1025168944.db2.gz NOIDGKPCWXWIJL-HNNXBMFYSA-N 2 1 300.446 3.926 20 10 DHCDMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cc(Cl)ccc2O)cc1 ZINC000809738375 1026609109 /nfs/dbraw/zinc/60/91/09/1026609109.db2.gz WPJMLPKGGBVFEK-UHFFFAOYSA-N 2 1 318.848 3.739 20 10 DHCDMP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1ccc(C)cc1O ZINC000280243584 1026615769 /nfs/dbraw/zinc/61/57/69/1026615769.db2.gz WDUCVJOAIZEMQY-SJLPKXTDSA-N 2 1 304.478 3.862 20 10 DHCDMP CC[C@@H](c1ccccc1O)[NH+]1CCC([N@H+]2CCC[C@@H]2C)CC1 ZINC000369888349 1028540991 /nfs/dbraw/zinc/54/09/91/1028540991.db2.gz NXKXAQXCVRQQPG-YJBOKZPZSA-N 2 1 302.462 3.792 20 10 DHCDMP Oc1c(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)ccc2ccccc21 ZINC000816513843 1028912110 /nfs/dbraw/zinc/91/21/10/1028912110.db2.gz DMDOJEARIMZYRY-LJQANCHMSA-N 2 1 324.468 3.996 20 10 DHCDMP CC(C)[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc3ccccc3c2O)C1 ZINC000816548391 1028930740 /nfs/dbraw/zinc/93/07/40/1028930740.db2.gz FZXYKWQNBQSHDI-INIZCTEOSA-N 2 1 312.457 3.755 20 10 DHCDMP [NH3+][C@@H]1C[C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)c2ccccc21 ZINC000817900459 1029270729 /nfs/dbraw/zinc/27/07/29/1029270729.db2.gz SRSWYMAMQIVEBU-UXHICEINSA-N 2 1 307.441 3.521 20 10 DHCDMP C[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cc(Cl)c(Cl)cc1O ZINC000817979393 1029317565 /nfs/dbraw/zinc/31/75/65/1029317565.db2.gz AQUGCAUMPXWXAI-GHMZBOCLSA-N 2 1 317.260 3.882 20 10 DHCDMP C[C@@H]([NH2+][C@H](C)C1CC[NH2+]CC1)c1cc(Cl)c(Cl)cc1O ZINC000873270127 1031781839 /nfs/dbraw/zinc/78/18/39/1031781839.db2.gz XPLWBHCGQZRXPY-NXEZZACHSA-N 2 1 317.260 3.738 20 10 DHCDMP CCCN(CCC)c1ccc(C[N@H+]2CC[C@@H]([NH3+])C[C@@H]2C)cc1 ZINC000846699574 1032041929 /nfs/dbraw/zinc/04/19/29/1032041929.db2.gz UTTGPDBGQXHJNO-FUHWJXTLSA-N 2 1 303.494 3.625 20 10 DHCDMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cc(F)ccc2O)c1 ZINC000185352730 1034542228 /nfs/dbraw/zinc/54/22/28/1034542228.db2.gz SURWGZCIALYUKZ-AWEZNQCLSA-N 2 1 316.420 3.834 20 10 DHCDMP Cc1cc(Cl)cc(C[NH+]2CC[C@@H](C[N@H+](C)CC3CC3)C2)c1O ZINC000775726712 1036574806 /nfs/dbraw/zinc/57/48/06/1036574806.db2.gz XPGHGLCLBVPHRN-HNNXBMFYSA-N 2 1 322.880 3.518 20 10 DHCDMP Cc1cc(Cl)cc(C[NH+]2CC[C@@H](C[N@@H+](C)CC3CC3)C2)c1O ZINC000775726712 1036574817 /nfs/dbraw/zinc/57/48/17/1036574817.db2.gz XPGHGLCLBVPHRN-HNNXBMFYSA-N 2 1 322.880 3.518 20 10 DHCDMP Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)c1O ZINC000775726712 1036574821 /nfs/dbraw/zinc/57/48/21/1036574821.db2.gz XPGHGLCLBVPHRN-HNNXBMFYSA-N 2 1 322.880 3.518 20 10 DHCDMP Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)c1O ZINC000775726712 1036574830 /nfs/dbraw/zinc/57/48/30/1036574830.db2.gz XPGHGLCLBVPHRN-HNNXBMFYSA-N 2 1 322.880 3.518 20 10 DHCDMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000158087182 1039941004 /nfs/dbraw/zinc/94/10/04/1039941004.db2.gz KRVCDDOOMYTJJU-ROUUACIJSA-N 2 1 315.505 3.669 20 10 DHCDMP C[C@@H]([NH2+][C@@H](C)c1ccccc1O)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272900408 130072176 /nfs/dbraw/zinc/07/21/76/130072176.db2.gz UZWNTZWZAQVWAO-AOIWGVFYSA-N 2 1 324.468 3.953 20 10 DHCDMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1cc(F)ccc1O ZINC000185034053 1016523060 /nfs/dbraw/zinc/52/30/60/1016523060.db2.gz IJERLEQERFCPBV-CABCVRRESA-N 2 1 308.441 3.837 20 10 DHCDMP Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)c(O)c1 ZINC000186142618 1017931686 /nfs/dbraw/zinc/93/16/86/1017931686.db2.gz JNKRDHQLGAZGTE-DLBZAZTESA-N 2 1 304.478 3.719 20 10 DHCDMP CC[C@@H](C[NH2+][C@H](C)c1ccc(N(C)CC)cc1)[NH+]1CCCC1 ZINC000764868802 1018409180 /nfs/dbraw/zinc/40/91/80/1018409180.db2.gz JBQKSOCVNMNEBZ-AEFFLSMTSA-N 2 1 303.494 3.668 20 10 DHCDMP CC[C@H](C[NH2+][C@@H](CC)c1ccc(N(C)C)cc1)[NH+]1CCCC1 ZINC000764867700 1018410085 /nfs/dbraw/zinc/41/00/85/1018410085.db2.gz CZMPEQSTBDOHCQ-MJGOQNOKSA-N 2 1 303.494 3.668 20 10 DHCDMP CC[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1ccc(N(C)C)cc1 ZINC000858490279 1032917540 /nfs/dbraw/zinc/91/75/40/1032917540.db2.gz DPFBQRRJPXGYFD-QFBILLFUSA-N 2 1 303.494 3.525 20 10 DHCDMP C[C@@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1ccc(Cl)cc1O ZINC000850585748 1021623946 /nfs/dbraw/zinc/62/39/46/1021623946.db2.gz ZJGPXDCRMGKOTO-CYBMUJFWSA-N 2 1 322.880 3.818 20 10 DHCDMP C[N@@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1cc3ccccc3cc1O)C2 ZINC001172116278 1033019596 /nfs/dbraw/zinc/01/95/96/1033019596.db2.gz GOWCPXOMRAQOME-REPLKXPHSA-N 2 1 310.441 3.650 20 10 DHCDMP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1ccc(Cl)cc1O ZINC000853239126 1022238962 /nfs/dbraw/zinc/23/89/62/1022238962.db2.gz AKDOHSUEZDQAOY-ZFWWWQNUSA-N 2 1 322.880 3.818 20 10 DHCDMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(Cl)cc1O ZINC000853239126 1022238971 /nfs/dbraw/zinc/23/89/71/1022238971.db2.gz AKDOHSUEZDQAOY-ZFWWWQNUSA-N 2 1 322.880 3.818 20 10 DHCDMP C[C@H]1C[C@H]([NH+](C)Cc2ccccc2O)CC[N@@H+]1Cc1ccccc1 ZINC000179573356 1022469039 /nfs/dbraw/zinc/46/90/39/1022469039.db2.gz BUTSHQBQXOJHAN-FXAWDEMLSA-N 2 1 324.468 3.877 20 10 DHCDMP C[C@H]1C[C@H]([NH+](C)Cc2ccccc2O)CC[N@H+]1Cc1ccccc1 ZINC000179573356 1022469043 /nfs/dbraw/zinc/46/90/43/1022469043.db2.gz BUTSHQBQXOJHAN-FXAWDEMLSA-N 2 1 324.468 3.877 20 10 DHCDMP C[C@H]1C[C@H]([N@H+](C)Cc2ccccc2O)CC[NH+]1Cc1ccccc1 ZINC000179573356 1022469045 /nfs/dbraw/zinc/46/90/45/1022469045.db2.gz BUTSHQBQXOJHAN-FXAWDEMLSA-N 2 1 324.468 3.877 20 10 DHCDMP C[C@H]1C[C@H]([N@@H+](C)Cc2ccccc2O)CC[NH+]1Cc1ccccc1 ZINC000179573356 1022469050 /nfs/dbraw/zinc/46/90/50/1022469050.db2.gz BUTSHQBQXOJHAN-FXAWDEMLSA-N 2 1 324.468 3.877 20 10 DHCDMP C[N@H+](Cc1ccccc1)CC1CC[NH+](Cc2ccccc2O)CC1 ZINC000179568844 1022472467 /nfs/dbraw/zinc/47/24/67/1022472467.db2.gz VIHHXUCIBOGVIP-UHFFFAOYSA-N 2 1 324.468 3.736 20 10 DHCDMP Cc1cccc(C[N@@H+](C)C2CC[NH+](Cc3ccccc3)CC2)c1O ZINC000180064392 1022629300 /nfs/dbraw/zinc/62/93/00/1022629300.db2.gz JOLBPDHQJHTWPC-UHFFFAOYSA-N 2 1 324.468 3.797 20 10 DHCDMP Cc1cccc(C[N@H+](C)C2CC[NH+](Cc3ccccc3)CC2)c1O ZINC000180064392 1022629309 /nfs/dbraw/zinc/62/93/09/1022629309.db2.gz JOLBPDHQJHTWPC-UHFFFAOYSA-N 2 1 324.468 3.797 20 10 DHCDMP C[C@@H]1CC[C@@H]([NH2+]C2CC[NH+](Cc3ccccc3O)CC2)C[C@@H]1C ZINC001172367581 1033146676 /nfs/dbraw/zinc/14/66/76/1033146676.db2.gz GRQVRGBHXYSNJV-JTDSTZFVSA-N 2 1 316.489 3.771 20 10 DHCDMP Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)c1O ZINC000808678621 1026355071 /nfs/dbraw/zinc/35/50/71/1026355071.db2.gz TWLDZNIPLNJMJJ-CFVMTHIKSA-N 2 1 308.853 3.631 20 10 DHCDMP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1ccc(C)cc1O ZINC000280243578 1026616513 /nfs/dbraw/zinc/61/65/13/1026616513.db2.gz WDUCVJOAIZEMQY-AEFFLSMTSA-N 2 1 304.478 3.862 20 10 DHCDMP C[C@H]([NH2+][C@@H]1CCc2cccc(O)c21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000296294394 1027599821 /nfs/dbraw/zinc/59/98/21/1027599821.db2.gz DFHSPMDFIXJIHW-QILLFSRXSA-N 2 1 314.473 3.622 20 10 DHCDMP C[N@H+](Cc1ccc(N)cc1)CC1CC[NH+](Cc2ccccc2)CC1 ZINC000719894980 1029076870 /nfs/dbraw/zinc/07/68/70/1029076870.db2.gz KGRIUQKRKGXYLC-UHFFFAOYSA-N 2 1 323.484 3.613 20 10 DHCDMP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1cc(Cl)c(Cl)cc1O ZINC000817985438 1029323779 /nfs/dbraw/zinc/32/37/79/1029323779.db2.gz KBQPSUFJVFEQEN-SNVBAGLBSA-N 2 1 315.244 3.659 20 10 DHCDMP Cc1cc(O)c(C[N@@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)cc1Cl ZINC000824894552 1030660596 /nfs/dbraw/zinc/66/05/96/1030660596.db2.gz HOHHWAFXYSRFRZ-HNNXBMFYSA-N 2 1 322.880 3.518 20 10 DHCDMP Cc1cc(O)c(C[NH+]2CC[C@@H](C[N@H+](C)CC3CC3)C2)cc1Cl ZINC000824894552 1030660577 /nfs/dbraw/zinc/66/05/77/1030660577.db2.gz HOHHWAFXYSRFRZ-HNNXBMFYSA-N 2 1 322.880 3.518 20 10 DHCDMP Cc1cc(O)c(C[NH+]2CC[C@@H](C[N@@H+](C)CC3CC3)C2)cc1Cl ZINC000824894552 1030660587 /nfs/dbraw/zinc/66/05/87/1030660587.db2.gz HOHHWAFXYSRFRZ-HNNXBMFYSA-N 2 1 322.880 3.518 20 10 DHCDMP Cc1cc(O)c(C[N@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)cc1Cl ZINC000824894552 1030660589 /nfs/dbraw/zinc/66/05/89/1030660589.db2.gz HOHHWAFXYSRFRZ-HNNXBMFYSA-N 2 1 322.880 3.518 20 10 DHCDMP COc1cccc([C@H](C)[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)c1O ZINC000846140471 1031900529 /nfs/dbraw/zinc/90/05/29/1031900529.db2.gz UDAWZGXIPMKFBP-HOTGVXAUSA-N 2 1 320.477 3.564 20 10 DHCDMP COc1cccc([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)c1O ZINC000846140150 1031900768 /nfs/dbraw/zinc/90/07/68/1031900768.db2.gz HMYBMOBVXBSRQK-CVEARBPZSA-N 2 1 320.477 3.706 20 10 DHCDMP CCN(CC)c1ccc(C[NH+]2CCC([NH2+]C3CCC3)CC2)cc1 ZINC000897986069 1031914734 /nfs/dbraw/zinc/91/47/34/1031914734.db2.gz WAEOCGOMGZIXGA-UHFFFAOYSA-N 2 1 315.505 3.639 20 10 DHCDMP CCCN(CCC)c1ccc(C[N@H+]2CC[C@@H]([NH3+])C[C@H]2C)cc1 ZINC000846699577 1032042505 /nfs/dbraw/zinc/04/25/05/1032042505.db2.gz UTTGPDBGQXHJNO-SJLPKXTDSA-N 2 1 303.494 3.625 20 10 DHCDMP C[C@@H](c1ccccc1)[N@@H+](CCn1ccnc1)Cc1ccccc1O ZINC000176682833 1034103322 /nfs/dbraw/zinc/10/33/22/1034103322.db2.gz TXUJALHWVQABOV-KRWDZBQOSA-N 2 1 321.424 3.852 20 10 DHCDMP C[C@@H]1C[C@H](C)C[N@H+](CCCNCc2c(O)cccc2Cl)C1 ZINC000776005987 1037301108 /nfs/dbraw/zinc/30/11/08/1037301108.db2.gz FRULDVLEYJOUQS-OKILXGFUSA-N 2 1 310.869 3.503 20 10 DHCDMP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+]Cc2c(O)cccc2Cl)C1 ZINC000776005987 1037301120 /nfs/dbraw/zinc/30/11/20/1037301120.db2.gz FRULDVLEYJOUQS-OKILXGFUSA-N 2 1 310.869 3.503 20 10 DHCDMP Cn1ccnc1[C@H]1CCC[N@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000376042175 337025776 /nfs/dbraw/zinc/02/57/76/337025776.db2.gz CGCJIOBAXBXEIC-INIZCTEOSA-N 2 1 321.424 3.659 20 10 DHCDMP Cn1ccnc1[C@H]1CCC[N@@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000376042175 337025777 /nfs/dbraw/zinc/02/57/77/337025777.db2.gz CGCJIOBAXBXEIC-INIZCTEOSA-N 2 1 321.424 3.659 20 10 DHCDMP C[N@H+](CCC[NH2+]Cc1c(O)cccc1Cl)C1CCCCC1 ZINC000083551655 1013985476 /nfs/dbraw/zinc/98/54/76/1013985476.db2.gz RRNHMOPOWSRQCF-UHFFFAOYSA-N 2 1 310.869 3.790 20 10 DHCDMP C[N@@H+](CCC[NH2+]Cc1c(O)cccc1Cl)C1CCCCC1 ZINC000083551655 1013985479 /nfs/dbraw/zinc/98/54/79/1013985479.db2.gz RRNHMOPOWSRQCF-UHFFFAOYSA-N 2 1 310.869 3.790 20 10 DHCDMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccccc1O ZINC000310343176 1014109139 /nfs/dbraw/zinc/10/91/39/1014109139.db2.gz DOXPGVGMLIKNDB-IEBWSBKVSA-N 2 1 324.468 3.955 20 10 DHCDMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1cc(F)ccc1O ZINC000185034441 1016523755 /nfs/dbraw/zinc/52/37/55/1016523755.db2.gz DTFPZPZEZBTXGJ-CABCVRRESA-N 2 1 308.441 3.694 20 10 DHCDMP Cc1ccc(O)c([C@@H](C)[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)c1 ZINC000185034187 1016524746 /nfs/dbraw/zinc/52/47/46/1016524746.db2.gz ITTNGZMGCDTPTN-DLBZAZTESA-N 2 1 304.478 3.863 20 10 DHCDMP Oc1ccccc1C[NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000716648993 1032699775 /nfs/dbraw/zinc/69/97/75/1032699775.db2.gz HBAPZVHYJWPCGU-SXLOBPIMSA-N 2 1 322.452 3.535 20 10 DHCDMP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)cc1F ZINC000858133384 1032778790 /nfs/dbraw/zinc/77/87/90/1032778790.db2.gz UQDAQQALKHIIAC-MRXNPFEDSA-N 2 1 321.484 3.634 20 10 DHCDMP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[N@@H+](C)C(C)(C)C2)cc1F ZINC000858133384 1032778796 /nfs/dbraw/zinc/77/87/96/1032778796.db2.gz UQDAQQALKHIIAC-MRXNPFEDSA-N 2 1 321.484 3.634 20 10 DHCDMP Cc1cc(O)c(C[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc1C(C)C ZINC000739875420 1020919041 /nfs/dbraw/zinc/91/90/41/1020919041.db2.gz JNZFEVWMIDPUFB-QGZVFWFLSA-N 2 1 316.489 3.742 20 10 DHCDMP C[C@H]1C[C@@H]([NH2+]Cc2ccccc2O)CC[N@@H+]1Cc1ccccc1 ZINC000379646475 1021656913 /nfs/dbraw/zinc/65/69/13/1021656913.db2.gz JEYVYTQYAOOPBX-LPHOPBHVSA-N 2 1 310.441 3.535 20 10 DHCDMP C[C@H]1C[C@@H]([NH2+]Cc2ccccc2O)CC[N@H+]1Cc1ccccc1 ZINC000379646475 1021656922 /nfs/dbraw/zinc/65/69/22/1021656922.db2.gz JEYVYTQYAOOPBX-LPHOPBHVSA-N 2 1 310.441 3.535 20 10 DHCDMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(N(C)C)cc1 ZINC000853241442 1022242590 /nfs/dbraw/zinc/24/25/90/1022242590.db2.gz VFFXRVDYUWOLLD-FUHWJXTLSA-N 2 1 315.505 3.525 20 10 DHCDMP C[C@H]([NH2+]CCCCC[NH+]1CCCCC1)c1ccc(F)cc1O ZINC000185442897 1022489072 /nfs/dbraw/zinc/48/90/72/1022489072.db2.gz SENMOSMNPYQHFK-HNNXBMFYSA-N 2 1 308.441 3.838 20 10 DHCDMP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2cc(F)ccc2O)C1 ZINC000180001409 1022607798 /nfs/dbraw/zinc/60/77/98/1022607798.db2.gz BIDORXZSNRTQOK-JKSUJKDBSA-N 2 1 320.452 3.618 20 10 DHCDMP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2cc(F)ccc2O)C1 ZINC000180001409 1022607804 /nfs/dbraw/zinc/60/78/04/1022607804.db2.gz BIDORXZSNRTQOK-JKSUJKDBSA-N 2 1 320.452 3.618 20 10 DHCDMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2cc(F)ccc2O)C1 ZINC000180001409 1022607810 /nfs/dbraw/zinc/60/78/10/1022607810.db2.gz BIDORXZSNRTQOK-JKSUJKDBSA-N 2 1 320.452 3.618 20 10 DHCDMP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2cc(F)ccc2O)C1 ZINC000180001409 1022607816 /nfs/dbraw/zinc/60/78/16/1022607816.db2.gz BIDORXZSNRTQOK-JKSUJKDBSA-N 2 1 320.452 3.618 20 10 DHCDMP Cc1cccc(C[NH+](C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1O ZINC000180196984 1022658915 /nfs/dbraw/zinc/65/89/15/1022658915.db2.gz COPWKSNBCSFFEG-IBGZPJMESA-N 2 1 324.468 3.655 20 10 DHCDMP Cc1cccc(C[NH+](C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1O ZINC000180196984 1022658924 /nfs/dbraw/zinc/65/89/24/1022658924.db2.gz COPWKSNBCSFFEG-IBGZPJMESA-N 2 1 324.468 3.655 20 10 DHCDMP CC[C@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)c1ccc(C)cc1O ZINC000279997914 1026571646 /nfs/dbraw/zinc/57/16/46/1026571646.db2.gz FRSMGNXRPXWDOA-YOEHRIQHSA-N 2 1 301.434 3.583 20 10 DHCDMP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1ccc(C)cc1O ZINC000280243586 1026616874 /nfs/dbraw/zinc/61/68/74/1026616874.db2.gz WDUCVJOAIZEMQY-WMZOPIPTSA-N 2 1 304.478 3.862 20 10 DHCDMP C[C@@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000809765521 1026621035 /nfs/dbraw/zinc/62/10/35/1026621035.db2.gz NSEGANLEUGTAJA-OXQOHEQNSA-N 2 1 324.468 3.831 20 10 DHCDMP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000809765521 1026621040 /nfs/dbraw/zinc/62/10/40/1026621040.db2.gz NSEGANLEUGTAJA-OXQOHEQNSA-N 2 1 324.468 3.831 20 10 DHCDMP C[C@@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000809765521 1026621047 /nfs/dbraw/zinc/62/10/47/1026621047.db2.gz NSEGANLEUGTAJA-OXQOHEQNSA-N 2 1 324.468 3.831 20 10 DHCDMP C[C@@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000809765521 1026621052 /nfs/dbraw/zinc/62/10/52/1026621052.db2.gz NSEGANLEUGTAJA-OXQOHEQNSA-N 2 1 324.468 3.831 20 10 DHCDMP CC[C@H](c1ccccc1O)[NH+]1CCC([N@H+]2CCC[C@H]2C)CC1 ZINC000369888346 1028541814 /nfs/dbraw/zinc/54/18/14/1028541814.db2.gz NXKXAQXCVRQQPG-CRAIPNDOSA-N 2 1 302.462 3.792 20 10 DHCDMP [NH3+][C@H]1C[C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)c2ccccc21 ZINC000817900452 1029269136 /nfs/dbraw/zinc/26/91/36/1029269136.db2.gz SRSWYMAMQIVEBU-PMACEKPBSA-N 2 1 307.441 3.521 20 10 DHCDMP C[C@@H]([NH2+]Cc1ccc(N2CCC(C)CC2)cc1)c1c[nH+]ccc1N ZINC000817902691 1029271812 /nfs/dbraw/zinc/27/18/12/1029271812.db2.gz XCSPJSZYXGXEBX-MRXNPFEDSA-N 2 1 324.472 3.581 20 10 DHCDMP C[C@H]([NH2+]Cc1ccc(N2CCC(C)CC2)cc1)c1c[nH+]ccc1N ZINC000817902690 1029272971 /nfs/dbraw/zinc/27/29/71/1029272971.db2.gz XCSPJSZYXGXEBX-INIZCTEOSA-N 2 1 324.472 3.581 20 10 DHCDMP C[C@@H](c1ccccc1)[N@@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775647614 1036212034 /nfs/dbraw/zinc/21/20/34/1036212034.db2.gz ZCVCVHCPXJYDMA-SFHVURJKSA-N 2 1 323.484 3.631 20 10 DHCDMP C[C@H](c1ccccc1)[N@@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775647613 1036212892 /nfs/dbraw/zinc/21/28/92/1036212892.db2.gz ZCVCVHCPXJYDMA-GOSISDBHSA-N 2 1 323.484 3.631 20 10 DHCDMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(Cl)cc(C)c2O)C[C@H]1C ZINC000775715929 1036534392 /nfs/dbraw/zinc/53/43/92/1036534392.db2.gz MIHRYYSLKIBPLM-CJNGLKHVSA-N 2 1 310.869 3.659 20 10 DHCDMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(Cl)cc(C)c2O)C[C@H]1C ZINC000775715929 1036534405 /nfs/dbraw/zinc/53/44/05/1036534405.db2.gz MIHRYYSLKIBPLM-CJNGLKHVSA-N 2 1 310.869 3.659 20 10 DHCDMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(Cl)cc(C)c2O)C[C@H]1C ZINC000775715929 1036534421 /nfs/dbraw/zinc/53/44/21/1036534421.db2.gz MIHRYYSLKIBPLM-CJNGLKHVSA-N 2 1 310.869 3.659 20 10 DHCDMP C[C@@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1ccc2ccccc2c1O ZINC000278983496 334104692 /nfs/dbraw/zinc/10/46/92/334104692.db2.gz PCWJDWKURIMRIA-HUUCEWRRSA-N 2 1 321.424 3.655 20 10 DHCDMP C[N@H+]1CC[C@@]2(C1)CCC[NH+](Cc1cc(C(C)(C)C)ccc1O)C2 ZINC001279474503 1014430648 /nfs/dbraw/zinc/43/06/48/1014430648.db2.gz ODXLFQOQZVIIPL-HXUWFJFHSA-N 2 1 316.489 3.607 20 10 DHCDMP C[NH+]1CC[C@@]2(C1)CCC[N@H+](Cc1cc(C(C)(C)C)ccc1O)C2 ZINC001279474503 1014430650 /nfs/dbraw/zinc/43/06/50/1014430650.db2.gz ODXLFQOQZVIIPL-HXUWFJFHSA-N 2 1 316.489 3.607 20 10 DHCDMP C[NH+]1CC[C@@]2(C1)CCC[N@@H+](Cc1cc(C(C)(C)C)ccc1O)C2 ZINC001279474503 1014430653 /nfs/dbraw/zinc/43/06/53/1014430653.db2.gz ODXLFQOQZVIIPL-HXUWFJFHSA-N 2 1 316.489 3.607 20 10 DHCDMP C[C@@H]([NH2+]CCCCC[NH+]1CCCCC1)c1ccc(F)cc1O ZINC000185442919 1016922441 /nfs/dbraw/zinc/92/24/41/1016922441.db2.gz SENMOSMNPYQHFK-OAHLLOKOSA-N 2 1 308.441 3.838 20 10 DHCDMP C[C@H]([NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000766167151 1019098664 /nfs/dbraw/zinc/09/86/64/1019098664.db2.gz SFNBUTQWFHCCRZ-ZIFCJYIRSA-N 2 1 315.505 3.810 20 10 DHCDMP C[C@H]([NH2+][C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000766167151 1019098676 /nfs/dbraw/zinc/09/86/76/1019098676.db2.gz SFNBUTQWFHCCRZ-ZIFCJYIRSA-N 2 1 315.505 3.810 20 10 DHCDMP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H]2CCCC[N@@H+](C)C2)cc1 ZINC000858490437 1032918175 /nfs/dbraw/zinc/91/81/75/1032918175.db2.gz HIOZZVKZRDIFMZ-SJORKVTESA-N 2 1 303.494 3.525 20 10 DHCDMP C[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1ccc2ccccc2c1O ZINC000858490325 1032918132 /nfs/dbraw/zinc/91/81/32/1032918132.db2.gz GFWNYCYCWRQUJS-HOTGVXAUSA-N 2 1 312.457 3.928 20 10 DHCDMP C[C@@H]1C[C@@H]([NH2+]Cc2cc(-c3ccccc3)ccc2O)CC[N@@H+]1C ZINC000742375628 1021114491 /nfs/dbraw/zinc/11/44/91/1021114491.db2.gz SRFYMWWKYLFNRA-BEFAXECRSA-N 2 1 310.441 3.632 20 10 DHCDMP C[C@@H]1C[C@@H]([NH2+]Cc2cc(-c3ccccc3)ccc2O)CC[N@H+]1C ZINC000742375628 1021114501 /nfs/dbraw/zinc/11/45/01/1021114501.db2.gz SRFYMWWKYLFNRA-BEFAXECRSA-N 2 1 310.441 3.632 20 10 DHCDMP CN(C)c1ccc(C[NH+]2CCC([NH2+]Cc3ccccc3)CC2)cc1 ZINC000852115265 1022079406 /nfs/dbraw/zinc/07/94/06/1022079406.db2.gz DPUVSWVOVCHRNR-UHFFFAOYSA-N 2 1 323.484 3.507 20 10 DHCDMP C[C@@H](CC[NH2+][C@@H](C)c1ccccc1O)[N@@H+](C)Cc1ccccc1 ZINC000183541022 1022180776 /nfs/dbraw/zinc/18/07/76/1022180776.db2.gz QMDWPXZUOFGKRC-IRXDYDNUSA-N 2 1 312.457 3.953 20 10 DHCDMP C[C@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1ccc(Cl)cc1O ZINC000853239123 1022240358 /nfs/dbraw/zinc/24/03/58/1022240358.db2.gz AKDOHSUEZDQAOY-DZGCQCFKSA-N 2 1 322.880 3.818 20 10 DHCDMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(Cl)cc1O ZINC000853239123 1022240364 /nfs/dbraw/zinc/24/03/64/1022240364.db2.gz AKDOHSUEZDQAOY-DZGCQCFKSA-N 2 1 322.880 3.818 20 10 DHCDMP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1ccc(F)cc1O ZINC000853241902 1022242798 /nfs/dbraw/zinc/24/27/98/1022242798.db2.gz YSFTWMVCEBYGTK-CRAIPNDOSA-N 2 1 320.452 3.694 20 10 DHCDMP CC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(F)cc1O ZINC000853241902 1022242804 /nfs/dbraw/zinc/24/28/04/1022242804.db2.gz YSFTWMVCEBYGTK-CRAIPNDOSA-N 2 1 320.452 3.694 20 10 DHCDMP CC[C@H](CC(C)C)[NH2+]C1CC[NH+](Cc2ccccc2O)CC1 ZINC001172394227 1033177936 /nfs/dbraw/zinc/17/79/36/1033177936.db2.gz OYZBVLHQHSSLGS-QGZVFWFLSA-N 2 1 304.478 3.771 20 10 DHCDMP C[N@@H+](CCC[NH2+][C@@H]1CCc2cccc(O)c21)C1CCCCC1 ZINC000321050571 1024649877 /nfs/dbraw/zinc/64/98/77/1024649877.db2.gz XJXXQQLHMGBEFP-QGZVFWFLSA-N 2 1 302.462 3.624 20 10 DHCDMP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2c(O)cccc2F)c1 ZINC000886522103 1025674450 /nfs/dbraw/zinc/67/44/50/1025674450.db2.gz CFJNBMWUYHOSQD-CQSZACIVSA-N 2 1 316.420 3.834 20 10 DHCDMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2c(O)cccc2F)c1 ZINC000886522103 1025674455 /nfs/dbraw/zinc/67/44/55/1025674455.db2.gz CFJNBMWUYHOSQD-CQSZACIVSA-N 2 1 316.420 3.834 20 10 DHCDMP C[C@H]1C[C@H]([NH+](C)Cc2ccc(N3CCCCC3)cc2)CC[N@@H+]1C ZINC000093643818 1026119640 /nfs/dbraw/zinc/11/96/40/1026119640.db2.gz GCEYNGOCJYGTGA-FXAWDEMLSA-N 2 1 315.505 3.591 20 10 DHCDMP C[C@H]1C[C@H]([NH+](C)Cc2ccc(N3CCCCC3)cc2)CC[N@H+]1C ZINC000093643818 1026119653 /nfs/dbraw/zinc/11/96/53/1026119653.db2.gz GCEYNGOCJYGTGA-FXAWDEMLSA-N 2 1 315.505 3.591 20 10 DHCDMP C[C@H]1C[C@H]([N@H+](C)Cc2ccc(N3CCCCC3)cc2)CC[NH+]1C ZINC000093643818 1026119659 /nfs/dbraw/zinc/11/96/59/1026119659.db2.gz GCEYNGOCJYGTGA-FXAWDEMLSA-N 2 1 315.505 3.591 20 10 DHCDMP C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(N3CCCCC3)cc2)CC[NH+]1C ZINC000093643818 1026119674 /nfs/dbraw/zinc/11/96/74/1026119674.db2.gz GCEYNGOCJYGTGA-FXAWDEMLSA-N 2 1 315.505 3.591 20 10 DHCDMP Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)c1O ZINC000808678623 1026356883 /nfs/dbraw/zinc/35/68/83/1026356883.db2.gz TWLDZNIPLNJMJJ-QEJZJMRPSA-N 2 1 308.853 3.631 20 10 DHCDMP Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)c1O ZINC000809757343 1026619059 /nfs/dbraw/zinc/61/90/59/1026619059.db2.gz YXHOCTPXEWFXAP-OAHLLOKOSA-N 2 1 322.880 3.518 20 10 DHCDMP CC[C@@H](c1ccccc1O)[N@H+]1CC[C@@H](CNc2ccccn2)C1 ZINC000367295578 1028159010 /nfs/dbraw/zinc/15/90/10/1028159010.db2.gz QPQKIXCQXUUHDY-RDJZCZTQSA-N 2 1 311.429 3.672 20 10 DHCDMP CC[C@H](c1ccccc1O)[NH+]1CCC([N@H+]2CCC[C@@H]2C)CC1 ZINC000369888347 1028540778 /nfs/dbraw/zinc/54/07/78/1028540778.db2.gz NXKXAQXCVRQQPG-MAUKXSAKSA-N 2 1 302.462 3.792 20 10 DHCDMP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc3ccccc3c2O)C1 ZINC000816516976 1028916603 /nfs/dbraw/zinc/91/66/03/1028916603.db2.gz ZBWPSBGXNQKCBK-MRXNPFEDSA-N 2 1 312.457 3.709 20 10 DHCDMP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816516976 1028916614 /nfs/dbraw/zinc/91/66/14/1028916614.db2.gz ZBWPSBGXNQKCBK-MRXNPFEDSA-N 2 1 312.457 3.709 20 10 DHCDMP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816516976 1028916627 /nfs/dbraw/zinc/91/66/27/1028916627.db2.gz ZBWPSBGXNQKCBK-MRXNPFEDSA-N 2 1 312.457 3.709 20 10 DHCDMP CCC[NH2+]CC[NH2+][C@H](CCc1ccccc1)c1ccccc1O ZINC000817963248 1029299400 /nfs/dbraw/zinc/29/94/00/1029299400.db2.gz SUJBRQNSPJYEDG-LJQANCHMSA-N 2 1 312.457 3.655 20 10 DHCDMP CC(C)[C@@H]([NH3+])C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000817959433 1029299703 /nfs/dbraw/zinc/29/97/03/1029299703.db2.gz RGVDXZSNKKNOBE-LPHOPBHVSA-N 2 1 303.494 3.701 20 10 DHCDMP C[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cccc(C(F)(F)F)c1O ZINC000817979447 1029316389 /nfs/dbraw/zinc/31/63/89/1029316389.db2.gz BCYXTKZRRCYAGM-RYUDHWBXSA-N 2 1 316.367 3.594 20 10 DHCDMP Cc1cc(O)c(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc1Cl ZINC000824850295 1030653591 /nfs/dbraw/zinc/65/35/91/1030653591.db2.gz KUSLTZOYYRJXLQ-MRXNPFEDSA-N 2 1 322.880 3.804 20 10 DHCDMP COc1cccc([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)c1O ZINC000846140151 1031900060 /nfs/dbraw/zinc/90/00/60/1031900060.db2.gz HMYBMOBVXBSRQK-HOTGVXAUSA-N 2 1 320.477 3.706 20 10 DHCDMP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cc(C)cc(C)c1O ZINC000191278166 1033390061 /nfs/dbraw/zinc/39/00/61/1033390061.db2.gz QRMXRWHYSHCQTB-UHFFFAOYSA-N 2 1 315.461 3.680 20 10 DHCDMP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cc(C)cc(C)c1O ZINC000191278166 1033390068 /nfs/dbraw/zinc/39/00/68/1033390068.db2.gz QRMXRWHYSHCQTB-UHFFFAOYSA-N 2 1 315.461 3.680 20 10 DHCDMP CC[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CCCCC1 ZINC000775636928 1036134366 /nfs/dbraw/zinc/13/43/66/1036134366.db2.gz JEAIFUZCTZVLBM-UHFFFAOYSA-N 2 1 315.505 3.593 20 10 DHCDMP Cc1cc(Cl)cc(C[N@H+](C)C2CC[NH+](C(C)C)CC2)c1O ZINC000775647823 1036189286 /nfs/dbraw/zinc/18/92/86/1036189286.db2.gz BLSXTGZMGWWPDG-UHFFFAOYSA-N 2 1 310.869 3.659 20 10 DHCDMP CC1([NH+]2CCCC2)CCC([NH2+]Cc2ccc(Cl)cc2O)CC1 ZINC001183863626 1036698651 /nfs/dbraw/zinc/69/86/51/1036698651.db2.gz FMQRMCJBLXNPHS-UHFFFAOYSA-N 2 1 322.880 3.932 20 10 DHCDMP CCCN(CCC)c1ccc(C[NH2+]CC2=CC[N@@H+](C)CC2)cc1 ZINC000776259030 1038095017 /nfs/dbraw/zinc/09/50/17/1038095017.db2.gz YINLCCSRZWBIAJ-UHFFFAOYSA-N 2 1 315.505 3.665 20 10 DHCDMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](CC)c2cc(Cl)ccc2O)C1 ZINC000775491787 1038567765 /nfs/dbraw/zinc/56/77/65/1038567765.db2.gz JUMZOESCHPTYQJ-BBRMVZONSA-N 2 1 310.869 3.818 20 10 DHCDMP CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cc(Cl)ccc1O ZINC000775493278 1038569286 /nfs/dbraw/zinc/56/92/86/1038569286.db2.gz WXICDCCGKNTXIR-BLLLJJGKSA-N 2 1 308.853 3.571 20 10 DHCDMP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cc(Cl)ccc1O ZINC000775493281 1038569465 /nfs/dbraw/zinc/56/94/65/1038569465.db2.gz WXICDCCGKNTXIR-MLGOLLRUSA-N 2 1 308.853 3.571 20 10 DHCDMP Oc1ccc(-c2ccccc2)cc1C[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000263716063 1032758219 /nfs/dbraw/zinc/75/82/19/1032758219.db2.gz VJGSPIQLGCQBCE-UHFFFAOYSA-N 2 1 322.452 3.776 20 10 DHCDMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccc(N(C)C)cc1 ZINC000764964117 1018440552 /nfs/dbraw/zinc/44/05/52/1018440552.db2.gz PKASIQCWRJWIQF-ROUUACIJSA-N 2 1 317.521 3.915 20 10 DHCDMP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)cc1 ZINC000125775342 1032969896 /nfs/dbraw/zinc/96/98/96/1032969896.db2.gz NUKDMQHPCQVNDV-MSOLQXFVSA-N 2 1 317.521 3.914 20 10 DHCDMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1ccc(N(C)C)cc1 ZINC000125855843 1033005176 /nfs/dbraw/zinc/00/51/76/1033005176.db2.gz KERPWVGPRIZUMR-FXAWDEMLSA-N 2 1 317.521 3.914 20 10 DHCDMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccccc1O ZINC000853239337 1022241139 /nfs/dbraw/zinc/24/11/39/1022241139.db2.gz FTVWHHVFCYAOLD-FUHWJXTLSA-N 2 1 302.462 3.555 20 10 DHCDMP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(C)cc1O ZINC000853239382 1022241484 /nfs/dbraw/zinc/24/14/84/1022241484.db2.gz GLYHQPVTWIBAHK-MJGOQNOKSA-N 2 1 316.489 3.863 20 10 DHCDMP CC[NH+]1CCC([NH2+][C@H]2c3c(c(C)cc(C)c3O)CC2(C)C)CC1 ZINC001169244273 1022322616 /nfs/dbraw/zinc/32/26/16/1022322616.db2.gz LBAAEIFFWPFMQD-IBGZPJMESA-N 2 1 316.489 3.706 20 10 DHCDMP C[N@H+](Cc1cc(-c2ccccc2)ccc1O)C[C@@H]1CCC[NH+](C)C1 ZINC000768547648 1022995799 /nfs/dbraw/zinc/99/57/99/1022995799.db2.gz WKOUBNVLOFJNON-QGZVFWFLSA-N 2 1 324.468 3.833 20 10 DHCDMP C[NH+](Cc1cc(-c2ccccc2)ccc1O)C[C@@H]1CCC[N@H+](C)C1 ZINC000768547648 1022995810 /nfs/dbraw/zinc/99/58/10/1022995810.db2.gz WKOUBNVLOFJNON-QGZVFWFLSA-N 2 1 324.468 3.833 20 10 DHCDMP C[NH+](Cc1cc(-c2ccccc2)ccc1O)C[C@@H]1CCC[N@@H+](C)C1 ZINC000768547648 1022995825 /nfs/dbraw/zinc/99/58/25/1022995825.db2.gz WKOUBNVLOFJNON-QGZVFWFLSA-N 2 1 324.468 3.833 20 10 DHCDMP CCN(CC)c1ccc(C[N@@H+]2CC[C@H](C[NH+](CC)CC)C2)cc1 ZINC000769504613 1023168915 /nfs/dbraw/zinc/16/89/15/1023168915.db2.gz WJCUBNGAPCQYPK-LJQANCHMSA-N 2 1 317.521 3.697 20 10 DHCDMP CCN(CC)c1ccc(C[N@H+]2CC[C@H](C[NH+](CC)CC)C2)cc1 ZINC000769504613 1023168918 /nfs/dbraw/zinc/16/89/18/1023168918.db2.gz WJCUBNGAPCQYPK-LJQANCHMSA-N 2 1 317.521 3.697 20 10 DHCDMP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2c(O)cccc2F)c1 ZINC000886522102 1025673320 /nfs/dbraw/zinc/67/33/20/1025673320.db2.gz CFJNBMWUYHOSQD-AWEZNQCLSA-N 2 1 316.420 3.834 20 10 DHCDMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2c(O)cccc2F)c1 ZINC000886522102 1025673328 /nfs/dbraw/zinc/67/33/28/1025673328.db2.gz CFJNBMWUYHOSQD-AWEZNQCLSA-N 2 1 316.420 3.834 20 10 DHCDMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cc(C)ccc1O ZINC000809739231 1026611233 /nfs/dbraw/zinc/61/12/33/1026611233.db2.gz BLGZXKFQSVPNRM-UHFFFAOYSA-N 2 1 312.457 3.784 20 10 DHCDMP CC[C@@H](c1ccccc1O)[N@H+]1CC[C@H](CNc2ccccn2)C1 ZINC000367295579 1028159828 /nfs/dbraw/zinc/15/98/28/1028159828.db2.gz QPQKIXCQXUUHDY-WBVHZDCISA-N 2 1 311.429 3.672 20 10 DHCDMP C[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cccc(C(F)(F)F)c1O ZINC000817979449 1029316812 /nfs/dbraw/zinc/31/68/12/1029316812.db2.gz BCYXTKZRRCYAGM-VXGBXAGGSA-N 2 1 316.367 3.594 20 10 DHCDMP C[C@H]([NH2+]CCC1CC[NH2+]CC1)c1cc(Cl)c(Cl)cc1O ZINC000844922878 1031401507 /nfs/dbraw/zinc/40/15/07/1031401507.db2.gz CAYRDHHKHBITJX-JTQLQIEISA-N 2 1 317.260 3.739 20 10 DHCDMP C[C@@H]([NH2+]CCC1CC[NH2+]CC1)c1cc(Cl)c(Cl)cc1O ZINC000844922879 1031401967 /nfs/dbraw/zinc/40/19/67/1031401967.db2.gz CAYRDHHKHBITJX-SNVBAGLBSA-N 2 1 317.260 3.739 20 10 DHCDMP C[NH+]1CCC([NH2+][C@H](CCc2ccccc2)c2ccccc2O)CC1 ZINC000293758327 1031606103 /nfs/dbraw/zinc/60/61/03/1031606103.db2.gz OTMVCSIEKSJJNB-HXUWFJFHSA-N 2 1 324.468 3.750 20 10 DHCDMP CC[C@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)c1ccc(N(C)C)cc1 ZINC000178701553 1034259454 /nfs/dbraw/zinc/25/94/54/1034259454.db2.gz PYCLSIKHKZGWLN-BEFAXECRSA-N 2 1 314.477 3.635 20 10 DHCDMP C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1O)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000186518955 1034639498 /nfs/dbraw/zinc/63/94/98/1034639498.db2.gz FPQLFRJDJAAAKD-QLFBSQMISA-N 2 1 320.452 3.835 20 10 DHCDMP Oc1ccc2ccccc2c1C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000153457213 1036601986 /nfs/dbraw/zinc/60/19/86/1036601986.db2.gz GCUNUSFFCDOXTK-SFHVURJKSA-N 2 1 324.468 3.996 20 10 DHCDMP CCC[N@H+](CCCCn1cc[nH+]c1C)Cc1ccccc1O ZINC000161530963 1018043105 /nfs/dbraw/zinc/04/31/05/1018043105.db2.gz QSSDTNKPCGKXON-UHFFFAOYSA-N 2 1 301.434 3.590 20 10 DHCDMP CCC[N@@H+](CCCCn1cc[nH+]c1C)Cc1ccccc1O ZINC000161530963 1018043120 /nfs/dbraw/zinc/04/31/20/1018043120.db2.gz QSSDTNKPCGKXON-UHFFFAOYSA-N 2 1 301.434 3.590 20 10 DHCDMP C[N@H+]1CCCC[C@H](C[NH2+]Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000858245371 1032814968 /nfs/dbraw/zinc/81/49/68/1032814968.db2.gz RJVMNEGWZRUWHY-QGZVFWFLSA-N 2 1 324.468 3.881 20 10 DHCDMP CC[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1ccc(N(C)C)cc1 ZINC000858490278 1032916062 /nfs/dbraw/zinc/91/60/62/1032916062.db2.gz DPFBQRRJPXGYFD-LPHOPBHVSA-N 2 1 303.494 3.525 20 10 DHCDMP C[NH+](C)[C@@H]1CCC[N@@H+](Cc2cc(-c3ccccc3)ccc2O)CC1 ZINC000763617005 1022125100 /nfs/dbraw/zinc/12/51/00/1022125100.db2.gz UMHXGFQOUKYQRJ-HXUWFJFHSA-N 2 1 324.468 3.975 20 10 DHCDMP Cc1cc(C)c([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)c(O)c1 ZINC000853239315 1022241570 /nfs/dbraw/zinc/24/15/70/1022241570.db2.gz DYYIFQHJLJRLBQ-SJLPKXTDSA-N 2 1 316.489 3.782 20 10 DHCDMP CC[C@@H](c1ccccc1O)[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000364008368 1022572178 /nfs/dbraw/zinc/57/21/78/1022572178.db2.gz IHUARACTQTVUOU-AEFFLSMTSA-N 2 1 302.462 3.651 20 10 DHCDMP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1ccc2ccccc2c1O ZINC000193508382 1024162103 /nfs/dbraw/zinc/16/21/03/1024162103.db2.gz ZWZUKRKGZRJANU-CABCVRRESA-N 2 1 310.441 3.680 20 10 DHCDMP Oc1ccccc1C[NH2+][C@@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000876995797 1033202918 /nfs/dbraw/zinc/20/29/18/1033202918.db2.gz INEBUDSZZBJINK-QUCCMNQESA-N 2 1 322.452 3.850 20 10 DHCDMP Oc1ccccc1C[NH2+][C@@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000876995797 1033202930 /nfs/dbraw/zinc/20/29/30/1033202930.db2.gz INEBUDSZZBJINK-QUCCMNQESA-N 2 1 322.452 3.850 20 10 DHCDMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000808699064 1026374064 /nfs/dbraw/zinc/37/40/64/1026374064.db2.gz RKGWDXCPTYDQJH-ZDUSSCGKSA-N 2 1 321.852 3.990 20 10 DHCDMP CC[C@H]([NH2+]CCCCn1cc[nH+]c1C)c1ccc(C)cc1O ZINC000280040611 1026577683 /nfs/dbraw/zinc/57/76/83/1026577683.db2.gz IWFGIFOFLYCAPK-KRWDZBQOSA-N 2 1 301.434 3.727 20 10 DHCDMP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cc2c(cc1O)CCCC2 ZINC000296286404 1027597187 /nfs/dbraw/zinc/59/71/87/1027597187.db2.gz FHADAYOHSZLOLH-TZUVLKIQSA-N 2 1 314.473 3.547 20 10 DHCDMP CC[N@@H+](CCC1CC[NH+](Cc2ccccc2O)CC1)CC1CC1 ZINC000779045619 1028035603 /nfs/dbraw/zinc/03/56/03/1028035603.db2.gz PUJZOSSUJXUPNH-UHFFFAOYSA-N 2 1 316.489 3.726 20 10 DHCDMP CC[C@H](c1ccccc1O)[N@H+]1CC[C@H](CNc2ccccn2)C1 ZINC000367295577 1028160736 /nfs/dbraw/zinc/16/07/36/1028160736.db2.gz QPQKIXCQXUUHDY-NVXWUHKLSA-N 2 1 311.429 3.672 20 10 DHCDMP CC[C@@H](c1ccccc1O)[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000367321746 1028165841 /nfs/dbraw/zinc/16/58/41/1028165841.db2.gz JNNIEGKTFRGLQV-WMZOPIPTSA-N 2 1 302.462 3.794 20 10 DHCDMP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816515969 1028920076 /nfs/dbraw/zinc/92/00/76/1028920076.db2.gz QMPCGJQYBTXUAE-INIZCTEOSA-N 2 1 312.457 3.709 20 10 DHCDMP C[C@H]1CCCC[N@H+]1CCC[NH2+]Cc1ccc2ccccc2c1O ZINC000816529930 1028924259 /nfs/dbraw/zinc/92/42/59/1028924259.db2.gz MPPNUVAPCMCGBU-INIZCTEOSA-N 2 1 312.457 3.900 20 10 DHCDMP C[NH+]1CCC2(CCC[N@@H+](Cc3ccc4ccccc4c3O)C2)CC1 ZINC000816598405 1028956179 /nfs/dbraw/zinc/95/61/79/1028956179.db2.gz AKNBIIOYBPBTHK-UHFFFAOYSA-N 2 1 324.468 3.853 20 10 DHCDMP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3ccc4ccccc4c3O)C2)CC1 ZINC000816610875 1028960597 /nfs/dbraw/zinc/96/05/97/1028960597.db2.gz BLUWDERIGQOXSN-SFHVURJKSA-N 2 1 324.468 3.709 20 10 DHCDMP CCN(CC)c1ccc(C[NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)cc1 ZINC000817888599 1029263768 /nfs/dbraw/zinc/26/37/68/1029263768.db2.gz MWKNOEQEWZDMBT-VQTJNVASSA-N 2 1 309.457 3.767 20 10 DHCDMP C[C@@H]([NH2+]C1CCC([NH3+])CC1)c1cc(Cl)c(Cl)cc1O ZINC000817946670 1029288547 /nfs/dbraw/zinc/28/85/47/1029288547.db2.gz CVRIVSONRDBZHK-XNWIYYODSA-N 2 1 303.233 3.620 20 10 DHCDMP CC[C@@H]([NH2+]C1CCC(C)([NH+]2CCC2)CC1)c1ccc(F)cc1O ZINC000927035668 1031043824 /nfs/dbraw/zinc/04/38/24/1031043824.db2.gz CBRFUHNKAMMTLN-URSIVYNOSA-N 2 1 320.452 3.979 20 10 DHCDMP CCCOc1ccc(C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1C ZINC000873014456 1031693895 /nfs/dbraw/zinc/69/38/95/1031693895.db2.gz RONAPINCOHFKHW-ZWKOTPCHSA-N 2 1 302.462 3.500 20 10 DHCDMP C[C@@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)C1CC[NH2+]CC1 ZINC000873270128 1031782443 /nfs/dbraw/zinc/78/24/43/1031782443.db2.gz XPLWBHCGQZRXPY-ZJUUUORDSA-N 2 1 317.260 3.738 20 10 DHCDMP COc1cccc([C@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)c1O ZINC000846140470 1031901464 /nfs/dbraw/zinc/90/14/64/1031901464.db2.gz UDAWZGXIPMKFBP-CVEARBPZSA-N 2 1 320.477 3.564 20 10 DHCDMP Cc1ccc(O)c(C[N@@H+](C)C2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000119327205 1034022211 /nfs/dbraw/zinc/02/22/11/1034022211.db2.gz MYGISYTUWDYUBU-UHFFFAOYSA-N 2 1 324.468 3.797 20 10 DHCDMP Cc1ccc(O)c(C[N@H+](C)C2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000119327205 1034022221 /nfs/dbraw/zinc/02/22/21/1034022221.db2.gz MYGISYTUWDYUBU-UHFFFAOYSA-N 2 1 324.468 3.797 20 10 DHCDMP CN(C)c1ccc(C[NH2+]C[C@@H]2CC[N@@H+](C)[C@H]2c2ccccc2)cc1 ZINC000377757670 337060251 /nfs/dbraw/zinc/06/02/51/337060251.db2.gz AIZJDMGEGGNQFS-FPOVZHCZSA-N 2 1 323.484 3.535 20 10 DHCDMP C[C@@H]([NH2+]C1CC[NH+](C)CC1)c1ccc(N2CCCCCC2)cc1 ZINC000161496829 525402779 /nfs/dbraw/zinc/40/27/79/525402779.db2.gz YIYHWTIOPYNGTE-QGZVFWFLSA-N 2 1 315.505 3.812 20 10 DHCDMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(F)cc2[O-])C1 ZINC000186142489 1017930489 /nfs/dbraw/zinc/93/04/89/1017930489.db2.gz LXPSOCKJBFXYHY-LSDHHAIUSA-N 2 1 308.441 3.550 20 10 DHCDMP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(F)cc2O)C1 ZINC000186142489 1017930498 /nfs/dbraw/zinc/93/04/98/1017930498.db2.gz LXPSOCKJBFXYHY-LSDHHAIUSA-N 2 1 308.441 3.550 20 10 DHCDMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(F)cc2O)C1 ZINC000186142489 1017930508 /nfs/dbraw/zinc/93/05/08/1017930508.db2.gz LXPSOCKJBFXYHY-LSDHHAIUSA-N 2 1 308.441 3.550 20 10 DHCDMP Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)c1 ZINC000186142466 1017931380 /nfs/dbraw/zinc/93/13/80/1017931380.db2.gz PONLVZHBYGYQKW-DLBZAZTESA-N 2 1 304.478 3.719 20 10 DHCDMP COc1ccc(C[NH2+]CCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1C ZINC000727643837 1019745778 /nfs/dbraw/zinc/74/57/78/1019745778.db2.gz PVSDTLUMBWBPGS-CALCHBBNSA-N 2 1 318.505 3.851 20 10 DHCDMP CCN(C)c1ccc([C@H](C)[NH2+]C[C@H]2CCCC[N@@H+](C)C2)cc1 ZINC000858490434 1032919125 /nfs/dbraw/zinc/91/91/25/1032919125.db2.gz HIOZZVKZRDIFMZ-DLBZAZTESA-N 2 1 303.494 3.525 20 10 DHCDMP Oc1ccc(-c2ccccc2)cc1C[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000725845707 1020685997 /nfs/dbraw/zinc/68/59/97/1020685997.db2.gz IAVNCKMVTDOJQR-UXHICEINSA-N 2 1 322.452 3.776 20 10 DHCDMP CC[N@H+](Cc1ccccc1O)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000179583277 1022475891 /nfs/dbraw/zinc/47/58/91/1022475891.db2.gz DVYXCMGTPRWJAI-LJQANCHMSA-N 2 1 324.468 3.736 20 10 DHCDMP CC[NH+](Cc1ccccc1O)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000179583277 1022475894 /nfs/dbraw/zinc/47/58/94/1022475894.db2.gz DVYXCMGTPRWJAI-LJQANCHMSA-N 2 1 324.468 3.736 20 10 DHCDMP CC[NH+](Cc1ccccc1O)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000179583277 1022475900 /nfs/dbraw/zinc/47/59/00/1022475900.db2.gz DVYXCMGTPRWJAI-LJQANCHMSA-N 2 1 324.468 3.736 20 10 DHCDMP C[C@H]([NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1O ZINC000272900415 1022516805 /nfs/dbraw/zinc/51/68/05/1022516805.db2.gz UZWNTZWZAQVWAO-LNLFQRSKSA-N 2 1 324.468 3.953 20 10 DHCDMP CC(C)c1ccc[nH+]c1NCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000767290552 1022681145 /nfs/dbraw/zinc/68/11/45/1022681145.db2.gz JUIVLGCPKHCOLZ-UHFFFAOYSA-N 2 1 324.472 3.569 20 10 DHCDMP CCN(CC)c1ccc(C[N@@H+](C)C2CC[NH+](C(C)C)CC2)cc1 ZINC000768227557 1022930693 /nfs/dbraw/zinc/93/06/93/1022930693.db2.gz BQLQLZQAZFHMKY-UHFFFAOYSA-N 2 1 317.521 3.837 20 10 DHCDMP CCN(CC)c1ccc(C[N@@H+](C)[C@@H]2CC[NH+](CC)[C@@H](C)C2)cc1 ZINC000769470648 1023161857 /nfs/dbraw/zinc/16/18/57/1023161857.db2.gz NEBXSSDZPTXTAB-FXAWDEMLSA-N 2 1 317.521 3.837 20 10 DHCDMP CCN(CC)c1ccc(C[NH+](C)[C@@H]2CC[N@H+](CC)[C@@H](C)C2)cc1 ZINC000769470648 1023161860 /nfs/dbraw/zinc/16/18/60/1023161860.db2.gz NEBXSSDZPTXTAB-FXAWDEMLSA-N 2 1 317.521 3.837 20 10 DHCDMP CCN(CC)c1ccc(C[NH+](C)[C@@H]2CC[N@@H+](CC)[C@@H](C)C2)cc1 ZINC000769470648 1023161862 /nfs/dbraw/zinc/16/18/62/1023161862.db2.gz NEBXSSDZPTXTAB-FXAWDEMLSA-N 2 1 317.521 3.837 20 10 DHCDMP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](C[NH+](CC)CC)C2)cc1 ZINC000769504611 1023168064 /nfs/dbraw/zinc/16/80/64/1023168064.db2.gz WJCUBNGAPCQYPK-IBGZPJMESA-N 2 1 317.521 3.697 20 10 DHCDMP CCN(CC)c1ccc(C[N@H+]2CC[C@@H](C[NH+](CC)CC)C2)cc1 ZINC000769504611 1023168066 /nfs/dbraw/zinc/16/80/66/1023168066.db2.gz WJCUBNGAPCQYPK-IBGZPJMESA-N 2 1 317.521 3.697 20 10 DHCDMP Cc1cc(Cl)cc([C@H](C)[NH2+]C2CC[NH+](C3CC3)CC2)c1O ZINC000808673746 1026353900 /nfs/dbraw/zinc/35/39/00/1026353900.db2.gz SRLWSAQUPQTTQH-LBPRGKRZSA-N 2 1 308.853 3.631 20 10 DHCDMP CC(C)(C)c1cccc(C[N@H+]2CCCC3(CC[NH2+]CC3)C2)c1O ZINC001204734762 1026442134 /nfs/dbraw/zinc/44/21/34/1026442134.db2.gz DRCSVQCWLGYJHV-UHFFFAOYSA-N 2 1 316.489 3.655 20 10 DHCDMP CC[C@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)c1ccc(C)cc1O ZINC000279997907 1026571731 /nfs/dbraw/zinc/57/17/31/1026571731.db2.gz FRSMGNXRPXWDOA-PBHICJAKSA-N 2 1 301.434 3.583 20 10 DHCDMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cccc(C)c1O ZINC000809738664 1026609255 /nfs/dbraw/zinc/60/92/55/1026609255.db2.gz DLEFDFHLFSTPQJ-UHFFFAOYSA-N 2 1 312.457 3.784 20 10 DHCDMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@H]1CCc2cccc(O)c21 ZINC000295814433 1027443167 /nfs/dbraw/zinc/44/31/67/1027443167.db2.gz CYTPILNWDMNZSH-RDJZCZTQSA-N 2 1 302.462 3.624 20 10 DHCDMP CC[C@H](c1ccccc1O)[N@H+]1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC000368137221 1028312151 /nfs/dbraw/zinc/31/21/51/1028312151.db2.gz YGDHAAGYDYYVEV-SJLPKXTDSA-N 2 1 302.462 3.507 20 10 DHCDMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C)[C@@H]1c1ccccc1)c1ccccc1O ZINC000368484441 1028362215 /nfs/dbraw/zinc/36/22/15/1028362215.db2.gz YIPIBUJRXOEHSA-RIFZZMRRSA-N 2 1 310.441 3.736 20 10 DHCDMP Cc1cc(C)c([C@@H](C)[NH2+]CCC[N@H+]2CCCC[C@H]2C)c(O)c1 ZINC000815555450 1028539334 /nfs/dbraw/zinc/53/93/34/1028539334.db2.gz ZUZWZQCGQQMVIC-IAGOWNOFSA-N 2 1 304.478 3.924 20 10 DHCDMP Oc1c(C[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)ccc2ccccc21 ZINC000816515565 1028919572 /nfs/dbraw/zinc/91/95/72/1028919572.db2.gz DFHVZALSZAOYQE-QGZVFWFLSA-N 2 1 324.468 3.853 20 10 DHCDMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1ccc2ccccc2c1O ZINC000816610974 1028958563 /nfs/dbraw/zinc/95/85/63/1028958563.db2.gz DVUNAHVGCGLDDT-UHFFFAOYSA-N 2 1 309.413 3.572 20 10 DHCDMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1ccc2ccccc2c1O ZINC000816610974 1028958579 /nfs/dbraw/zinc/95/85/79/1028958579.db2.gz DVUNAHVGCGLDDT-UHFFFAOYSA-N 2 1 309.413 3.572 20 10 DHCDMP C[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1cc(Cl)c(Cl)cc1O ZINC000817966414 1029305354 /nfs/dbraw/zinc/30/53/54/1029305354.db2.gz NGWZLEPMHFMAGO-BONVTDFDSA-N 2 1 317.260 3.739 20 10 DHCDMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccc1O ZINC000183489471 1034389917 /nfs/dbraw/zinc/38/99/17/1034389917.db2.gz ORJRQQWXVNRLON-PKOBYXMFSA-N 2 1 324.468 3.607 20 10 DHCDMP CC(C)[N@@H+](C)CC1CC[NH+](Cc2cccc(Cl)c2[O-])CC1 ZINC000775657498 1036242663 /nfs/dbraw/zinc/24/26/63/1036242663.db2.gz BXTOPAAKAZRQSC-UHFFFAOYSA-N 2 1 310.869 3.598 20 10 DHCDMP CC[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1cc(Cl)ccc1O ZINC000775487045 1038553472 /nfs/dbraw/zinc/55/34/72/1038553472.db2.gz GYLJACKXCOJFIO-DZKIICNBSA-N 2 1 308.853 3.713 20 10 DHCDMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000273603172 130143594 /nfs/dbraw/zinc/14/35/94/130143594.db2.gz SLYMTLBYRZLBEH-OAHLLOKOSA-N 2 1 301.434 3.645 20 10 DHCDMP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000284033395 131042472 /nfs/dbraw/zinc/04/24/72/131042472.db2.gz JJTRXYXGCSYJQW-HNNXBMFYSA-N 2 1 301.434 3.645 20 10 DHCDMP CC[C@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1ccc(C)cc1O ZINC000373522707 336963660 /nfs/dbraw/zinc/96/36/60/336963660.db2.gz NWUVLYKIZOBXPY-HTWSVDAQSA-N 2 1 302.462 3.758 20 10 DHCDMP C[C@@H]([NH2+]C1CC[NH+](C)CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000161429154 525402221 /nfs/dbraw/zinc/40/22/21/525402221.db2.gz QHCUBUNAEGSPIV-OAHLLOKOSA-N 2 1 319.468 3.561 20 10 DHCDMP Oc1ccc(-c2ccccc2)cc1C[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000263674664 1032751479 /nfs/dbraw/zinc/75/14/79/1032751479.db2.gz KYDRPKLOZBNLEB-INIZCTEOSA-N 2 1 322.452 3.633 20 10 DHCDMP Cc1cc(C[NH2+][C@H]2CC[N@H+]3CCC[C@@H]3C2)c(C)n1-c1ccccc1 ZINC000325414290 1018467614 /nfs/dbraw/zinc/46/76/14/1018467614.db2.gz UWGNBDZJMYBSKG-PZJWPPBQSA-N 2 1 323.484 3.811 20 10 DHCDMP Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H]2CCCC[N@@H+](C)C2)c1O ZINC000858492358 1032921322 /nfs/dbraw/zinc/92/13/22/1032921322.db2.gz WHQKTKQSSYLCOH-ZIAGYGMSSA-N 2 1 310.869 3.737 20 10 DHCDMP CCCN(CCC)c1ccc(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000742374850 1021114555 /nfs/dbraw/zinc/11/45/55/1021114555.db2.gz IBRRLGJRAYCAFI-PKOBYXMFSA-N 2 1 317.521 3.885 20 10 DHCDMP C[C@H]([NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1ccccc1O ZINC000310081248 1022550632 /nfs/dbraw/zinc/55/06/32/1022550632.db2.gz JLBRBZKNMDZVKV-UWJYYQICSA-N 2 1 324.468 3.955 20 10 DHCDMP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2cc(F)ccc2O)C1 ZINC000180001395 1022607916 /nfs/dbraw/zinc/60/79/16/1022607916.db2.gz BIDORXZSNRTQOK-HZPDHXFCSA-N 2 1 320.452 3.618 20 10 DHCDMP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2cc(F)ccc2O)C1 ZINC000180001395 1022607920 /nfs/dbraw/zinc/60/79/20/1022607920.db2.gz BIDORXZSNRTQOK-HZPDHXFCSA-N 2 1 320.452 3.618 20 10 DHCDMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2cc(F)ccc2O)C1 ZINC000180001395 1022607925 /nfs/dbraw/zinc/60/79/25/1022607925.db2.gz BIDORXZSNRTQOK-HZPDHXFCSA-N 2 1 320.452 3.618 20 10 DHCDMP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2cc(F)ccc2O)C1 ZINC000180001395 1022607931 /nfs/dbraw/zinc/60/79/31/1022607931.db2.gz BIDORXZSNRTQOK-HZPDHXFCSA-N 2 1 320.452 3.618 20 10 DHCDMP CCc1cccc(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)c1O ZINC000691523769 1023576113 /nfs/dbraw/zinc/57/61/13/1023576113.db2.gz PXZKZEHQEYBFTN-UHFFFAOYSA-N 2 1 324.468 3.709 20 10 DHCDMP CC(C)[N@@H+](C)CCC[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000319118350 1025169088 /nfs/dbraw/zinc/16/90/88/1025169088.db2.gz NOIDGKPCWXWIJL-OAHLLOKOSA-N 2 1 300.446 3.926 20 10 DHCDMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000808691757 1026349802 /nfs/dbraw/zinc/34/98/02/1026349802.db2.gz NOMVWYGIKQZCIT-YPMHNXCESA-N 2 1 321.852 3.846 20 10 DHCDMP CC[C@@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)c1ccc(C)cc1O ZINC000279997910 1026571558 /nfs/dbraw/zinc/57/15/58/1026571558.db2.gz FRSMGNXRPXWDOA-RHSMWYFYSA-N 2 1 301.434 3.583 20 10 DHCDMP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816515970 1028919605 /nfs/dbraw/zinc/91/96/05/1028919605.db2.gz QMPCGJQYBTXUAE-MRXNPFEDSA-N 2 1 312.457 3.709 20 10 DHCDMP C[N@@H+](Cc1ccc2ccccc2c1O)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000816609333 1028959686 /nfs/dbraw/zinc/95/96/86/1028959686.db2.gz YCTOFFSOCBFJDM-JWTNVVGKSA-N 2 1 310.441 3.602 20 10 DHCDMP C[NH+](Cc1ccc2ccccc2c1O)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000816609333 1028959693 /nfs/dbraw/zinc/95/96/93/1028959693.db2.gz YCTOFFSOCBFJDM-JWTNVVGKSA-N 2 1 310.441 3.602 20 10 DHCDMP C[NH+](Cc1ccc2ccccc2c1O)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000816609333 1028959699 /nfs/dbraw/zinc/95/96/99/1028959699.db2.gz YCTOFFSOCBFJDM-JWTNVVGKSA-N 2 1 310.441 3.602 20 10 DHCDMP C[C@H]([NH2+][C@@H]1CCCC[C@H]1C[NH3+])c1cccc(C(F)(F)F)c1O ZINC000817960627 1029300934 /nfs/dbraw/zinc/30/09/34/1029300934.db2.gz OLSAWBJGEGWEMR-COPLHBTASA-N 2 1 316.367 3.579 20 10 DHCDMP CC[NH2+][C@H](C)C[NH2+][C@@H](CCc1ccccc1)c1ccccc1O ZINC000817972931 1029312294 /nfs/dbraw/zinc/31/22/94/1029312294.db2.gz QCWDXWJBNQWZJN-APWZRJJASA-N 2 1 312.457 3.654 20 10 DHCDMP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H](C)Cn2cc[nH+]c2C)cc1 ZINC000178697690 1034257459 /nfs/dbraw/zinc/25/74/59/1034257459.db2.gz LQIIEALQYNTGLX-HZPDHXFCSA-N 2 1 314.477 3.635 20 10 DHCDMP CC(C)[NH2+]C1CC[NH+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000179832187 1034338999 /nfs/dbraw/zinc/33/89/99/1034338999.db2.gz ONRQHVFOIBQOGX-UHFFFAOYSA-N 2 1 315.505 3.639 20 10 DHCDMP CCN(C)c1ccc(C[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)cc1 ZINC000773746942 1035435358 /nfs/dbraw/zinc/43/53/58/1035435358.db2.gz CFGMQSGRWITSCU-UHFFFAOYSA-N 2 1 317.521 3.695 20 10 DHCDMP CC(C)c1ccc(O)c(C[NH+]2CCC([NH+]3CCCCC3)CC2)c1 ZINC001180547061 1035718243 /nfs/dbraw/zinc/71/82/43/1035718243.db2.gz VEJURETVGRYZTA-UHFFFAOYSA-N 2 1 316.489 3.966 20 10 DHCDMP CCC(CC)[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CC1 ZINC000775649934 1036231741 /nfs/dbraw/zinc/23/17/41/1036231741.db2.gz VAEVBQXDNJCLME-UHFFFAOYSA-N 2 1 315.505 3.591 20 10 DHCDMP CC[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc(Cl)ccc1O ZINC000775487046 1038553221 /nfs/dbraw/zinc/55/32/21/1038553221.db2.gz GYLJACKXCOJFIO-FMKPAKJESA-N 2 1 308.853 3.713 20 10 DHCDMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](CC)c2cc(Cl)ccc2O)C1 ZINC000775491790 1038567625 /nfs/dbraw/zinc/56/76/25/1038567625.db2.gz JUMZOESCHPTYQJ-XJKSGUPXSA-N 2 1 310.869 3.818 20 10 DHCDMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccccc1O ZINC000272842030 130068459 /nfs/dbraw/zinc/06/84/59/130068459.db2.gz JVEKPVSEPHHLOL-ABSDTBQOSA-N 2 1 324.468 3.953 20 10 DHCDMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccccc1O ZINC000272842030 130068462 /nfs/dbraw/zinc/06/84/62/130068462.db2.gz JVEKPVSEPHHLOL-ABSDTBQOSA-N 2 1 324.468 3.953 20 10 DHCDMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000273399785 130117757 /nfs/dbraw/zinc/11/77/57/130117757.db2.gz MUZWCTBDKWFZOB-CQSZACIVSA-N 2 1 313.445 3.517 20 10 DHCDMP C[N@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccc(C(C)(C)C)cc1O)C2 ZINC001279393584 1013274996 /nfs/dbraw/zinc/27/49/96/1013274996.db2.gz XQQDUXYKVHBMEY-HXUWFJFHSA-N 2 1 316.489 3.607 20 10 DHCDMP C[NH+]1CC[C@@]2(C1)CCC[N@H+](Cc1ccc(C(C)(C)C)cc1O)C2 ZINC001279393584 1013275003 /nfs/dbraw/zinc/27/50/03/1013275003.db2.gz XQQDUXYKVHBMEY-HXUWFJFHSA-N 2 1 316.489 3.607 20 10 DHCDMP C[NH+]1CC[C@@]2(C1)CCC[N@@H+](Cc1ccc(C(C)(C)C)cc1O)C2 ZINC001279393584 1013275009 /nfs/dbraw/zinc/27/50/09/1013275009.db2.gz XQQDUXYKVHBMEY-HXUWFJFHSA-N 2 1 316.489 3.607 20 10 DHCDMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc3c(c2)CCO3)c1 ZINC000065976504 1014615979 /nfs/dbraw/zinc/61/59/79/1014615979.db2.gz PGZICLJMMSZNMW-UHFFFAOYSA-N 2 1 324.468 3.752 20 10 DHCDMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(N(C)C)cc2)C1 ZINC000773074815 1032548081 /nfs/dbraw/zinc/54/80/81/1032548081.db2.gz HZEDNPLVTICRFU-MSOLQXFVSA-N 2 1 317.521 3.771 20 10 DHCDMP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)c(O)c1 ZINC000186142571 1017931914 /nfs/dbraw/zinc/93/19/14/1017931914.db2.gz JNKRDHQLGAZGTE-SJORKVTESA-N 2 1 304.478 3.719 20 10 DHCDMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(F)cc2[O-])C1 ZINC000186142501 1017932128 /nfs/dbraw/zinc/93/21/28/1017932128.db2.gz LXPSOCKJBFXYHY-GJZGRUSLSA-N 2 1 308.441 3.550 20 10 DHCDMP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(F)cc2O)C1 ZINC000186142501 1017932137 /nfs/dbraw/zinc/93/21/37/1017932137.db2.gz LXPSOCKJBFXYHY-GJZGRUSLSA-N 2 1 308.441 3.550 20 10 DHCDMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(F)cc2O)C1 ZINC000186142501 1017932147 /nfs/dbraw/zinc/93/21/47/1017932147.db2.gz LXPSOCKJBFXYHY-GJZGRUSLSA-N 2 1 308.441 3.550 20 10 DHCDMP Cc1cc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)c(C)n1-c1ccccc1 ZINC000325414288 1018468967 /nfs/dbraw/zinc/46/89/67/1018468967.db2.gz UWGNBDZJMYBSKG-CTNGQTDRSA-N 2 1 323.484 3.811 20 10 DHCDMP CC[C@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1cc(Cl)ccc1O ZINC000858490704 1032916505 /nfs/dbraw/zinc/91/65/05/1032916505.db2.gz MHSJNFYLBHJNGX-CJNGLKHVSA-N 2 1 310.869 3.818 20 10 DHCDMP C[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1ccc2ccccc2c1O ZINC000858490326 1032918928 /nfs/dbraw/zinc/91/89/28/1032918928.db2.gz GFWNYCYCWRQUJS-HZPDHXFCSA-N 2 1 312.457 3.928 20 10 DHCDMP Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H]2CCCC[N@@H+](C)C2)c1O ZINC000858492356 1032921999 /nfs/dbraw/zinc/92/19/99/1032921999.db2.gz WHQKTKQSSYLCOH-UONOGXRCSA-N 2 1 310.869 3.737 20 10 DHCDMP C[C@H]1C[C@H]([NH2+]Cc2ccccc2O)CC[N@@H+]1Cc1ccccc1 ZINC000379646476 1021657344 /nfs/dbraw/zinc/65/73/44/1021657344.db2.gz JEYVYTQYAOOPBX-QFBILLFUSA-N 2 1 310.441 3.535 20 10 DHCDMP C[C@H]1C[C@H]([NH2+]Cc2ccccc2O)CC[N@H+]1Cc1ccccc1 ZINC000379646476 1021657349 /nfs/dbraw/zinc/65/73/49/1021657349.db2.gz JEYVYTQYAOOPBX-QFBILLFUSA-N 2 1 310.441 3.535 20 10 DHCDMP CC[N@H+](Cc1ccccc1O)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000179583261 1022475691 /nfs/dbraw/zinc/47/56/91/1022475691.db2.gz DVYXCMGTPRWJAI-IBGZPJMESA-N 2 1 324.468 3.736 20 10 DHCDMP CC[NH+](Cc1ccccc1O)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000179583261 1022475695 /nfs/dbraw/zinc/47/56/95/1022475695.db2.gz DVYXCMGTPRWJAI-IBGZPJMESA-N 2 1 324.468 3.736 20 10 DHCDMP CC[NH+](Cc1ccccc1O)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000179583261 1022475701 /nfs/dbraw/zinc/47/57/01/1022475701.db2.gz DVYXCMGTPRWJAI-IBGZPJMESA-N 2 1 324.468 3.736 20 10 DHCDMP C[C@@H]([NH2+][C@@H](C)c1ccccc1O)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272900419 1022517709 /nfs/dbraw/zinc/51/77/09/1022517709.db2.gz UZWNTZWZAQVWAO-ZIFCJYIRSA-N 2 1 324.468 3.953 20 10 DHCDMP Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)c(O)c1C ZINC000756546547 1022887623 /nfs/dbraw/zinc/88/76/23/1022887623.db2.gz RSJDRJPJCHARLL-IAGOWNOFSA-N 2 1 304.478 3.780 20 10 DHCDMP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)c(O)c1C ZINC000756546548 1022890303 /nfs/dbraw/zinc/89/03/03/1022890303.db2.gz RSJDRJPJCHARLL-IRXDYDNUSA-N 2 1 304.478 3.780 20 10 DHCDMP CCN(CC)c1ccc(C[N@H+](C)C2CC[NH+](CC)CC2)cc1F ZINC000768233100 1022931424 /nfs/dbraw/zinc/93/14/24/1022931424.db2.gz KVDJCQDSNKQGQP-UHFFFAOYSA-N 2 1 321.484 3.588 20 10 DHCDMP CCN(CC)c1ccc(C[N@@H+](C)C2CC[NH+](CC)CC2)cc1F ZINC000768233100 1022931432 /nfs/dbraw/zinc/93/14/32/1022931432.db2.gz KVDJCQDSNKQGQP-UHFFFAOYSA-N 2 1 321.484 3.588 20 10 DHCDMP Cc1ccc(O)c(C[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)c1 ZINC000769315682 1023119161 /nfs/dbraw/zinc/11/91/61/1023119161.db2.gz KQWRTJVWFXOBHJ-GOSISDBHSA-N 2 1 316.489 3.789 20 10 DHCDMP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(N(CC)CC)cc2)C1 ZINC000769507871 1023170885 /nfs/dbraw/zinc/17/08/85/1023170885.db2.gz POEFTRWAYJNEHE-IBGZPJMESA-N 2 1 317.521 3.697 20 10 DHCDMP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(N(CC)CC)cc2)C1 ZINC000769507871 1023170886 /nfs/dbraw/zinc/17/08/86/1023170886.db2.gz POEFTRWAYJNEHE-IBGZPJMESA-N 2 1 317.521 3.697 20 10 DHCDMP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(N(CC)CC)cc2)C1 ZINC000769507871 1023170890 /nfs/dbraw/zinc/17/08/90/1023170890.db2.gz POEFTRWAYJNEHE-IBGZPJMESA-N 2 1 317.521 3.697 20 10 DHCDMP C[C@@H]([NH2+][C@@H](C)c1c(O)cccc1F)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000886588728 1025726165 /nfs/dbraw/zinc/72/61/65/1025726165.db2.gz XXONVWGFNGYVCD-QLFBSQMISA-N 2 1 320.452 3.835 20 10 DHCDMP C[C@@H]([NH2+][C@@H](C)c1c(O)cccc1F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000886588728 1025726178 /nfs/dbraw/zinc/72/61/78/1025726178.db2.gz XXONVWGFNGYVCD-QLFBSQMISA-N 2 1 320.452 3.835 20 10 DHCDMP CCN(CC)c1ccc(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1 ZINC000289806164 1026181648 /nfs/dbraw/zinc/18/16/48/1026181648.db2.gz SPQVDNHAUSWLPG-YOFSQIOKSA-N 2 1 315.505 3.590 20 10 DHCDMP CC[C@@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1ccc(C)cc1O ZINC000280286013 1026626172 /nfs/dbraw/zinc/62/61/72/1026626172.db2.gz YVRWNVXCBULHCK-GOSISDBHSA-N 2 1 302.462 3.758 20 10 DHCDMP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc3ccccc3c2O)C1 ZINC000816516975 1028917888 /nfs/dbraw/zinc/91/78/88/1028917888.db2.gz ZBWPSBGXNQKCBK-INIZCTEOSA-N 2 1 312.457 3.709 20 10 DHCDMP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816516975 1028917903 /nfs/dbraw/zinc/91/79/03/1028917903.db2.gz ZBWPSBGXNQKCBK-INIZCTEOSA-N 2 1 312.457 3.709 20 10 DHCDMP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816516975 1028917919 /nfs/dbraw/zinc/91/79/19/1028917919.db2.gz ZBWPSBGXNQKCBK-INIZCTEOSA-N 2 1 312.457 3.709 20 10 DHCDMP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]CCc2ccc(N)cc2)cc1 ZINC000817955831 1029293168 /nfs/dbraw/zinc/29/31/68/1029293168.db2.gz ISRAGCFHXWWSOT-HNNXBMFYSA-N 2 1 320.440 3.656 20 10 DHCDMP CC(C)[NH2+]CCC[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000817953971 1029295118 /nfs/dbraw/zinc/29/51/18/1029295118.db2.gz TZFGYRIBVDPCCI-JTQLQIEISA-N 2 1 305.249 3.738 20 10 DHCDMP C[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)c1cc(Cl)c(Cl)cc1O ZINC000817965240 1029305839 /nfs/dbraw/zinc/30/58/39/1029305839.db2.gz ROOKGFXHIYXYTP-SNVBAGLBSA-N 2 1 317.260 3.739 20 10 DHCDMP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1cc(Cl)c(Cl)cc1O ZINC000817970275 1029310384 /nfs/dbraw/zinc/31/03/84/1029310384.db2.gz QHTXQZVSFWMONS-AEJSXWLSSA-N 2 1 303.233 3.620 20 10 DHCDMP C[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cc(Cl)c(Cl)cc1O ZINC000817979394 1029316787 /nfs/dbraw/zinc/31/67/87/1029316787.db2.gz AQUGCAUMPXWXAI-MNOVXSKESA-N 2 1 317.260 3.882 20 10 DHCDMP C[C@H]([NH2+]C[C@H]1CC[N@H+](C)[C@@H]1c1cccs1)c1ccccc1O ZINC000374711563 1029441448 /nfs/dbraw/zinc/44/14/48/1029441448.db2.gz RKMNOXSFHVTKSP-IYOUNJFTSA-N 2 1 316.470 3.797 20 10 DHCDMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C)[C@@H]1c1cccs1)c1ccccc1O ZINC000374711563 1029441453 /nfs/dbraw/zinc/44/14/53/1029441453.db2.gz RKMNOXSFHVTKSP-IYOUNJFTSA-N 2 1 316.470 3.797 20 10 DHCDMP C[C@H]([NH2+]C[C@H]1CC[N@H+](C)[C@H]1c1cccs1)c1ccccc1O ZINC000374711564 1029441486 /nfs/dbraw/zinc/44/14/86/1029441486.db2.gz RKMNOXSFHVTKSP-PMUMKWKESA-N 2 1 316.470 3.797 20 10 DHCDMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C)[C@H]1c1cccs1)c1ccccc1O ZINC000374711564 1029441494 /nfs/dbraw/zinc/44/14/94/1029441494.db2.gz RKMNOXSFHVTKSP-PMUMKWKESA-N 2 1 316.470 3.797 20 10 DHCDMP C[C@H]([NH2+]C[C@@H]1CC[N@H+](C)[C@@H]1c1cccs1)c1ccccc1O ZINC000374711562 1029442241 /nfs/dbraw/zinc/44/22/41/1029442241.db2.gz RKMNOXSFHVTKSP-DEYYWGMASA-N 2 1 316.470 3.797 20 10 DHCDMP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C)[C@@H]1c1cccs1)c1ccccc1O ZINC000374711562 1029442250 /nfs/dbraw/zinc/44/22/50/1029442250.db2.gz RKMNOXSFHVTKSP-DEYYWGMASA-N 2 1 316.470 3.797 20 10 DHCDMP CC[NH+](CC)C1CCC([N@@H+](CC)Cc2ccccc2O)CC1 ZINC001173113374 1033548125 /nfs/dbraw/zinc/54/81/25/1033548125.db2.gz OMVUTVDVPMXJPZ-UHFFFAOYSA-N 2 1 304.478 3.867 20 10 DHCDMP C[C@H](c1ccccc1)[N@@H+](CCn1ccnc1)Cc1ccccc1O ZINC000176682850 1034103386 /nfs/dbraw/zinc/10/33/86/1034103386.db2.gz TXUJALHWVQABOV-QGZVFWFLSA-N 2 1 321.424 3.852 20 10 DHCDMP CC[C@@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)c1ccc(N(C)C)cc1 ZINC000178701564 1034257189 /nfs/dbraw/zinc/25/71/89/1034257189.db2.gz PYCLSIKHKZGWLN-DNVCBOLYSA-N 2 1 314.477 3.635 20 10 DHCDMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccc1O ZINC000183489486 1034390188 /nfs/dbraw/zinc/39/01/88/1034390188.db2.gz ORJRQQWXVNRLON-IEBWSBKVSA-N 2 1 324.468 3.607 20 10 DHCDMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cc(F)ccc1O ZINC000186518918 1034637384 /nfs/dbraw/zinc/63/73/84/1034637384.db2.gz FPQLFRJDJAAAKD-SOUVJXGZSA-N 2 1 320.452 3.835 20 10 DHCDMP CC(C)c1ccc(O)c(C[N@H+]2CCCC3(CC[NH+](C)CC3)C2)c1 ZINC001181244398 1035867989 /nfs/dbraw/zinc/86/79/89/1035867989.db2.gz RMKSJISYGUSIFI-UHFFFAOYSA-N 2 1 316.489 3.823 20 10 DHCDMP C[C@@H]([NH2+]CCCC[NH+](C)C)c1cc(Cl)c(Cl)cc1O ZINC000774160137 1036206500 /nfs/dbraw/zinc/20/65/00/1036206500.db2.gz RYADJYOZKZCKBC-SNVBAGLBSA-N 2 1 305.249 3.691 20 10 DHCDMP Cc1[nH+]ccn1CCC[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000762925585 1037073416 /nfs/dbraw/zinc/07/34/16/1037073416.db2.gz IJOOORYIHWXVOX-UHFFFAOYSA-N 2 1 313.445 3.732 20 10 DHCDMP Cc1[nH+]ccn1CCC[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000762925585 1037073435 /nfs/dbraw/zinc/07/34/35/1037073435.db2.gz IJOOORYIHWXVOX-UHFFFAOYSA-N 2 1 313.445 3.732 20 10 DHCDMP Cc1cc(O)c(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)cc1C(C)C ZINC000164680724 1038268297 /nfs/dbraw/zinc/26/82/97/1038268297.db2.gz QTKOQFAEIXDZJA-VQIMIIECSA-N 2 1 316.489 3.740 20 10 DHCDMP Cc1cc(O)c(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)cc1C(C)C ZINC000164680724 1038268305 /nfs/dbraw/zinc/26/83/05/1038268305.db2.gz QTKOQFAEIXDZJA-VQIMIIECSA-N 2 1 316.489 3.740 20 10 DHCDMP Cc1cc(O)c(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cc1C(C)C ZINC000164680724 1038268312 /nfs/dbraw/zinc/26/83/12/1038268312.db2.gz QTKOQFAEIXDZJA-VQIMIIECSA-N 2 1 316.489 3.740 20 10 DHCDMP CC[C@H]([NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccccc1O ZINC000775486674 1038554540 /nfs/dbraw/zinc/55/45/40/1038554540.db2.gz DNQFISVKFFTNMD-JZXOWHBKSA-N 2 1 304.478 3.801 20 10 DHCDMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](CC)c2cc(Cl)ccc2O)C1 ZINC000775491789 1038567509 /nfs/dbraw/zinc/56/75/09/1038567509.db2.gz JUMZOESCHPTYQJ-CZUORRHYSA-N 2 1 310.869 3.818 20 10 DHCDMP CC[N@@H+](Cc1ccccc1O)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001168004786 1014377197 /nfs/dbraw/zinc/37/71/97/1014377197.db2.gz ZCSAPCJXIAPFBP-DFNIBXOVSA-N 2 1 314.473 3.620 20 10 DHCDMP CC[NH+](Cc1ccccc1O)C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001168004786 1014377208 /nfs/dbraw/zinc/37/72/08/1014377208.db2.gz ZCSAPCJXIAPFBP-DFNIBXOVSA-N 2 1 314.473 3.620 20 10 DHCDMP CC[NH+](Cc1ccccc1O)C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1 ZINC001168004786 1014377220 /nfs/dbraw/zinc/37/72/20/1014377220.db2.gz ZCSAPCJXIAPFBP-DFNIBXOVSA-N 2 1 314.473 3.620 20 10 DHCDMP Oc1ccccc1C[NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccccc1)C2 ZINC000716648991 1032698900 /nfs/dbraw/zinc/69/89/00/1032698900.db2.gz HBAPZVHYJWPCGU-IHPCNDPISA-N 2 1 322.452 3.535 20 10 DHCDMP Cc1[nH+]ccn1CCC[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000263707746 1032759403 /nfs/dbraw/zinc/75/94/03/1032759403.db2.gz SVDLFRSYGBAZTD-UHFFFAOYSA-N 2 1 321.424 3.744 20 10 DHCDMP C[N@@H+](CCC[NH+]1CCCC1)Cc1ccc(N2CCCCC2)cc1 ZINC000727769574 1019774907 /nfs/dbraw/zinc/77/49/07/1019774907.db2.gz FYEBREZXGAEDHX-UHFFFAOYSA-N 2 1 315.505 3.595 20 10 DHCDMP CCCN(CCC)c1ccc(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000742374847 1021114698 /nfs/dbraw/zinc/11/46/98/1021114698.db2.gz IBRRLGJRAYCAFI-HKUYNNGSSA-N 2 1 317.521 3.885 20 10 DHCDMP CN(C)c1ccc(C[NH2+]C[C@H]2CC[N@@H+](C)[C@H]2c2ccccc2)cc1 ZINC000377757668 1021850620 /nfs/dbraw/zinc/85/06/20/1021850620.db2.gz AIZJDMGEGGNQFS-CTNGQTDRSA-N 2 1 323.484 3.535 20 10 DHCDMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1cc(Cl)ccc1O ZINC000853240647 1022241027 /nfs/dbraw/zinc/24/10/27/1022241027.db2.gz QDXZMNFFNPOUGO-DZGCQCFKSA-N 2 1 322.880 3.818 20 10 DHCDMP CCN(CC)c1ccc(C[NH+](C)[C@H]2CC[N@H+](CC)C[C@@H]2C)cc1 ZINC000769481887 1023152953 /nfs/dbraw/zinc/15/29/53/1023152953.db2.gz ANRPKFDXLQNIKQ-PXNSSMCTSA-N 2 1 317.521 3.695 20 10 DHCDMP CCN(CC)c1ccc(C[NH+](C)[C@H]2CC[N@@H+](CC)C[C@@H]2C)cc1 ZINC000769481887 1023152957 /nfs/dbraw/zinc/15/29/57/1023152957.db2.gz ANRPKFDXLQNIKQ-PXNSSMCTSA-N 2 1 317.521 3.695 20 10 DHCDMP CC[C@@H](CC(C)C)[NH2+]C1CC[NH+](Cc2ccccc2O)CC1 ZINC001172394226 1033178608 /nfs/dbraw/zinc/17/86/08/1033178608.db2.gz OYZBVLHQHSSLGS-KRWDZBQOSA-N 2 1 304.478 3.771 20 10 DHCDMP CCC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)C1 ZINC000808680485 1026347485 /nfs/dbraw/zinc/34/74/85/1026347485.db2.gz MJVZFABKSZLTGX-ZIAGYGMSSA-N 2 1 310.869 3.737 20 10 DHCDMP [NH3+][C@H]1C[C@@H]([NH2+]Cc2ccc(N3CCCC3)cc2)c2ccccc21 ZINC000817900461 1029270506 /nfs/dbraw/zinc/27/05/06/1029270506.db2.gz SRSWYMAMQIVEBU-VQTJNVASSA-N 2 1 307.441 3.521 20 10 DHCDMP CC[C@H]([NH2+]Cc1ccc([C@@H](C)[NH3+])cc1)c1ccc(F)cc1O ZINC000817962148 1029300185 /nfs/dbraw/zinc/30/01/85/1029300185.db2.gz GMNHXLOFOOBYAY-PXAZEXFGSA-N 2 1 302.393 3.792 20 10 DHCDMP C[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cccc(C(F)(F)F)c1O ZINC000817979445 1029318129 /nfs/dbraw/zinc/31/81/29/1029318129.db2.gz BCYXTKZRRCYAGM-NWDGAFQWSA-N 2 1 316.367 3.594 20 10 DHCDMP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1cc(Cl)c(Cl)cc1O ZINC000817985436 1029324503 /nfs/dbraw/zinc/32/45/03/1029324503.db2.gz KBQPSUFJVFEQEN-JTQLQIEISA-N 2 1 315.244 3.659 20 10 DHCDMP C[C@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1ccc(Cl)cc1O ZINC000866516855 1030341171 /nfs/dbraw/zinc/34/11/71/1030341171.db2.gz DGUFACAKXXBYQM-MKQDKFQKSA-N 2 1 310.869 3.959 20 10 DHCDMP CCCOc1ccc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1C ZINC000873014453 1031693300 /nfs/dbraw/zinc/69/33/00/1031693300.db2.gz RONAPINCOHFKHW-MSOLQXFVSA-N 2 1 302.462 3.500 20 10 DHCDMP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1cccc(C(F)(F)F)c1O ZINC000873239221 1031769109 /nfs/dbraw/zinc/76/91/09/1031769109.db2.gz QALBMTIDHMDGKR-SRVKXCTJSA-N 2 1 316.367 3.579 20 10 DHCDMP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H](CCc1ccccc1)c1ccccc1O ZINC000863543721 1034124330 /nfs/dbraw/zinc/12/43/30/1034124330.db2.gz WOPAYJPQKVPKBC-XUVXKRRUSA-N 2 1 324.468 3.796 20 10 DHCDMP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cc(Cl)c(Cl)cc1O ZINC000774274421 1036273007 /nfs/dbraw/zinc/27/30/07/1036273007.db2.gz SYOZPDXXKDFBNT-JTQLQIEISA-N 2 1 315.244 3.612 20 10 DHCDMP C[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1cc(Cl)c(Cl)cc1O ZINC000774274421 1036273022 /nfs/dbraw/zinc/27/30/22/1036273022.db2.gz SYOZPDXXKDFBNT-JTQLQIEISA-N 2 1 315.244 3.612 20 10 DHCDMP Cc1cc(Cl)cc(C[N@H+](C)CC[C@@H]2CCCC[NH+]2C)c1O ZINC000775716738 1036524626 /nfs/dbraw/zinc/52/46/26/1036524626.db2.gz MXJXTJMONOJTCJ-INIZCTEOSA-N 2 1 310.869 3.660 20 10 DHCDMP Cc1cc(Cl)cc(C[N@@H+](C)CC[C@@H]2CCCC[NH+]2C)c1O ZINC000775716738 1036524633 /nfs/dbraw/zinc/52/46/33/1036524633.db2.gz MXJXTJMONOJTCJ-INIZCTEOSA-N 2 1 310.869 3.660 20 10 DHCDMP Cc1cc(Cl)cc(C[NH+](C)CC[C@@H]2CCCC[N@@H+]2C)c1O ZINC000775716738 1036524643 /nfs/dbraw/zinc/52/46/43/1036524643.db2.gz MXJXTJMONOJTCJ-INIZCTEOSA-N 2 1 310.869 3.660 20 10 DHCDMP Cc1cc(Cl)cc(C[NH+](C)CC[C@@H]2CCCC[N@H+]2C)c1O ZINC000775716738 1036524655 /nfs/dbraw/zinc/52/46/55/1036524655.db2.gz MXJXTJMONOJTCJ-INIZCTEOSA-N 2 1 310.869 3.660 20 10 DHCDMP C[C@H]1C[C@@H]([NH+](C)Cc2ccc(N3CCCCC3)cc2)CC[N@@H+]1C ZINC000093643820 193280088 /nfs/dbraw/zinc/28/00/88/193280088.db2.gz GCEYNGOCJYGTGA-PXNSSMCTSA-N 2 1 315.505 3.591 20 10 DHCDMP C[C@H]1C[C@@H]([NH+](C)Cc2ccc(N3CCCCC3)cc2)CC[N@H+]1C ZINC000093643820 193280090 /nfs/dbraw/zinc/28/00/90/193280090.db2.gz GCEYNGOCJYGTGA-PXNSSMCTSA-N 2 1 315.505 3.591 20 10 DHCDMP C[C@H]1C[C@@H]([N@H+](C)Cc2ccc(N3CCCCC3)cc2)CC[NH+]1C ZINC000093643820 193280092 /nfs/dbraw/zinc/28/00/92/193280092.db2.gz GCEYNGOCJYGTGA-PXNSSMCTSA-N 2 1 315.505 3.591 20 10 DHCDMP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(N3CCCCC3)cc2)CC[NH+]1C ZINC000093643820 193280096 /nfs/dbraw/zinc/28/00/96/193280096.db2.gz GCEYNGOCJYGTGA-PXNSSMCTSA-N 2 1 315.505 3.591 20 10 DHCDMP C[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(Cl)c(Cl)c1[O-] ZINC000273533102 130133747 /nfs/dbraw/zinc/13/37/47/130133747.db2.gz WSULCIBMSJGNGT-JTQLQIEISA-N 2 1 315.244 3.612 20 10 DHCDMP CC[NH+]1CCC([NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)CC1 ZINC000159313619 521579592 /nfs/dbraw/zinc/57/95/92/521579592.db2.gz ZCGQCLFZOMLXIT-KRWDZBQOSA-N 2 1 315.505 3.812 20 10 DHCDMP CC[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccc(F)cc1O ZINC000285478379 535919101 /nfs/dbraw/zinc/91/91/01/535919101.db2.gz BGQIWFBIMRTIFL-SFHVURJKSA-N 2 1 316.420 3.834 20 10 DHCDMP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ccc(F)cc1O ZINC000185034240 1016523954 /nfs/dbraw/zinc/52/39/54/1016523954.db2.gz FNUKFEGWKZASNT-CABCVRRESA-N 2 1 308.441 3.694 20 10 DHCDMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccc(F)cc1O ZINC000185034240 1016523966 /nfs/dbraw/zinc/52/39/66/1016523966.db2.gz FNUKFEGWKZASNT-CABCVRRESA-N 2 1 308.441 3.694 20 10 DHCDMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)C1 ZINC000185112507 1016578179 /nfs/dbraw/zinc/57/81/79/1016578179.db2.gz WGGGPJPFQKLBOA-JKSUJKDBSA-N 2 1 316.489 3.654 20 10 DHCDMP C[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1cc2c(cc1O)CCCC2 ZINC000858490603 1032916477 /nfs/dbraw/zinc/91/64/77/1032916477.db2.gz KKZOLLXJKGXPPS-HOTGVXAUSA-N 2 1 316.489 3.654 20 10 DHCDMP Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H]2CCCC[N@@H+](C)C2)c1O ZINC000858492349 1032921069 /nfs/dbraw/zinc/92/10/69/1032921069.db2.gz WHQKTKQSSYLCOH-KBPBESRZSA-N 2 1 310.869 3.737 20 10 DHCDMP CCN(CC)c1ccc(C[NH2+]CCC[NH+]2CCCCC2)cc1F ZINC000740000285 1020923014 /nfs/dbraw/zinc/92/30/14/1020923014.db2.gz AAUZFSFRUGFMGX-UHFFFAOYSA-N 2 1 321.484 3.638 20 10 DHCDMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1ccc(F)cc1O ZINC000853241906 1022242432 /nfs/dbraw/zinc/24/24/32/1022242432.db2.gz YSFTWMVCEBYGTK-MAUKXSAKSA-N 2 1 320.452 3.694 20 10 DHCDMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(F)cc1O ZINC000853241906 1022242436 /nfs/dbraw/zinc/24/24/36/1022242436.db2.gz YSFTWMVCEBYGTK-MAUKXSAKSA-N 2 1 320.452 3.694 20 10 DHCDMP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccccc1O ZINC000853239336 1022242466 /nfs/dbraw/zinc/24/24/66/1022242466.db2.gz FTVWHHVFCYAOLD-AEFFLSMTSA-N 2 1 302.462 3.555 20 10 DHCDMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccccc1O ZINC000272842040 1022516463 /nfs/dbraw/zinc/51/64/63/1022516463.db2.gz JVEKPVSEPHHLOL-ZWOKBUDYSA-N 2 1 324.468 3.953 20 10 DHCDMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccccc1O ZINC000272842040 1022516468 /nfs/dbraw/zinc/51/64/68/1022516468.db2.gz JVEKPVSEPHHLOL-ZWOKBUDYSA-N 2 1 324.468 3.953 20 10 DHCDMP CCN(CC)c1ccc(C[N@@H+](C)[C@H]2CC[NH+](CC)[C@H](C)C2)cc1 ZINC000769470650 1023160859 /nfs/dbraw/zinc/16/08/59/1023160859.db2.gz NEBXSSDZPTXTAB-XLIONFOSSA-N 2 1 317.521 3.837 20 10 DHCDMP CCN(CC)c1ccc(C[NH+](C)[C@H]2CC[N@H+](CC)[C@H](C)C2)cc1 ZINC000769470650 1023160868 /nfs/dbraw/zinc/16/08/68/1023160868.db2.gz NEBXSSDZPTXTAB-XLIONFOSSA-N 2 1 317.521 3.837 20 10 DHCDMP CCN(CC)c1ccc(C[NH+](C)[C@H]2CC[N@@H+](CC)[C@H](C)C2)cc1 ZINC000769470650 1023160871 /nfs/dbraw/zinc/16/08/71/1023160871.db2.gz NEBXSSDZPTXTAB-XLIONFOSSA-N 2 1 317.521 3.837 20 10 DHCDMP C[C@@H]1CC[C@H]([NH2+]C2CC[NH+](Cc3ccccc3O)CC2)C[C@@H]1C ZINC001172367579 1033146942 /nfs/dbraw/zinc/14/69/42/1033146942.db2.gz GRQVRGBHXYSNJV-GJYPPUQNSA-N 2 1 316.489 3.771 20 10 DHCDMP Cc1cccc(O)c1C[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000876981418 1033197448 /nfs/dbraw/zinc/19/74/48/1033197448.db2.gz PLAZXHMSENZILH-UHFFFAOYSA-N 2 1 312.457 3.831 20 10 DHCDMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(N3CCCCC3)cc2)CC[N@@H+]1C ZINC000093643819 1026121017 /nfs/dbraw/zinc/12/10/17/1026121017.db2.gz GCEYNGOCJYGTGA-XLIONFOSSA-N 2 1 315.505 3.591 20 10 DHCDMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(N3CCCCC3)cc2)CC[N@H+]1C ZINC000093643819 1026121025 /nfs/dbraw/zinc/12/10/25/1026121025.db2.gz GCEYNGOCJYGTGA-XLIONFOSSA-N 2 1 315.505 3.591 20 10 DHCDMP C[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(N3CCCCC3)cc2)CC[NH+]1C ZINC000093643819 1026121031 /nfs/dbraw/zinc/12/10/31/1026121031.db2.gz GCEYNGOCJYGTGA-XLIONFOSSA-N 2 1 315.505 3.591 20 10 DHCDMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(N3CCCCC3)cc2)CC[NH+]1C ZINC000093643819 1026121041 /nfs/dbraw/zinc/12/10/41/1026121041.db2.gz GCEYNGOCJYGTGA-XLIONFOSSA-N 2 1 315.505 3.591 20 10 DHCDMP Cc1cc(Cl)cc([C@H](C)[NH2+]C2CC[NH+](C(C)C)CC2)c1O ZINC000808705411 1026358430 /nfs/dbraw/zinc/35/84/30/1026358430.db2.gz YUNXBSYBPOBJLS-ZDUSSCGKSA-N 2 1 310.869 3.877 20 10 DHCDMP CC[N@@H+](CCC[NH+](C)C)Cc1cc(-c2ccccc2)ccc1O ZINC000809749675 1026613896 /nfs/dbraw/zinc/61/38/96/1026613896.db2.gz JGLZYDPZKXOJDO-UHFFFAOYSA-N 2 1 312.457 3.833 20 10 DHCDMP CCCN(CCC)c1ccc(C[N@H+]2CC[C@H]([NH3+])C[C@H]2C)cc1 ZINC000846699571 1032043674 /nfs/dbraw/zinc/04/36/74/1032043674.db2.gz UTTGPDBGQXHJNO-AEFFLSMTSA-N 2 1 303.494 3.625 20 10 DHCDMP Cc1ccc(C[NH+]2CCC(C)([NH+]3CCCCC3)CC2)c(O)c1 ZINC000877794238 1033455211 /nfs/dbraw/zinc/45/52/11/1033455211.db2.gz HYKAFSYCDJNQRV-UHFFFAOYSA-N 2 1 302.462 3.541 20 10 DHCDMP CC[C@H]1CC[C@@H]([NH2+]C2CC[NH+](Cc3ccccc3O)CC2)C1 ZINC001173270832 1033640822 /nfs/dbraw/zinc/64/08/22/1033640822.db2.gz CVEDZPZUSDAAQF-MAUKXSAKSA-N 2 1 302.462 3.525 20 10 DHCDMP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000185352346 1034542889 /nfs/dbraw/zinc/54/28/89/1034542889.db2.gz XJQLPNCVUYJQIN-AWEZNQCLSA-N 2 1 316.420 3.834 20 10 DHCDMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(F)cc2O)c1 ZINC000185352346 1034542902 /nfs/dbraw/zinc/54/29/02/1034542902.db2.gz XJQLPNCVUYJQIN-AWEZNQCLSA-N 2 1 316.420 3.834 20 10 DHCDMP CC[NH+](CC)CCC[N@@H+](CC)Cc1ccc(N(C)C)cc1C ZINC001181497637 1035928307 /nfs/dbraw/zinc/92/83/07/1035928307.db2.gz KONRUMPNBFFMDT-UHFFFAOYSA-N 2 1 305.510 3.615 20 10 DHCDMP Cc1cc(O)c(C[NH2+]CCC[NH+]2C[C@H](C)C[C@@H](C)C2)c(Cl)c1 ZINC001199329354 1037245420 /nfs/dbraw/zinc/24/54/20/1037245420.db2.gz RBZRGRULQBZLRN-HUUCEWRRSA-N 2 1 324.896 3.812 20 10 DHCDMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](CC)c2ccc(N(C)C)cc2)C1 ZINC000151117838 1037726257 /nfs/dbraw/zinc/72/62/57/1037726257.db2.gz CQGWGMKBZXIAOL-APWZRJJASA-N 2 1 303.494 3.525 20 10 DHCDMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1)c1ccccc1O ZINC000156812821 1038324592 /nfs/dbraw/zinc/32/45/92/1038324592.db2.gz NNCVJCOKGXDMHW-WMZOPIPTSA-N 2 1 304.478 3.801 20 10 DHCDMP CC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1)c1ccccc1O ZINC000156813234 1038325497 /nfs/dbraw/zinc/32/54/97/1038325497.db2.gz NNCVJCOKGXDMHW-SJLPKXTDSA-N 2 1 304.478 3.801 20 10 DHCDMP C[C@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1ccc2ccccc2c1O ZINC000278983500 334104653 /nfs/dbraw/zinc/10/46/53/334104653.db2.gz PCWJDWKURIMRIA-LSDHHAIUSA-N 2 1 321.424 3.655 20 10 DHCDMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cc2c(cc1O)CCCC2 ZINC000363845188 525571274 /nfs/dbraw/zinc/57/12/74/525571274.db2.gz AQLHAUFAKJRSPL-QGTPRVQTSA-N 2 1 314.473 3.548 20 10 DHCDMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1c(O)ccc2ccccc21 ZINC000162840407 527410908 /nfs/dbraw/zinc/41/09/08/527410908.db2.gz CRUIGJZZZZDWRD-UHFFFAOYSA-N 2 1 309.413 3.572 20 10 DHCDMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1c(O)ccc2ccccc21 ZINC000162840407 527410915 /nfs/dbraw/zinc/41/09/15/527410915.db2.gz CRUIGJZZZZDWRD-UHFFFAOYSA-N 2 1 309.413 3.572 20 10 DHCDMP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1)c1ccc(F)cc1O ZINC000286136921 535911882 /nfs/dbraw/zinc/91/18/82/535911882.db2.gz OUIMVYOLLVCSRO-PBHICJAKSA-N 2 1 308.441 3.692 20 10 DHCDMP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1ccc(F)cc1O ZINC000286136921 535911885 /nfs/dbraw/zinc/91/18/85/535911885.db2.gz OUIMVYOLLVCSRO-PBHICJAKSA-N 2 1 308.441 3.692 20 10 DHCDMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000158087489 1016323456 /nfs/dbraw/zinc/32/34/56/1016323456.db2.gz KRVCDDOOMYTJJU-ZWKOTPCHSA-N 2 1 315.505 3.669 20 10 DHCDMP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)c(O)c1 ZINC000186142586 1017931774 /nfs/dbraw/zinc/93/17/74/1017931774.db2.gz JNKRDHQLGAZGTE-IRXDYDNUSA-N 2 1 304.478 3.719 20 10 DHCDMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2ccc3c(c2)CCCO3)c1 ZINC000921685849 1020441687 /nfs/dbraw/zinc/44/16/87/1020441687.db2.gz AYZWAYFUYYHIBL-UHFFFAOYSA-N 2 1 324.468 3.753 20 10 DHCDMP C[C@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1ccc2ccccc2c1O ZINC000858490327 1032916729 /nfs/dbraw/zinc/91/67/29/1032916729.db2.gz GFWNYCYCWRQUJS-JKSUJKDBSA-N 2 1 312.457 3.928 20 10 DHCDMP Cc1cc(O)c(C[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc1C(C)C ZINC000739875419 1020919517 /nfs/dbraw/zinc/91/95/17/1020919517.db2.gz JNZFEVWMIDPUFB-KRWDZBQOSA-N 2 1 316.489 3.742 20 10 DHCDMP C[C@H]1C[C@H]([NH2+]Cc2cc(-c3ccccc3)ccc2O)CC[N@@H+]1C ZINC000742375630 1021114218 /nfs/dbraw/zinc/11/42/18/1021114218.db2.gz SRFYMWWKYLFNRA-HNAYVOBHSA-N 2 1 310.441 3.632 20 10 DHCDMP C[C@H]1C[C@H]([NH2+]Cc2cc(-c3ccccc3)ccc2O)CC[N@H+]1C ZINC000742375630 1021114222 /nfs/dbraw/zinc/11/42/22/1021114222.db2.gz SRFYMWWKYLFNRA-HNAYVOBHSA-N 2 1 310.441 3.632 20 10 DHCDMP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)c(O)c1C ZINC000853239114 1022238883 /nfs/dbraw/zinc/23/88/83/1022238883.db2.gz AFSNOHMGARPHOJ-WMZOPIPTSA-N 2 1 316.489 3.782 20 10 DHCDMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccccc1O ZINC000183723210 1022361780 /nfs/dbraw/zinc/36/17/80/1022361780.db2.gz KLHNBIKETDBICT-HRCADAONSA-N 2 1 302.462 3.696 20 10 DHCDMP C[C@H]([NH2+]CC1([NH3+])CCCC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000854222822 1022433899 /nfs/dbraw/zinc/43/38/99/1022433899.db2.gz LHBZTNQDGXZESY-HNNXBMFYSA-N 2 1 319.468 3.738 20 10 DHCDMP Cc1cccc(C[NH2+][C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1O ZINC000272670392 1022511852 /nfs/dbraw/zinc/51/18/52/1022511852.db2.gz SVRBYKHLKWPPDE-XLIONFOSSA-N 2 1 324.468 3.701 20 10 DHCDMP Cc1cccc(C[NH2+]C[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)c1O ZINC000310069280 1022552296 /nfs/dbraw/zinc/55/22/96/1022552296.db2.gz CSROKURIDULDEU-NRFANRHFSA-N 2 1 324.468 3.702 20 10 DHCDMP CCCC[N@@H+](C)CC1CC[NH+](Cc2ccc(N(C)C)cc2)CC1 ZINC000768304256 1022944807 /nfs/dbraw/zinc/94/48/07/1022944807.db2.gz WIGLHGRNONVUGG-UHFFFAOYSA-N 2 1 317.521 3.697 20 10 DHCDMP C[NH+](C)CCCCCCC[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000790959539 1024405263 /nfs/dbraw/zinc/40/52/63/1024405263.db2.gz ZDVJDXRSHZFDFI-UHFFFAOYSA-N 2 1 316.848 3.786 20 10 DHCDMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1c(O)cccc1F ZINC000886588729 1025727614 /nfs/dbraw/zinc/72/76/14/1025727614.db2.gz XXONVWGFNGYVCD-SOUVJXGZSA-N 2 1 320.452 3.835 20 10 DHCDMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1c(O)cccc1F ZINC000886588729 1025727621 /nfs/dbraw/zinc/72/76/21/1025727621.db2.gz XXONVWGFNGYVCD-SOUVJXGZSA-N 2 1 320.452 3.835 20 10 DHCDMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)C1 ZINC000808680484 1026348019 /nfs/dbraw/zinc/34/80/19/1026348019.db2.gz MJVZFABKSZLTGX-UONOGXRCSA-N 2 1 310.869 3.737 20 10 DHCDMP Cc1cc(Cl)cc(C[N@@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)c1O ZINC000809757340 1026618575 /nfs/dbraw/zinc/61/85/75/1026618575.db2.gz YXHOCTPXEWFXAP-HNNXBMFYSA-N 2 1 322.880 3.518 20 10 DHCDMP C[C@H]1CCCC[N@H+]1CCCC[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000295814426 1027441829 /nfs/dbraw/zinc/44/18/29/1027441829.db2.gz CYTPILNWDMNZSH-DOTOQJQBSA-N 2 1 302.462 3.624 20 10 DHCDMP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1cc(Cl)c(Cl)cc1O ZINC000873239075 1031770274 /nfs/dbraw/zinc/77/02/74/1031770274.db2.gz NHGIYOUUHSPSKF-DCAQKATOSA-N 2 1 317.260 3.867 20 10 DHCDMP CC[N@@H+](CCC[NH2+]Cc1cccc(OC)c1O)C1CCCCC1 ZINC000846022126 1031814883 /nfs/dbraw/zinc/81/48/83/1031814883.db2.gz FSSTWMGOBMXRRQ-UHFFFAOYSA-N 2 1 320.477 3.535 20 10 DHCDMP CC1([NH+]2CCCC2)CCC([NH2+]Cc2cc(F)c(F)cc2O)CC1 ZINC001183866114 1036699998 /nfs/dbraw/zinc/69/99/98/1036699998.db2.gz XULYVESJIYNOEN-UHFFFAOYSA-N 2 1 324.415 3.557 20 10 DHCDMP Cc1cc(O)c(C[NH2+]CCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c(Cl)c1 ZINC001199329342 1037244756 /nfs/dbraw/zinc/24/47/56/1037244756.db2.gz RBZRGRULQBZLRN-GASCZTMLSA-N 2 1 324.896 3.812 20 10 DHCDMP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](C2CC2)C1)c1cc(Cl)ccc1O ZINC000775493280 1038570363 /nfs/dbraw/zinc/57/03/63/1038570363.db2.gz WXICDCCGKNTXIR-LRDDRELGSA-N 2 1 308.853 3.571 20 10 DHCDMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1)c1ccc(F)cc1O ZINC000286138805 131221415 /nfs/dbraw/zinc/22/14/15/131221415.db2.gz OUIMVYOLLVCSRO-YOEHRIQHSA-N 2 1 308.441 3.692 20 10 DHCDMP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1ccc(F)cc1O ZINC000286138805 131221416 /nfs/dbraw/zinc/22/14/16/131221416.db2.gz OUIMVYOLLVCSRO-YOEHRIQHSA-N 2 1 308.441 3.692 20 10 DHCDMP CC[NH+]1CCC([NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)CC1 ZINC000159313749 521579733 /nfs/dbraw/zinc/57/97/33/521579733.db2.gz ZCGQCLFZOMLXIT-QGZVFWFLSA-N 2 1 315.505 3.812 20 10 DHCDMP C[NH+](C)[C@@H]1CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000277329134 1016206395 /nfs/dbraw/zinc/20/63/95/1016206395.db2.gz CNQWGUKYTDGPGN-LJQANCHMSA-N 2 1 315.505 3.593 20 10 DHCDMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1ccc(N(C)C)cc1 ZINC000764964120 1018441796 /nfs/dbraw/zinc/44/17/96/1018441796.db2.gz PKASIQCWRJWIQF-ZWKOTPCHSA-N 2 1 317.521 3.915 20 10 DHCDMP Cc1cc(C[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)c(C)n1-c1ccccc1 ZINC000325414289 1018467718 /nfs/dbraw/zinc/46/77/18/1018467718.db2.gz UWGNBDZJMYBSKG-FPOVZHCZSA-N 2 1 323.484 3.811 20 10 DHCDMP CCC[N@@H+](CCC1C[C@H]2CC[C@@H](C1)[NH2+]2)Cc1ccccc1O ZINC000923311355 1019127119 /nfs/dbraw/zinc/12/71/19/1019127119.db2.gz VQCRRLVCONAFGY-ZNXRZULTSA-N 2 1 302.462 3.525 20 10 DHCDMP Cc1ccc(O)c(C[NH2+]C[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000310064378 1020312101 /nfs/dbraw/zinc/31/21/01/1020312101.db2.gz AVIFGOQPUXUFRU-OAQYLSRUSA-N 2 1 324.468 3.702 20 10 DHCDMP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H]2CCCC[N@@H+](C)C2)cc1 ZINC000858490435 1032916277 /nfs/dbraw/zinc/91/62/77/1032916277.db2.gz HIOZZVKZRDIFMZ-IAGOWNOFSA-N 2 1 303.494 3.525 20 10 DHCDMP CC1(C)C[C@H]([NH2+]Cc2ccccc2O)CC[N@H+]1Cc1ccccc1 ZINC001171970057 1032954698 /nfs/dbraw/zinc/95/46/98/1032954698.db2.gz XTFHNCXZMRPHSV-LJQANCHMSA-N 2 1 324.468 3.925 20 10 DHCDMP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(N(C)C)cc1 ZINC000853241444 1022241395 /nfs/dbraw/zinc/24/13/95/1022241395.db2.gz VFFXRVDYUWOLLD-WMZOPIPTSA-N 2 1 315.505 3.525 20 10 DHCDMP C[C@@H]([NH2+]CC1([NH3+])CCCC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000854222823 1022432637 /nfs/dbraw/zinc/43/26/37/1022432637.db2.gz LHBZTNQDGXZESY-OAHLLOKOSA-N 2 1 319.468 3.738 20 10 DHCDMP C[N@H+]1CCC[C@H]1CC[NH+](Cc1ccccc1O)C1CCCC1 ZINC000767396346 1022709672 /nfs/dbraw/zinc/70/96/72/1022709672.db2.gz DKQXMMBWSNZKMS-KRWDZBQOSA-N 2 1 302.462 3.621 20 10 DHCDMP C[NH+]1CCC[C@H]1CC[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000767396346 1022709684 /nfs/dbraw/zinc/70/96/84/1022709684.db2.gz DKQXMMBWSNZKMS-KRWDZBQOSA-N 2 1 302.462 3.621 20 10 DHCDMP C[NH+]1CCC[C@H]1CC[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000767396346 1022709702 /nfs/dbraw/zinc/70/97/02/1022709702.db2.gz DKQXMMBWSNZKMS-KRWDZBQOSA-N 2 1 302.462 3.621 20 10 DHCDMP CCN(CC)c1ccc(C[NH+](C)[C@@H]2CC[N@H+](CC)C[C@H]2C)cc1 ZINC000769481889 1023152565 /nfs/dbraw/zinc/15/25/65/1023152565.db2.gz ANRPKFDXLQNIKQ-YLJYHZDGSA-N 2 1 317.521 3.695 20 10 DHCDMP CCN(CC)c1ccc(C[NH+](C)[C@@H]2CC[N@@H+](CC)C[C@H]2C)cc1 ZINC000769481889 1023152568 /nfs/dbraw/zinc/15/25/68/1023152568.db2.gz ANRPKFDXLQNIKQ-YLJYHZDGSA-N 2 1 317.521 3.695 20 10 DHCDMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)C1 ZINC000808680481 1026346625 /nfs/dbraw/zinc/34/66/25/1026346625.db2.gz MJVZFABKSZLTGX-KBPBESRZSA-N 2 1 310.869 3.737 20 10 DHCDMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000808699063 1026373558 /nfs/dbraw/zinc/37/35/58/1026373558.db2.gz RKGWDXCPTYDQJH-CYBMUJFWSA-N 2 1 321.852 3.990 20 10 DHCDMP CC[C@H](c1ccccc1O)[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000367321745 1028166543 /nfs/dbraw/zinc/16/65/43/1028166543.db2.gz JNNIEGKTFRGLQV-SJLPKXTDSA-N 2 1 302.462 3.794 20 10 DHCDMP Cc1ccc(O)c(C[N@@H+]2CCC[C@H](n3ccnc3C(C)C)C2)c1 ZINC000374274604 1029267750 /nfs/dbraw/zinc/26/77/50/1029267750.db2.gz ZNVKGHDYDTVDIW-KRWDZBQOSA-N 2 1 313.445 3.858 20 10 DHCDMP C[C@H]([NH2+]CC1(C)CC[NH2+]CC1)c1cc(Cl)c(Cl)cc1O ZINC000817965238 1029303807 /nfs/dbraw/zinc/30/38/07/1029303807.db2.gz ROOKGFXHIYXYTP-JTQLQIEISA-N 2 1 317.260 3.739 20 10 DHCDMP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000817976604 1029313966 /nfs/dbraw/zinc/31/39/66/1029313966.db2.gz OXHIVBKIGNDJPN-UWVGGRQHSA-N 2 1 305.249 3.867 20 10 DHCDMP Cc1cc(O)c(C[NH+]2CC[C@H](C[N@H+](C)CC3CC3)C2)cc1Cl ZINC000824894554 1030661481 /nfs/dbraw/zinc/66/14/81/1030661481.db2.gz HOHHWAFXYSRFRZ-OAHLLOKOSA-N 2 1 322.880 3.518 20 10 DHCDMP Cc1cc(O)c(C[NH+]2CC[C@H](C[N@@H+](C)CC3CC3)C2)cc1Cl ZINC000824894554 1030661486 /nfs/dbraw/zinc/66/14/86/1030661486.db2.gz HOHHWAFXYSRFRZ-OAHLLOKOSA-N 2 1 322.880 3.518 20 10 DHCDMP Cc1cc(O)c(C[N@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)cc1Cl ZINC000824894554 1030661493 /nfs/dbraw/zinc/66/14/93/1030661493.db2.gz HOHHWAFXYSRFRZ-OAHLLOKOSA-N 2 1 322.880 3.518 20 10 DHCDMP Cc1cc(O)c(C[N@@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)cc1Cl ZINC000824894554 1030661497 /nfs/dbraw/zinc/66/14/97/1030661497.db2.gz HOHHWAFXYSRFRZ-OAHLLOKOSA-N 2 1 322.880 3.518 20 10 DHCDMP CCCOc1ccc(C[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1C ZINC000873014454 1031692974 /nfs/dbraw/zinc/69/29/74/1031692974.db2.gz RONAPINCOHFKHW-QZTJIDSGSA-N 2 1 302.462 3.500 20 10 DHCDMP CC[NH+](CC)C1CCC([N@@H+](C)Cc2ccc(N(C)C)cc2)CC1 ZINC001173113836 1033547918 /nfs/dbraw/zinc/54/79/18/1033547918.db2.gz MCXJWJNUIXSOMR-UHFFFAOYSA-N 2 1 317.521 3.837 20 10 DHCDMP CC[C@@H]1CC[C@@H]([NH2+]C2CC[NH+](Cc3ccccc3O)CC2)C1 ZINC001173270831 1033641069 /nfs/dbraw/zinc/64/10/69/1033641069.db2.gz CVEDZPZUSDAAQF-CRAIPNDOSA-N 2 1 302.462 3.525 20 10 DHCDMP Cc1cc(O)c(C[N@H+]2CCC[C@@H]3C[NH+](C)CC[C@@H]32)cc1C(C)C ZINC000129306155 1034703171 /nfs/dbraw/zinc/70/31/71/1034703171.db2.gz CRHALDKCJDOJAT-APWZRJJASA-N 2 1 316.489 3.740 20 10 DHCDMP Cc1cc(O)c(C[NH+]2CCC[C@@H]3C[N@H+](C)CC[C@@H]32)cc1C(C)C ZINC000129306155 1034703181 /nfs/dbraw/zinc/70/31/81/1034703181.db2.gz CRHALDKCJDOJAT-APWZRJJASA-N 2 1 316.489 3.740 20 10 DHCDMP Cc1cc(O)c(C[NH+]2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)cc1C(C)C ZINC000129306155 1034703188 /nfs/dbraw/zinc/70/31/88/1034703188.db2.gz CRHALDKCJDOJAT-APWZRJJASA-N 2 1 316.489 3.740 20 10 DHCDMP CCc1cc(C[N@H+]2CC[C@H](C[NH+](C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000153144170 1035767994 /nfs/dbraw/zinc/76/79/94/1035767994.db2.gz ZWLAMTJYIIWUJM-MRXNPFEDSA-N 2 1 318.505 3.636 20 10 DHCDMP CC[C@H]([NH2+]CCC[N@@H+]1CCc2ccccc2C1)c1ccccc1O ZINC000775488325 1038562167 /nfs/dbraw/zinc/56/21/67/1038562167.db2.gz REXALGBPOLGNKB-FQEVSTJZSA-N 2 1 324.468 3.881 20 10 DHCDMP CC[C@H]([NH2+]CCC[N@H+]1CCc2ccccc2C1)c1ccccc1O ZINC000775488325 1038562176 /nfs/dbraw/zinc/56/21/76/1038562176.db2.gz REXALGBPOLGNKB-FQEVSTJZSA-N 2 1 324.468 3.881 20 10 DHCDMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000273563041 130136423 /nfs/dbraw/zinc/13/64/23/130136423.db2.gz ISEUGNVRSCYXPA-IUODEOHRSA-N 2 1 301.434 3.501 20 10 DHCDMP CC[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccc(F)cc1O ZINC000285478377 131171960 /nfs/dbraw/zinc/17/19/60/131171960.db2.gz BGQIWFBIMRTIFL-GOSISDBHSA-N 2 1 316.420 3.834 20 10 DHCDMP Cn1ccnc1[C@@H]1CCC[N@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000376042177 337025862 /nfs/dbraw/zinc/02/58/62/337025862.db2.gz CGCJIOBAXBXEIC-MRXNPFEDSA-N 2 1 321.424 3.659 20 10 DHCDMP Cn1ccnc1[C@@H]1CCC[N@@H+](Cc2c([O-])ccc3ccccc32)C1 ZINC000376042177 337025863 /nfs/dbraw/zinc/02/58/63/337025863.db2.gz CGCJIOBAXBXEIC-MRXNPFEDSA-N 2 1 321.424 3.659 20 10 DHCDMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@H](C)C1)c1cc(F)ccc1O ZINC000185034458 1016523598 /nfs/dbraw/zinc/52/35/98/1016523598.db2.gz DTFPZPZEZBTXGJ-GJZGRUSLSA-N 2 1 308.441 3.694 20 10 DHCDMP CC[C@H](C[NH2+][C@@H](C)c1ccc(N(C)CC)cc1)[NH+]1CCCC1 ZINC000764868803 1018409994 /nfs/dbraw/zinc/40/99/94/1018409994.db2.gz JBQKSOCVNMNEBZ-FUHWJXTLSA-N 2 1 303.494 3.668 20 10 DHCDMP C[C@@H]([NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1ccccc1O ZINC000310081245 1020329386 /nfs/dbraw/zinc/32/93/86/1020329386.db2.gz JLBRBZKNMDZVKV-DYESRHJHSA-N 2 1 324.468 3.955 20 10 DHCDMP CCCN(CCC)c1ccc(C[NH2+][C@H]2CC[N@@H+](C)[C@H](C)C2)cc1 ZINC000742374849 1021114619 /nfs/dbraw/zinc/11/46/19/1021114619.db2.gz IBRRLGJRAYCAFI-MJGOQNOKSA-N 2 1 317.521 3.885 20 10 DHCDMP CC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccccc1O ZINC000853239338 1022242873 /nfs/dbraw/zinc/24/28/73/1022242873.db2.gz FTVWHHVFCYAOLD-SJLPKXTDSA-N 2 1 302.462 3.555 20 10 DHCDMP C[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1O ZINC000272900412 1022516858 /nfs/dbraw/zinc/51/68/58/1022516858.db2.gz UZWNTZWZAQVWAO-JENIJYKNSA-N 2 1 324.468 3.953 20 10 DHCDMP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1ccccc1O ZINC000272842036 1022517909 /nfs/dbraw/zinc/51/79/09/1022517909.db2.gz JVEKPVSEPHHLOL-UWVAXJGDSA-N 2 1 324.468 3.953 20 10 DHCDMP C[C@H]([NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)c1ccccc1O ZINC000272842036 1022517911 /nfs/dbraw/zinc/51/79/11/1022517911.db2.gz JVEKPVSEPHHLOL-UWVAXJGDSA-N 2 1 324.468 3.953 20 10 DHCDMP CCN(CC)c1ccc(C[N@@H+](C)[C@H]2CC[NH+](CC)[C@@H](C)C2)cc1 ZINC000769470649 1023160764 /nfs/dbraw/zinc/16/07/64/1023160764.db2.gz NEBXSSDZPTXTAB-PXNSSMCTSA-N 2 1 317.521 3.837 20 10 DHCDMP CCN(CC)c1ccc(C[NH+](C)[C@H]2CC[N@H+](CC)[C@@H](C)C2)cc1 ZINC000769470649 1023160767 /nfs/dbraw/zinc/16/07/67/1023160767.db2.gz NEBXSSDZPTXTAB-PXNSSMCTSA-N 2 1 317.521 3.837 20 10 DHCDMP CCN(CC)c1ccc(C[NH+](C)[C@H]2CC[N@@H+](CC)[C@@H](C)C2)cc1 ZINC000769470649 1023160772 /nfs/dbraw/zinc/16/07/72/1023160772.db2.gz NEBXSSDZPTXTAB-PXNSSMCTSA-N 2 1 317.521 3.837 20 10 DHCDMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000808691755 1026349723 /nfs/dbraw/zinc/34/97/23/1026349723.db2.gz NOMVWYGIKQZCIT-WCQYABFASA-N 2 1 321.852 3.846 20 10 DHCDMP CC[C@@H](c1ccccc1O)[NH+]1CCC(Cc2[nH+]ccn2C)CC1 ZINC000364621277 1027857440 /nfs/dbraw/zinc/85/74/40/1027857440.db2.gz GZMOAINFICAYMQ-KRWDZBQOSA-N 2 1 313.445 3.532 20 10 DHCDMP CC[C@H](c1ccccc1O)[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000367321744 1028167564 /nfs/dbraw/zinc/16/75/64/1028167564.db2.gz JNNIEGKTFRGLQV-FUHWJXTLSA-N 2 1 302.462 3.794 20 10 DHCDMP CCN(CC)c1ccc(C[NH2+][C@H]2C[C@H]([NH3+])c3ccccc32)cc1 ZINC000817888597 1029264475 /nfs/dbraw/zinc/26/44/75/1029264475.db2.gz MWKNOEQEWZDMBT-PMACEKPBSA-N 2 1 309.457 3.767 20 10 DHCDMP CCC[NH+]1CCC([N@@H+](C)Cc2cc(Cl)c(C)cc2O)CC1 ZINC000824601382 1030590629 /nfs/dbraw/zinc/59/06/29/1030590629.db2.gz IVUUDWVLBODESP-UHFFFAOYSA-N 2 1 310.869 3.660 20 10 DHCDMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000293708840 1031582507 /nfs/dbraw/zinc/58/25/07/1031582507.db2.gz LVNCOFJNXFUGAE-DZGCQCFKSA-N 2 1 301.434 3.501 20 10 DHCDMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccc1O ZINC000183489454 1034390282 /nfs/dbraw/zinc/39/02/82/1034390282.db2.gz ORJRQQWXVNRLON-MJGOQNOKSA-N 2 1 324.468 3.607 20 10 DHCDMP Cc1cc(C[N@@H+](C)CCCC[NH+]2CCCCC2)ccc1N(C)C ZINC001175690253 1035085661 /nfs/dbraw/zinc/08/56/61/1035085661.db2.gz WYCDMJJPDOTCJS-UHFFFAOYSA-N 2 1 317.521 3.759 20 10 DHCDMP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1O ZINC000195134689 1035415065 /nfs/dbraw/zinc/41/50/65/1035415065.db2.gz XPGHJKOOTMZXDK-SJLPKXTDSA-N 2 1 310.441 3.565 20 10 DHCDMP Cc1[nH+]ccn1CCC[N@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000762916554 1037065822 /nfs/dbraw/zinc/06/58/22/1037065822.db2.gz HRKBWMMYRKYAIY-UHFFFAOYSA-N 2 1 314.477 3.558 20 10 DHCDMP Cc1[nH+]ccn1CCC[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000762916554 1037065840 /nfs/dbraw/zinc/06/58/40/1037065840.db2.gz HRKBWMMYRKYAIY-UHFFFAOYSA-N 2 1 314.477 3.558 20 10 DHCDMP CC[C@@H]([NH2+]CCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1ccccc1O ZINC000775486678 1038555338 /nfs/dbraw/zinc/55/53/38/1038555338.db2.gz DNQFISVKFFTNMD-SOLBZPMBSA-N 2 1 304.478 3.801 20 10 DHCDMP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000173450053 1040291995 /nfs/dbraw/zinc/29/19/95/1040291995.db2.gz VAZNHQWUSJSBSD-KRWDZBQOSA-N 2 1 318.505 3.988 20 10 DHCDMP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000173450053 1040292012 /nfs/dbraw/zinc/29/20/12/1040292012.db2.gz VAZNHQWUSJSBSD-KRWDZBQOSA-N 2 1 318.505 3.988 20 10 DHCDMP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000173450053 1040292029 /nfs/dbraw/zinc/29/20/29/1040292029.db2.gz VAZNHQWUSJSBSD-KRWDZBQOSA-N 2 1 318.505 3.988 20 10 DHCDMP Cc1[nH+]ccn1CCC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000273434889 130120469 /nfs/dbraw/zinc/12/04/69/130120469.db2.gz WQDJMQFGFZFXCE-AWEZNQCLSA-N 2 1 309.413 3.791 20 10 DHCDMP C[C@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1ccc2ccccc2c1O ZINC000278983491 334104543 /nfs/dbraw/zinc/10/45/43/334104543.db2.gz PCWJDWKURIMRIA-GJZGRUSLSA-N 2 1 321.424 3.655 20 10 DHCDMP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)C1 ZINC000163295044 521717739 /nfs/dbraw/zinc/71/77/39/521717739.db2.gz QKKGLIXPJUAIHI-ZWKOTPCHSA-N 2 1 315.505 3.669 20 10 DHCDMP C[NH+](C)C1CCC([N@@H+](C)Cc2ccc(N3CCCC3)cc2)CC1 ZINC001168324806 1032272139 /nfs/dbraw/zinc/27/21/39/1032272139.db2.gz XOASTRGBKRULNL-UHFFFAOYSA-N 2 1 315.505 3.591 20 10 DHCDMP CC[C@@H](C[NH2+][C@@H](C)c1ccc(N(C)CC)cc1)[NH+]1CCCC1 ZINC000764868807 1018409516 /nfs/dbraw/zinc/40/95/16/1018409516.db2.gz JBQKSOCVNMNEBZ-WMZOPIPTSA-N 2 1 303.494 3.668 20 10 DHCDMP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(N(CC)CC)cc2)C1 ZINC000769507872 1023170563 /nfs/dbraw/zinc/17/05/63/1023170563.db2.gz POEFTRWAYJNEHE-LJQANCHMSA-N 2 1 317.521 3.697 20 10 DHCDMP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(N(CC)CC)cc2)C1 ZINC000769507872 1023170570 /nfs/dbraw/zinc/17/05/70/1023170570.db2.gz POEFTRWAYJNEHE-LJQANCHMSA-N 2 1 317.521 3.697 20 10 DHCDMP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(N(CC)CC)cc2)C1 ZINC000769507872 1023170577 /nfs/dbraw/zinc/17/05/77/1023170577.db2.gz POEFTRWAYJNEHE-LJQANCHMSA-N 2 1 317.521 3.697 20 10 DHCDMP Cc1cc(C[NH+]2CC[C@@]3(CC[N@H+](C)C3)C2)c(O)c(C(C)(C)C)c1 ZINC000793769282 1025159149 /nfs/dbraw/zinc/15/91/49/1025159149.db2.gz UFWHHEPMJNXRJN-HXUWFJFHSA-N 2 1 316.489 3.526 20 10 DHCDMP Cc1cc(C[N@H+]2CC[C@@]3(CC[NH+](C)C3)C2)c(O)c(C(C)(C)C)c1 ZINC000793769282 1025159153 /nfs/dbraw/zinc/15/91/53/1025159153.db2.gz UFWHHEPMJNXRJN-HXUWFJFHSA-N 2 1 316.489 3.526 20 10 DHCDMP Cc1cc(C[N@@H+]2CC[C@@]3(CC[NH+](C)C3)C2)c(O)c(C(C)(C)C)c1 ZINC000793769282 1025159165 /nfs/dbraw/zinc/15/91/65/1025159165.db2.gz UFWHHEPMJNXRJN-HXUWFJFHSA-N 2 1 316.489 3.526 20 10 DHCDMP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000809765522 1026621390 /nfs/dbraw/zinc/62/13/90/1026621390.db2.gz NSEGANLEUGTAJA-UZLBHIALSA-N 2 1 324.468 3.831 20 10 DHCDMP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000809765522 1026621394 /nfs/dbraw/zinc/62/13/94/1026621394.db2.gz NSEGANLEUGTAJA-UZLBHIALSA-N 2 1 324.468 3.831 20 10 DHCDMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000809765522 1026621398 /nfs/dbraw/zinc/62/13/98/1026621398.db2.gz NSEGANLEUGTAJA-UZLBHIALSA-N 2 1 324.468 3.831 20 10 DHCDMP C[C@@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000809765522 1026621404 /nfs/dbraw/zinc/62/14/04/1026621404.db2.gz NSEGANLEUGTAJA-UZLBHIALSA-N 2 1 324.468 3.831 20 10 DHCDMP CC[C@@H](c1ccccc1O)[NH+]1CCC([N@H+]2CCC[C@H]2C)CC1 ZINC000369888348 1028542874 /nfs/dbraw/zinc/54/28/74/1028542874.db2.gz NXKXAQXCVRQQPG-QAPCUYQASA-N 2 1 302.462 3.792 20 10 DHCDMP Oc1c(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)ccc2ccccc21 ZINC000816513842 1028913753 /nfs/dbraw/zinc/91/37/53/1028913753.db2.gz DMDOJEARIMZYRY-IBGZPJMESA-N 2 1 324.468 3.996 20 10 DHCDMP C[C@H](CCCC[NH3+])[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000817976763 1029312817 /nfs/dbraw/zinc/31/28/17/1029312817.db2.gz SXFSRLATRDXDKI-GHMZBOCLSA-N 2 1 304.356 3.579 20 10 DHCDMP C[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cc(Cl)c(Cl)cc1O ZINC000817979397 1029315855 /nfs/dbraw/zinc/31/58/55/1029315855.db2.gz AQUGCAUMPXWXAI-QWRGUYRKSA-N 2 1 317.260 3.882 20 10 DHCDMP C[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccc(F)cc1O ZINC000817984016 1029323645 /nfs/dbraw/zinc/32/36/45/1029323645.db2.gz UVUMQUJIGBNQIF-GUYCJALGSA-N 2 1 302.393 3.662 20 10 DHCDMP Cc1cc([O-])c(C[NH2+][C@H](Cn2ccnc2)C(C)(C)C)cc1Cl ZINC000825131006 1030730430 /nfs/dbraw/zinc/73/04/30/1030730430.db2.gz IAEBKKPSPOIHLE-MRXNPFEDSA-N 2 1 321.852 3.755 20 10 DHCDMP [NH3+][C@H](C[C@H]1CCC[N@@H+](Cc2ccccc2O)C1)C1CCCC1 ZINC000873231712 1031767371 /nfs/dbraw/zinc/76/73/71/1031767371.db2.gz AYHVQWAPMROUGP-CRAIPNDOSA-N 2 1 302.462 3.512 20 10 DHCDMP COc1cccc([C@@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)c1O ZINC000846140472 1031899836 /nfs/dbraw/zinc/89/98/36/1031899836.db2.gz UDAWZGXIPMKFBP-HZPDHXFCSA-N 2 1 320.477 3.564 20 10 DHCDMP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2c(O)ccc3ccccc32)C1 ZINC000173444159 1033751367 /nfs/dbraw/zinc/75/13/67/1033751367.db2.gz UHTBOTOYNFSITB-MRXNPFEDSA-N 2 1 312.457 3.709 20 10 DHCDMP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000173444159 1033751378 /nfs/dbraw/zinc/75/13/78/1033751378.db2.gz UHTBOTOYNFSITB-MRXNPFEDSA-N 2 1 312.457 3.709 20 10 DHCDMP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000173444159 1033751395 /nfs/dbraw/zinc/75/13/95/1033751395.db2.gz UHTBOTOYNFSITB-MRXNPFEDSA-N 2 1 312.457 3.709 20 10 DHCDMP CC(C)(C)c1cccc(C[N@H+]2CCC[C@@](C)(C[NH3+])CC2)c1O ZINC001206311557 1035400941 /nfs/dbraw/zinc/40/09/41/1035400941.db2.gz QPWUVFUPMHPCCV-LJQANCHMSA-N 2 1 304.478 3.641 20 10 DHCDMP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cc(Cl)c(Cl)cc1O ZINC000774274426 1036273646 /nfs/dbraw/zinc/27/36/46/1036273646.db2.gz SYOZPDXXKDFBNT-SNVBAGLBSA-N 2 1 315.244 3.612 20 10 DHCDMP C[C@@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1cc(Cl)c(Cl)cc1O ZINC000774274426 1036273669 /nfs/dbraw/zinc/27/36/69/1036273669.db2.gz SYOZPDXXKDFBNT-SNVBAGLBSA-N 2 1 315.244 3.612 20 10 DHCDMP Cc1[nH+]ccn1CCC[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000273434895 130121023 /nfs/dbraw/zinc/12/10/23/130121023.db2.gz WQDJMQFGFZFXCE-CQSZACIVSA-N 2 1 309.413 3.791 20 10 DHCDMP C[C@H]([NH2+]C1CC[NH+](C)CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000161429053 525292692 /nfs/dbraw/zinc/29/26/92/525292692.db2.gz QHCUBUNAEGSPIV-HNNXBMFYSA-N 2 1 319.468 3.561 20 10 DHCDMP C[C@H]([NH2+]CCC[N@H+](C)Cc1ccccc1)c1cc(F)ccc1O ZINC000303268785 1013498330 /nfs/dbraw/zinc/49/83/30/1013498330.db2.gz ULVFSYYKGQUKFH-HNNXBMFYSA-N 2 1 316.420 3.704 20 10 DHCDMP C[C@H]([NH2+]CCC[N@@H+](C)Cc1ccccc1)c1cc(F)ccc1O ZINC000303268785 1013498335 /nfs/dbraw/zinc/49/83/35/1013498335.db2.gz ULVFSYYKGQUKFH-HNNXBMFYSA-N 2 1 316.420 3.704 20 10 DHCDMP CC[NH+]1CCC([NH2+]Cc2cc(-c3ccccc3)ccc2O)CC1 ZINC000263698736 1032755897 /nfs/dbraw/zinc/75/58/97/1032755897.db2.gz QUMBCSDZHKRRSF-UHFFFAOYSA-N 2 1 310.441 3.633 20 10 DHCDMP CC[C@@H](C[NH2+][C@@H](CC)c1ccc(N(C)C)cc1)[NH+]1CCCC1 ZINC000764867698 1018409332 /nfs/dbraw/zinc/40/93/32/1018409332.db2.gz CZMPEQSTBDOHCQ-HKUYNNGSSA-N 2 1 303.494 3.668 20 10 DHCDMP C[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1cc2c(cc1O)CCCC2 ZINC000858490604 1032917208 /nfs/dbraw/zinc/91/72/08/1032917208.db2.gz KKZOLLXJKGXPPS-HZPDHXFCSA-N 2 1 316.489 3.654 20 10 DHCDMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1ccc2ccccc2c1O ZINC000858490324 1032915778 /nfs/dbraw/zinc/91/57/78/1032915778.db2.gz GFWNYCYCWRQUJS-CVEARBPZSA-N 2 1 312.457 3.928 20 10 DHCDMP CC[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1ccc(N(C)C)cc1 ZINC000858490280 1032918789 /nfs/dbraw/zinc/91/87/89/1032918789.db2.gz DPFBQRRJPXGYFD-VQIMIIECSA-N 2 1 303.494 3.525 20 10 DHCDMP C[C@@H]([NH2+]CC[C@H](C)[N@@H+](C)Cc1ccccc1)c1ccccc1O ZINC000183541057 1022180886 /nfs/dbraw/zinc/18/08/86/1022180886.db2.gz QMDWPXZUOFGKRC-DLBZAZTESA-N 2 1 312.457 3.953 20 10 DHCDMP Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)c(O)c1 ZINC000853239313 1022239560 /nfs/dbraw/zinc/23/95/60/1022239560.db2.gz DYYIFQHJLJRLBQ-AEFFLSMTSA-N 2 1 316.489 3.782 20 10 DHCDMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1cc(Cl)ccc1O ZINC000853240649 1022241932 /nfs/dbraw/zinc/24/19/32/1022241932.db2.gz QDXZMNFFNPOUGO-UKRRQHHQSA-N 2 1 322.880 3.818 20 10 DHCDMP Cc1cccc(C[NH+]2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)c1O ZINC000179884748 1022572629 /nfs/dbraw/zinc/57/26/29/1022572629.db2.gz WNEFDOVKAXGTSA-ZWKOTPCHSA-N 2 1 316.489 3.787 20 10 DHCDMP Cc1cccc(C[N@H+]2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)c1O ZINC000179884748 1022572632 /nfs/dbraw/zinc/57/26/32/1022572632.db2.gz WNEFDOVKAXGTSA-ZWKOTPCHSA-N 2 1 316.489 3.787 20 10 DHCDMP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1cc(C(C)C)c(C)cc1O ZINC000746628550 1023753712 /nfs/dbraw/zinc/75/37/12/1023753712.db2.gz WWYGLXHBKKDOHF-UHFFFAOYSA-N 2 1 315.461 3.851 20 10 DHCDMP Cc1[nH+]ccn1CCC[N@H+](C)Cc1cc(C(C)C)c(C)cc1O ZINC000746628550 1023753718 /nfs/dbraw/zinc/75/37/18/1023753718.db2.gz WWYGLXHBKKDOHF-UHFFFAOYSA-N 2 1 315.461 3.851 20 10 DHCDMP Cc1cc(O)c(C[N@@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)cc1Cl ZINC000825927630 1033201113 /nfs/dbraw/zinc/20/11/13/1033201113.db2.gz GWPHRJMJQNYORG-HNNXBMFYSA-N 2 1 322.880 3.518 20 10 DHCDMP CC1CCC([NH2+]C2CC[NH+](Cc3ccccc3O)CC2)CC1 ZINC001168204337 1025320067 /nfs/dbraw/zinc/32/00/67/1025320067.db2.gz LHYSQBNLQBEWQH-UHFFFAOYSA-N 2 1 302.462 3.525 20 10 DHCDMP CCc1cccc(C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1O ZINC000691527932 1025807258 /nfs/dbraw/zinc/80/72/58/1025807258.db2.gz VNYUFNPOMPMKNN-GOSISDBHSA-N 2 1 324.468 3.566 20 10 DHCDMP CCC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)C1 ZINC000808680482 1026347157 /nfs/dbraw/zinc/34/71/57/1026347157.db2.gz MJVZFABKSZLTGX-KGLIPLIRSA-N 2 1 310.869 3.737 20 10 DHCDMP CC[N@@H+](CCC[NH+]1CCCC1)Cc1ccc2ccccc2c1O ZINC000816610990 1028958654 /nfs/dbraw/zinc/95/86/54/1028958654.db2.gz FCOMUJADPNITRM-UHFFFAOYSA-N 2 1 312.457 3.853 20 10 DHCDMP Cc1ccc([C@H](C)[NH2+]C2CC([NH+]3CCCCC3)C2)c(O)c1C ZINC000373521058 1029069735 /nfs/dbraw/zinc/06/97/35/1029069735.db2.gz JPTQWMQFGDSMOH-GTPINHCMSA-N 2 1 302.462 3.677 20 10 DHCDMP C[C@H]([NH2+][C@H]1CCCC[C@H]1C[NH3+])c1cccc(C(F)(F)F)c1O ZINC000817960632 1029302711 /nfs/dbraw/zinc/30/27/11/1029302711.db2.gz OLSAWBJGEGWEMR-MJVIPROJSA-N 2 1 316.367 3.579 20 10 DHCDMP CC[C@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1ccc(F)cc1O ZINC000817962149 1029302766 /nfs/dbraw/zinc/30/27/66/1029302766.db2.gz GMNHXLOFOOBYAY-SJCJKPOMSA-N 2 1 302.393 3.792 20 10 DHCDMP Cc1cc([O-])c(C[NH2+][C@@H](Cn2ccnc2)C(C)(C)C)cc1Cl ZINC000825131004 1030731970 /nfs/dbraw/zinc/73/19/70/1030731970.db2.gz IAEBKKPSPOIHLE-INIZCTEOSA-N 2 1 321.852 3.755 20 10 DHCDMP CCCOc1ccc(C[NH2+][C@H]2CC[N@H+]3CCC[C@H]3C2)cc1C ZINC000873014455 1031694428 /nfs/dbraw/zinc/69/44/28/1031694428.db2.gz RONAPINCOHFKHW-ROUUACIJSA-N 2 1 302.462 3.500 20 10 DHCDMP CCCN(CCC)c1ccc(C[N@H+]2CC[C@H]([NH3+])C[C@@H]2C)cc1 ZINC000846699580 1032042713 /nfs/dbraw/zinc/04/27/13/1032042713.db2.gz UTTGPDBGQXHJNO-WMZOPIPTSA-N 2 1 303.494 3.625 20 10 DHCDMP C[C@H]([NH2+]C1CC[NH+](CCc2ccccc2)CC1)c1ccccc1O ZINC000183413850 1034384844 /nfs/dbraw/zinc/38/48/44/1034384844.db2.gz YPSLKKVETJKBLQ-KRWDZBQOSA-N 2 1 324.468 3.750 20 10 DHCDMP Cc1cc(Cl)cc(C[N@H+](C)CC[C@H]2CCCC[NH+]2C)c1O ZINC000775716739 1036525433 /nfs/dbraw/zinc/52/54/33/1036525433.db2.gz MXJXTJMONOJTCJ-MRXNPFEDSA-N 2 1 310.869 3.660 20 10 DHCDMP Cc1cc(Cl)cc(C[N@@H+](C)CC[C@H]2CCCC[NH+]2C)c1O ZINC000775716739 1036525444 /nfs/dbraw/zinc/52/54/44/1036525444.db2.gz MXJXTJMONOJTCJ-MRXNPFEDSA-N 2 1 310.869 3.660 20 10 DHCDMP Cc1cc(Cl)cc(C[NH+](C)CC[C@H]2CCCC[N@@H+]2C)c1O ZINC000775716739 1036525458 /nfs/dbraw/zinc/52/54/58/1036525458.db2.gz MXJXTJMONOJTCJ-MRXNPFEDSA-N 2 1 310.869 3.660 20 10 DHCDMP Cc1cc(Cl)cc(C[NH+](C)CC[C@H]2CCCC[N@H+]2C)c1O ZINC000775716739 1036525471 /nfs/dbraw/zinc/52/54/71/1036525471.db2.gz MXJXTJMONOJTCJ-MRXNPFEDSA-N 2 1 310.869 3.660 20 10 DHCDMP C[N@@H+](CCC[NH2+]Cc1ccc2c(c1)CCCO2)Cc1ccccc1 ZINC001199038486 1037187374 /nfs/dbraw/zinc/18/73/74/1037187374.db2.gz RMXXHODUXRMYFY-UHFFFAOYSA-N 2 1 324.468 3.623 20 10 DHCDMP CC[C@@H]([NH2+]C1CC([NH+]2CCCCC2)C1)c1ccc(C)cc1O ZINC000373522710 336963587 /nfs/dbraw/zinc/96/35/87/336963587.db2.gz NWUVLYKIZOBXPY-LEOMRAHMSA-N 2 1 302.462 3.758 20 10 DHCDMP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)C1 ZINC000163295169 521710867 /nfs/dbraw/zinc/71/08/67/521710867.db2.gz QKKGLIXPJUAIHI-ROUUACIJSA-N 2 1 315.505 3.669 20 10 DHCDMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc2c(cc1O)CCCC2 ZINC000363845187 525619306 /nfs/dbraw/zinc/61/93/06/525619306.db2.gz AQLHAUFAKJRSPL-JCGIZDLHSA-N 2 1 314.473 3.548 20 10 DHCDMP C[N@H+]1CC[C@]2(C1)CCC[NH+](Cc1cc(C(C)(C)C)ccc1O)C2 ZINC001279474494 1014425894 /nfs/dbraw/zinc/42/58/94/1014425894.db2.gz ODXLFQOQZVIIPL-FQEVSTJZSA-N 2 1 316.489 3.607 20 10 DHCDMP C[NH+]1CC[C@]2(C1)CCC[N@H+](Cc1cc(C(C)(C)C)ccc1O)C2 ZINC001279474494 1014425900 /nfs/dbraw/zinc/42/59/00/1014425900.db2.gz ODXLFQOQZVIIPL-FQEVSTJZSA-N 2 1 316.489 3.607 20 10 DHCDMP C[NH+]1CC[C@]2(C1)CCC[N@@H+](Cc1cc(C(C)(C)C)ccc1O)C2 ZINC001279474494 1014425907 /nfs/dbraw/zinc/42/59/07/1014425907.db2.gz ODXLFQOQZVIIPL-FQEVSTJZSA-N 2 1 316.489 3.607 20 10 DHCDMP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1ccc(F)cc1O ZINC000185033851 1016524720 /nfs/dbraw/zinc/52/47/20/1016524720.db2.gz SFEYHNRYNCQKNB-CABCVRRESA-N 2 1 308.441 3.837 20 10 DHCDMP C[C@H]([NH2+]CCCC[N@H+]1CCCC[C@H]1C)c1ccc(F)cc1O ZINC000185033851 1016524730 /nfs/dbraw/zinc/52/47/30/1016524730.db2.gz SFEYHNRYNCQKNB-CABCVRRESA-N 2 1 308.441 3.837 20 10 DHCDMP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)C1 ZINC000125795565 1018325146 /nfs/dbraw/zinc/32/51/46/1018325146.db2.gz BALSMSSJHYCCGY-IRXDYDNUSA-N 2 1 303.494 3.524 20 10 DHCDMP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1ccc(N(C)C)cc1 ZINC000125855699 1033004578 /nfs/dbraw/zinc/00/45/78/1033004578.db2.gz KERPWVGPRIZUMR-PXNSSMCTSA-N 2 1 317.521 3.914 20 10 DHCDMP CC[C@@H](c1ccccc1O)[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000364008381 1022573970 /nfs/dbraw/zinc/57/39/70/1022573970.db2.gz IHUARACTQTVUOU-WMZOPIPTSA-N 2 1 302.462 3.651 20 10 DHCDMP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccc2ccccc2c1O ZINC000296599688 1023011259 /nfs/dbraw/zinc/01/12/59/1023011259.db2.gz VMOAWEQRIDSMJR-LNRIEFBSSA-N 2 1 310.441 3.821 20 10 DHCDMP C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccccc2O)CC1 ZINC000770505254 1023316526 /nfs/dbraw/zinc/31/65/26/1023316526.db2.gz LWMRZCHGKLVYFA-QGZVFWFLSA-N 2 1 316.489 3.869 20 10 DHCDMP Cc1[nH+]ccn1CC[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000268835880 1024175325 /nfs/dbraw/zinc/17/53/25/1024175325.db2.gz UKXVXWUXEICFKM-INIZCTEOSA-N 2 1 312.461 3.533 20 10 DHCDMP Oc1ccccc1C[NH2+][C@H]1CC[N@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000876995796 1033202422 /nfs/dbraw/zinc/20/24/22/1033202422.db2.gz INEBUDSZZBJINK-ICSRJNTNSA-N 2 1 322.452 3.850 20 10 DHCDMP Oc1ccccc1C[NH2+][C@H]1CC[N@@H+](C2CC2)[C@H](c2ccccc2)C1 ZINC000876995796 1033202428 /nfs/dbraw/zinc/20/24/28/1033202428.db2.gz INEBUDSZZBJINK-ICSRJNTNSA-N 2 1 322.452 3.850 20 10 DHCDMP Oc1ccccc1C[NH2+][C@H]1CC[N@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000876995795 1033201950 /nfs/dbraw/zinc/20/19/50/1033201950.db2.gz INEBUDSZZBJINK-AZUAARDMSA-N 2 1 322.452 3.850 20 10 DHCDMP Oc1ccccc1C[NH2+][C@H]1CC[N@@H+](C2CC2)[C@@H](c2ccccc2)C1 ZINC000876995795 1033201955 /nfs/dbraw/zinc/20/19/55/1033201955.db2.gz INEBUDSZZBJINK-AZUAARDMSA-N 2 1 322.452 3.850 20 10 DHCDMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1c(O)cccc1F ZINC000886588727 1025728481 /nfs/dbraw/zinc/72/84/81/1025728481.db2.gz XXONVWGFNGYVCD-KKUMJFAQSA-N 2 1 320.452 3.835 20 10 DHCDMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1c(O)cccc1F ZINC000886588727 1025728495 /nfs/dbraw/zinc/72/84/95/1025728495.db2.gz XXONVWGFNGYVCD-KKUMJFAQSA-N 2 1 320.452 3.835 20 10 DHCDMP C[C@H]([NH2+][C@H]1CCc2cccc(O)c21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000296294389 1027598347 /nfs/dbraw/zinc/59/83/47/1027598347.db2.gz DFHSPMDFIXJIHW-LESCRADOSA-N 2 1 314.473 3.622 20 10 DHCDMP CC[C@H](c1ccccc1O)[N@H+]1CC[C@@H](CNc2ccccn2)C1 ZINC000367295576 1028159185 /nfs/dbraw/zinc/15/91/85/1028159185.db2.gz QPQKIXCQXUUHDY-DOTOQJQBSA-N 2 1 311.429 3.672 20 10 DHCDMP CC[C@@H](c1ccccc1O)[N@H+]1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC000368137219 1028312324 /nfs/dbraw/zinc/31/23/24/1028312324.db2.gz YGDHAAGYDYYVEV-AEFFLSMTSA-N 2 1 302.462 3.507 20 10 DHCDMP CC(C)[N@H+]1CCC[C@H](C[NH2+]Cc2ccc3ccccc3c2O)C1 ZINC000816548392 1028930095 /nfs/dbraw/zinc/93/00/95/1028930095.db2.gz FZXYKWQNBQSHDI-MRXNPFEDSA-N 2 1 312.457 3.755 20 10 DHCDMP CC(C)c1nccn1[C@H]1CCC[N@@H+](Cc2cc(F)ccc2O)C1 ZINC000373139475 1028958745 /nfs/dbraw/zinc/95/87/45/1028958745.db2.gz LVYXIRHVESJXIO-INIZCTEOSA-N 2 1 317.408 3.688 20 10 DHCDMP CC(C)c1nccn1[C@@H]1CCC[N@@H+](Cc2cc(F)ccc2O)C1 ZINC000373139477 1028959518 /nfs/dbraw/zinc/95/95/18/1028959518.db2.gz LVYXIRHVESJXIO-MRXNPFEDSA-N 2 1 317.408 3.688 20 10 DHCDMP CCN(CC)c1ccc(C[NH2+][C@H]2C[C@@H]([NH3+])c3ccccc32)cc1 ZINC000817888598 1029262682 /nfs/dbraw/zinc/26/26/82/1029262682.db2.gz MWKNOEQEWZDMBT-UXHICEINSA-N 2 1 309.457 3.767 20 10 DHCDMP CC(C)[C@@H]([NH3+])C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000817959431 1029302350 /nfs/dbraw/zinc/30/23/50/1029302350.db2.gz RGVDXZSNKKNOBE-APWZRJJASA-N 2 1 303.494 3.701 20 10 DHCDMP CCN(C)c1ccc([C@@H](C)[NH2+]C2CC([NH+]3CCCCC3)C2)cc1 ZINC000373519756 1029784609 /nfs/dbraw/zinc/78/46/09/1029784609.db2.gz GNKMENCQAQBXOC-PPDQVPDSSA-N 2 1 315.505 3.810 20 10 DHCDMP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(Cl)c(C)cc2O)C[C@H]1C ZINC000824855898 1030654301 /nfs/dbraw/zinc/65/43/01/1030654301.db2.gz RVXXFLFFCSWFGE-HIFRSBDPSA-N 2 1 310.869 3.659 20 10 DHCDMP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(Cl)c(C)cc2O)C[C@H]1C ZINC000824855898 1030654302 /nfs/dbraw/zinc/65/43/02/1030654302.db2.gz RVXXFLFFCSWFGE-HIFRSBDPSA-N 2 1 310.869 3.659 20 10 DHCDMP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(Cl)c(C)cc2O)C[C@H]1C ZINC000824855898 1030654308 /nfs/dbraw/zinc/65/43/08/1030654308.db2.gz RVXXFLFFCSWFGE-HIFRSBDPSA-N 2 1 310.869 3.659 20 10 DHCDMP COc1ccc(O)c([C@H](C)[NH2+]CCCC[N@H+]2CCC[C@@H](C)C2)c1 ZINC000185034284 1034521874 /nfs/dbraw/zinc/52/18/74/1034521874.db2.gz CDXSYMGIQJBPQP-CVEARBPZSA-N 2 1 320.477 3.564 20 10 DHCDMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(F)cc1O ZINC000186518254 1034638644 /nfs/dbraw/zinc/63/86/44/1034638644.db2.gz UGACFSIQHDCTFH-SOUVJXGZSA-N 2 1 320.452 3.835 20 10 DHCDMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc(F)cc1O ZINC000186518254 1034638656 /nfs/dbraw/zinc/63/86/56/1034638656.db2.gz UGACFSIQHDCTFH-SOUVJXGZSA-N 2 1 320.452 3.835 20 10 DHCDMP Cc1cc(O)c(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C)C2)cc1C(C)C ZINC000164680840 1038268703 /nfs/dbraw/zinc/26/87/03/1038268703.db2.gz QTKOQFAEIXDZJA-APWZRJJASA-N 2 1 316.489 3.740 20 10 DHCDMP Cc1cc(O)c(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)cc1C(C)C ZINC000164680840 1038268724 /nfs/dbraw/zinc/26/87/24/1038268724.db2.gz QTKOQFAEIXDZJA-APWZRJJASA-N 2 1 316.489 3.740 20 10 DHCDMP Cc1cc(O)c(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C)C2)cc1C(C)C ZINC000164680840 1038268731 /nfs/dbraw/zinc/26/87/31/1038268731.db2.gz QTKOQFAEIXDZJA-APWZRJJASA-N 2 1 316.489 3.740 20 10 DHCDMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](CC)c2cc(Cl)ccc2O)C1 ZINC000775491788 1038568129 /nfs/dbraw/zinc/56/81/29/1038568129.db2.gz JUMZOESCHPTYQJ-CJNGLKHVSA-N 2 1 310.869 3.818 20 10 DHCDMP C[C@@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1ccc2ccccc2c1O ZINC000278983487 334104565 /nfs/dbraw/zinc/10/45/65/334104565.db2.gz PCWJDWKURIMRIA-CABCVRRESA-N 2 1 321.424 3.655 20 10 DHCDMP C[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1)c1cc2c(cc1O)CCCC2 ZINC000363845189 525620874 /nfs/dbraw/zinc/62/08/74/525620874.db2.gz AQLHAUFAKJRSPL-WBAXXEDZSA-N 2 1 314.473 3.548 20 10 DHCDMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]Cc2c(O)cccc2Cl)C1 ZINC000120800802 1013271518 /nfs/dbraw/zinc/27/15/18/1013271518.db2.gz BUEZYXAEIDNILK-AWEZNQCLSA-N 2 1 310.869 3.503 20 10 DHCDMP CC[C@H]([NH2+]CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1O ZINC000796675373 1013935150 /nfs/dbraw/zinc/93/51/50/1013935150.db2.gz NSBONVLRJQIRBS-KRWDZBQOSA-N 2 1 308.441 3.694 20 10 DHCDMP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2O)C[C@H](C)[N@@H+]1Cc1ccccc1 ZINC001168007555 1014433073 /nfs/dbraw/zinc/43/30/73/1014433073.db2.gz AWTPYQNQFJFCAT-XEMDLRDOSA-N 2 1 324.468 3.923 20 10 DHCDMP CC[NH+]1CCC([N@H+](C)Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000125205867 1032760440 /nfs/dbraw/zinc/76/04/40/1032760440.db2.gz LOTIKDTVHFUMSM-UHFFFAOYSA-N 2 1 315.505 3.593 20 10 DHCDMP CC[NH+]1CCC([N@@H+](C)Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000125205867 1032760454 /nfs/dbraw/zinc/76/04/54/1032760454.db2.gz LOTIKDTVHFUMSM-UHFFFAOYSA-N 2 1 315.505 3.593 20 10 DHCDMP C[C@H]([NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1ccccc1O ZINC000310081246 1020329835 /nfs/dbraw/zinc/32/98/35/1020329835.db2.gz JLBRBZKNMDZVKV-LAUBAEHRSA-N 2 1 324.468 3.955 20 10 DHCDMP Cc1ccc(O)c(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000379630256 1021611071 /nfs/dbraw/zinc/61/10/71/1021611071.db2.gz PIEVLRYFWVMHRK-FXAWDEMLSA-N 2 1 324.468 3.843 20 10 DHCDMP Cc1ccc(O)c(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000379630256 1021611081 /nfs/dbraw/zinc/61/10/81/1021611081.db2.gz PIEVLRYFWVMHRK-FXAWDEMLSA-N 2 1 324.468 3.843 20 10 DHCDMP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1ccc(N(C)C)cc1 ZINC000125856145 1033003258 /nfs/dbraw/zinc/00/32/58/1033003258.db2.gz KERPWVGPRIZUMR-YLJYHZDGSA-N 2 1 317.521 3.914 20 10 DHCDMP Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)c(O)c1C ZINC000853239113 1022238573 /nfs/dbraw/zinc/23/85/73/1022238573.db2.gz AFSNOHMGARPHOJ-SJLPKXTDSA-N 2 1 316.489 3.782 20 10 DHCDMP CC[NH+]1CCC([NH2+][C@@H]2c3c(c(C)cc(C)c3O)CC2(C)C)CC1 ZINC001169244274 1022322480 /nfs/dbraw/zinc/32/24/80/1022322480.db2.gz LBAAEIFFWPFMQD-LJQANCHMSA-N 2 1 316.489 3.706 20 10 DHCDMP CC[C@H]([NH2+]CCCCn1cc[nH+]c1C)c1ccc(N(C)C)cc1 ZINC000164646159 1023822011 /nfs/dbraw/zinc/82/20/11/1023822011.db2.gz ZYPCSGSTPVABNR-IBGZPJMESA-N 2 1 314.477 3.779 20 10 DHCDMP Cc1nccn1CC[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000278858151 1023968386 /nfs/dbraw/zinc/96/83/86/1023968386.db2.gz WBXNAEQCHZLIKR-SECBINFHSA-N 2 1 314.216 3.555 20 10 DHCDMP CCC[NH+]1CCC([NH2+]Cc2ccc(N(CC)CC)c(F)c2)CC1 ZINC000236779005 1024040898 /nfs/dbraw/zinc/04/08/98/1024040898.db2.gz OOXNDGTVFXLMKN-UHFFFAOYSA-N 2 1 321.484 3.636 20 10 DHCDMP c1cc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc2c1OCC2 ZINC000747100875 1024869126 /nfs/dbraw/zinc/86/91/26/1024869126.db2.gz WZBFJVGLLCPICW-UHFFFAOYSA-N 2 1 314.473 3.508 20 10 DHCDMP CCc1cccc(C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1O ZINC000691527935 1025807170 /nfs/dbraw/zinc/80/71/70/1025807170.db2.gz VNYUFNPOMPMKNN-SFHVURJKSA-N 2 1 324.468 3.566 20 10 DHCDMP CC[C@@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)c1ccc(C)cc1O ZINC000279997912 1026570910 /nfs/dbraw/zinc/57/09/10/1026570910.db2.gz FRSMGNXRPXWDOA-WMLDXEAASA-N 2 1 301.434 3.583 20 10 DHCDMP C[C@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000809765520 1026619733 /nfs/dbraw/zinc/61/97/33/1026619733.db2.gz NSEGANLEUGTAJA-OXJNMPFZSA-N 2 1 324.468 3.831 20 10 DHCDMP C[C@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000809765520 1026619738 /nfs/dbraw/zinc/61/97/38/1026619738.db2.gz NSEGANLEUGTAJA-OXJNMPFZSA-N 2 1 324.468 3.831 20 10 DHCDMP C[C@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000809765520 1026619743 /nfs/dbraw/zinc/61/97/43/1026619743.db2.gz NSEGANLEUGTAJA-OXJNMPFZSA-N 2 1 324.468 3.831 20 10 DHCDMP C[C@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000809765520 1026619747 /nfs/dbraw/zinc/61/97/47/1026619747.db2.gz NSEGANLEUGTAJA-OXJNMPFZSA-N 2 1 324.468 3.831 20 10 DHCDMP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](Cc2ccc3ccccc3c2O)C1 ZINC000816516647 1028919343 /nfs/dbraw/zinc/91/93/43/1028919343.db2.gz LXXQMZSYSJUZAC-QGZVFWFLSA-N 2 1 324.468 3.709 20 10 DHCDMP C[NH+](CC1CC1)C[C@H]1CC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816516647 1028919353 /nfs/dbraw/zinc/91/93/53/1028919353.db2.gz LXXQMZSYSJUZAC-QGZVFWFLSA-N 2 1 324.468 3.709 20 10 DHCDMP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816516647 1028919365 /nfs/dbraw/zinc/91/93/65/1028919365.db2.gz LXXQMZSYSJUZAC-QGZVFWFLSA-N 2 1 324.468 3.709 20 10 DHCDMP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1cc(Cl)c(Cl)cc1O ZINC000817948381 1029290854 /nfs/dbraw/zinc/29/08/54/1029290854.db2.gz ZDQKPSIZNFFYRF-GARJFASQSA-N 2 1 317.260 3.738 20 10 DHCDMP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1cc(Cl)c(Cl)cc1O ZINC000817948380 1029292281 /nfs/dbraw/zinc/29/22/81/1029292281.db2.gz ZDQKPSIZNFFYRF-DCAQKATOSA-N 2 1 317.260 3.738 20 10 DHCDMP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]CCc2ccc(N)cc2)cc1 ZINC000817955832 1029294066 /nfs/dbraw/zinc/29/40/66/1029294066.db2.gz ISRAGCFHXWWSOT-OAHLLOKOSA-N 2 1 320.440 3.656 20 10 DHCDMP C[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1cc(Cl)c(Cl)cc1O ZINC000817966413 1029304978 /nfs/dbraw/zinc/30/49/78/1029304978.db2.gz NGWZLEPMHFMAGO-BMIGLBTASA-N 2 1 317.260 3.739 20 10 DHCDMP C[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cc(Cl)c(Cl)cc1O ZINC000817979398 1029318157 /nfs/dbraw/zinc/31/81/57/1029318157.db2.gz AQUGCAUMPXWXAI-WDEREUQCSA-N 2 1 317.260 3.882 20 10 DHCDMP CC[C@H]([NH2+]C1CCC(C)([NH+]2CCC2)CC1)c1ccc(F)cc1O ZINC000927035667 1031043199 /nfs/dbraw/zinc/04/31/99/1031043199.db2.gz CBRFUHNKAMMTLN-RMXPPQQLSA-N 2 1 320.452 3.979 20 10 DHCDMP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000173427796 1033661851 /nfs/dbraw/zinc/66/18/51/1033661851.db2.gz JBKKBEHUGGUQHU-INIZCTEOSA-N 2 1 312.457 3.709 20 10 DHCDMP COc1ccc(O)c([C@H](C)[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)c1 ZINC000185034303 1034521926 /nfs/dbraw/zinc/52/19/26/1034521926.db2.gz CDXSYMGIQJBPQP-HOTGVXAUSA-N 2 1 320.477 3.564 20 10 DHCDMP COc1ccc(O)c([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)c1 ZINC000185033901 1034522766 /nfs/dbraw/zinc/52/27/66/1034522766.db2.gz NLQBRNBLFRSYDY-CVEARBPZSA-N 2 1 320.477 3.706 20 10 DHCDMP Cc1cc(O)c(C[N@H+]2CCC[C@H]3C[NH+](C)CC[C@@H]32)cc1C(C)C ZINC000129305975 1034702764 /nfs/dbraw/zinc/70/27/64/1034702764.db2.gz CRHALDKCJDOJAT-LPHOPBHVSA-N 2 1 316.489 3.740 20 10 DHCDMP Cc1cc(O)c(C[NH+]2CCC[C@H]3C[N@H+](C)CC[C@@H]32)cc1C(C)C ZINC000129305975 1034702776 /nfs/dbraw/zinc/70/27/76/1034702776.db2.gz CRHALDKCJDOJAT-LPHOPBHVSA-N 2 1 316.489 3.740 20 10 DHCDMP Cc1cc(O)c(C[NH+]2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)cc1C(C)C ZINC000129305975 1034702788 /nfs/dbraw/zinc/70/27/88/1034702788.db2.gz CRHALDKCJDOJAT-LPHOPBHVSA-N 2 1 316.489 3.740 20 10 DHCDMP C[C@H]([NH2+]CCCC[NH+](C)C)c1cc(Cl)c(Cl)cc1O ZINC000774160136 1036207423 /nfs/dbraw/zinc/20/74/23/1036207423.db2.gz RYADJYOZKZCKBC-JTQLQIEISA-N 2 1 305.249 3.691 20 10 DHCDMP CC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1)c1ccc(F)cc1O ZINC000286136927 131221324 /nfs/dbraw/zinc/22/13/24/131221324.db2.gz OUIMVYOLLVCSRO-RHSMWYFYSA-N 2 1 308.441 3.692 20 10 DHCDMP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](C(C)C)C1)c1ccc(F)cc1O ZINC000286136927 131221325 /nfs/dbraw/zinc/22/13/25/131221325.db2.gz OUIMVYOLLVCSRO-RHSMWYFYSA-N 2 1 308.441 3.692 20 10 DHCDMP Oc1cccc2c1[C@@H]([NH2+]C1CC[NH+](Cc3ccccc3)CC1)CC2 ZINC000295853379 341715417 /nfs/dbraw/zinc/71/54/17/341715417.db2.gz GDIQIPRQKNATBF-IBGZPJMESA-N 2 1 322.452 3.634 20 10 DHCDMP Cc1cccc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c1O ZINC000181032858 524435916 /nfs/dbraw/zinc/43/59/16/524435916.db2.gz OPIAKBWGKUTQCO-UHFFFAOYSA-N 2 1 312.457 3.831 20 10 DHCDMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000158087334 1016324217 /nfs/dbraw/zinc/32/42/17/1016324217.db2.gz KRVCDDOOMYTJJU-MSOLQXFVSA-N 2 1 315.505 3.669 20 10 DHCDMP CC(C)C[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)C1 ZINC000773074819 1032548522 /nfs/dbraw/zinc/54/85/22/1032548522.db2.gz HZEDNPLVTICRFU-ROUUACIJSA-N 2 1 317.521 3.771 20 10 DHCDMP CC[C@H](C[NH2+][C@H](C)c1ccc(N(C)CC)cc1)[NH+]1CCCC1 ZINC000764868805 1018408861 /nfs/dbraw/zinc/40/88/61/1018408861.db2.gz JBQKSOCVNMNEBZ-SJLPKXTDSA-N 2 1 303.494 3.668 20 10 DHCDMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000766167137 1019100045 /nfs/dbraw/zinc/10/00/45/1019100045.db2.gz SFNBUTQWFHCCRZ-AOIWGVFYSA-N 2 1 315.505 3.810 20 10 DHCDMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000766167137 1019100054 /nfs/dbraw/zinc/10/00/54/1019100054.db2.gz SFNBUTQWFHCCRZ-AOIWGVFYSA-N 2 1 315.505 3.810 20 10 DHCDMP CC[C@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1cc(Cl)ccc1O ZINC000858490703 1032917271 /nfs/dbraw/zinc/91/72/71/1032917271.db2.gz MHSJNFYLBHJNGX-BBRMVZONSA-N 2 1 310.869 3.818 20 10 DHCDMP C[C@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1cc2c(cc1O)CCCC2 ZINC000858490605 1032918351 /nfs/dbraw/zinc/91/83/51/1032918351.db2.gz KKZOLLXJKGXPPS-JKSUJKDBSA-N 2 1 316.489 3.654 20 10 DHCDMP C[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+](C)C1)c1cc2c(cc1O)CCCC2 ZINC000858490602 1032919249 /nfs/dbraw/zinc/91/92/49/1032919249.db2.gz KKZOLLXJKGXPPS-CVEARBPZSA-N 2 1 316.489 3.654 20 10 DHCDMP C[NH+](C)C[C@@H]1CC[N@@H+](Cc2cc3oc4ccccc4c3cc2O)C1 ZINC000738225801 1020864509 /nfs/dbraw/zinc/86/45/09/1020864509.db2.gz CZCUMOWYZFVYSB-AWEZNQCLSA-N 2 1 324.424 3.675 20 10 DHCDMP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000743388936 1021277371 /nfs/dbraw/zinc/27/73/71/1021277371.db2.gz WRHIWYHNEGUZKT-QGZVFWFLSA-N 2 1 318.505 3.988 20 10 DHCDMP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2O)CC[N@@H+]1Cc1ccccc1 ZINC000379646474 1021657443 /nfs/dbraw/zinc/65/74/43/1021657443.db2.gz JEYVYTQYAOOPBX-APWZRJJASA-N 2 1 310.441 3.535 20 10 DHCDMP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2O)CC[N@H+]1Cc1ccccc1 ZINC000379646474 1021657447 /nfs/dbraw/zinc/65/74/47/1021657447.db2.gz JEYVYTQYAOOPBX-APWZRJJASA-N 2 1 310.441 3.535 20 10 DHCDMP Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)c(O)c1C ZINC000853239112 1022239876 /nfs/dbraw/zinc/23/98/76/1022239876.db2.gz AFSNOHMGARPHOJ-FUHWJXTLSA-N 2 1 316.489 3.782 20 10 DHCDMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(C)cc1O ZINC000853239383 1022242186 /nfs/dbraw/zinc/24/21/86/1022242186.db2.gz GLYHQPVTWIBAHK-PKOBYXMFSA-N 2 1 316.489 3.863 20 10 DHCDMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(N(C)C)cc1 ZINC000853241435 1022242566 /nfs/dbraw/zinc/24/25/66/1022242566.db2.gz VFFXRVDYUWOLLD-AEFFLSMTSA-N 2 1 315.505 3.525 20 10 DHCDMP Cc1cccc(C[NH2+][C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1O ZINC000272670395 1022511431 /nfs/dbraw/zinc/51/14/31/1022511431.db2.gz SVRBYKHLKWPPDE-YLJYHZDGSA-N 2 1 324.468 3.701 20 10 DHCDMP Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)c(O)c1 ZINC000788593630 1023910693 /nfs/dbraw/zinc/91/06/93/1023910693.db2.gz HBMCAVCKAKOKCM-IRXDYDNUSA-N 2 1 304.478 3.780 20 10 DHCDMP C[C@@H]([NH2+][C@@H](C)c1c(O)cccc1F)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000886588726 1025726867 /nfs/dbraw/zinc/72/68/67/1025726867.db2.gz XXONVWGFNGYVCD-ILXRZTDVSA-N 2 1 320.452 3.835 20 10 DHCDMP C[C@@H]([NH2+][C@@H](C)c1c(O)cccc1F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000886588726 1025726879 /nfs/dbraw/zinc/72/68/79/1025726879.db2.gz XXONVWGFNGYVCD-ILXRZTDVSA-N 2 1 320.452 3.835 20 10 DHCDMP Cc1cc(Cl)cc([C@@H](C)[NH2+]C2CC[NH+](C(C)C)CC2)c1O ZINC000808705410 1026357350 /nfs/dbraw/zinc/35/73/50/1026357350.db2.gz YUNXBSYBPOBJLS-CYBMUJFWSA-N 2 1 310.869 3.877 20 10 DHCDMP C[C@H]([NH2+]CC1=CC[N@@H+](C)CC1)c1ccc(N2CCCCC2)cc1 ZINC000271817241 1027151768 /nfs/dbraw/zinc/15/17/68/1027151768.db2.gz BVCNWNDBCPXWAK-KRWDZBQOSA-N 2 1 313.489 3.589 20 10 DHCDMP CC[C@H](c1ccccc1O)[NH+]1CCC(Cc2[nH+]ccn2C)CC1 ZINC000364621278 1027854572 /nfs/dbraw/zinc/85/45/72/1027854572.db2.gz GZMOAINFICAYMQ-QGZVFWFLSA-N 2 1 313.445 3.532 20 10 DHCDMP CC[C@H](c1ccccc1O)[N@H+]1CC[C@H](C2CC[NH+](C)CC2)C1 ZINC000368137220 1028310430 /nfs/dbraw/zinc/31/04/30/1028310430.db2.gz YGDHAAGYDYYVEV-FUHWJXTLSA-N 2 1 302.462 3.507 20 10 DHCDMP Cc1cc(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)ccc1N(C)C ZINC000815052157 1028337513 /nfs/dbraw/zinc/33/75/13/1028337513.db2.gz DZAHQIXMZGUWLO-IBGZPJMESA-N 2 1 315.505 3.511 20 10 DHCDMP C[C@@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)[C@H]1CCC[NH2+]C1 ZINC000817948384 1029291442 /nfs/dbraw/zinc/29/14/42/1029291442.db2.gz ZDQKPSIZNFFYRF-VWYCJHECSA-N 2 1 317.260 3.738 20 10 DHCDMP C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1cc(Cl)c(Cl)cc1O ZINC000817976605 1029314960 /nfs/dbraw/zinc/31/49/60/1029314960.db2.gz OXHIVBKIGNDJPN-VHSXEESVSA-N 2 1 305.249 3.867 20 10 DHCDMP C[C@H]([NH2+][C@@H]1CCCC[C@H]1[NH3+])c1ccc(N2CCCCC2)c(F)c1 ZINC000818618923 1029421687 /nfs/dbraw/zinc/42/16/87/1029421687.db2.gz UUEMRBBUACRHSA-BMGDILEWSA-N 2 1 319.468 3.737 20 10 DHCDMP COc1cccc([C@H](C)[NH2+]CCC[N@@H+](C)C2CCCCC2)c1O ZINC000846135521 1031900962 /nfs/dbraw/zinc/90/09/62/1031900962.db2.gz DPMMAVPRAUFLGW-HNNXBMFYSA-N 2 1 320.477 3.706 20 10 DHCDMP C[C@@H]([NH2+]C1CCC(C)([NH+]2CCC2)CC1)c1c(O)cccc1F ZINC000927036870 1033406494 /nfs/dbraw/zinc/40/64/94/1033406494.db2.gz JYDICHWFMKCIMM-WRSVWVKZSA-N 2 1 306.425 3.589 20 10 DHCDMP C[C@@H]([NH2+][C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1O ZINC000877755966 1033435664 /nfs/dbraw/zinc/43/56/64/1033435664.db2.gz UZWNTZWZAQVWAO-ZHALLVOQSA-N 2 1 324.468 3.953 20 10 DHCDMP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H](CCc1ccccc1)c1ccccc1O ZINC000863543720 1034123492 /nfs/dbraw/zinc/12/34/92/1034123492.db2.gz WOPAYJPQKVPKBC-SLFFLAALSA-N 2 1 324.468 3.796 20 10 DHCDMP Cc1cc(O)c(C[NH2+]CC(C)(C)C[NH+]2CCCC2)c(Cl)c1 ZINC001178615134 1035439882 /nfs/dbraw/zinc/43/98/82/1035439882.db2.gz RMFUDIOTGBIQDL-UHFFFAOYSA-N 2 1 310.869 3.566 20 10 DHCDMP CCc1cccc(C[N@H+]2CCCC[C@@H]2[C@@H](C)C[NH+](C)C)c1O ZINC001183065919 1036517269 /nfs/dbraw/zinc/51/72/69/1036517269.db2.gz ROOGWVNLMYNYPT-MAUKXSAKSA-N 2 1 304.478 3.507 20 10 DHCDMP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(Cl)cc(C)c2O)C[C@H]1C ZINC000775715930 1036534219 /nfs/dbraw/zinc/53/42/19/1036534219.db2.gz MIHRYYSLKIBPLM-CZUORRHYSA-N 2 1 310.869 3.659 20 10 DHCDMP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(Cl)cc(C)c2O)C[C@H]1C ZINC000775715930 1036534227 /nfs/dbraw/zinc/53/42/27/1036534227.db2.gz MIHRYYSLKIBPLM-CZUORRHYSA-N 2 1 310.869 3.659 20 10 DHCDMP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(Cl)cc(C)c2O)C[C@H]1C ZINC000775715930 1036534238 /nfs/dbraw/zinc/53/42/38/1036534238.db2.gz MIHRYYSLKIBPLM-CZUORRHYSA-N 2 1 310.869 3.659 20 10 DHCDMP Cc1cc(O)c(C[NH2+]CCC[NH+]2C[C@@H](C)C[C@H](C)C2)c(Cl)c1 ZINC001199329352 1037243542 /nfs/dbraw/zinc/24/35/42/1037243542.db2.gz RBZRGRULQBZLRN-GJZGRUSLSA-N 2 1 324.896 3.812 20 10 DHCDMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(N(C)CC)cc2)C1 ZINC000151103772 1037724956 /nfs/dbraw/zinc/72/49/56/1037724956.db2.gz SAIAEUPVMFVMIS-DLBZAZTESA-N 2 1 303.494 3.525 20 10 DHCDMP CC[C@H]([NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc(Cl)ccc1O ZINC000775487047 1038551988 /nfs/dbraw/zinc/55/19/88/1038551988.db2.gz GYLJACKXCOJFIO-LZWOXQAQSA-N 2 1 308.853 3.713 20 10 DHCDMP CC[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cc(Cl)ccc1O ZINC000775493283 1038569966 /nfs/dbraw/zinc/56/99/66/1038569966.db2.gz WXICDCCGKNTXIR-WBMJQRKESA-N 2 1 308.853 3.571 20 10 DHCDMP CC[C@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1ccc(F)cc1O ZINC000286013419 535894639 /nfs/dbraw/zinc/89/46/39/535894639.db2.gz JHQYSQZGNQNCCK-SFHVURJKSA-N 2 1 320.452 3.979 20 10 DHCDMP Cc1cc(O)c(C[N@@H+]2CCCC3(CC[NH+](C)CC3)C2)cc1Cl ZINC000825762308 1032784548 /nfs/dbraw/zinc/78/45/48/1032784548.db2.gz IFHMCWCJGCPMQA-UHFFFAOYSA-N 2 1 322.880 3.662 20 10 DHCDMP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccccc1O ZINC000310343180 1020370051 /nfs/dbraw/zinc/37/00/51/1020370051.db2.gz DOXPGVGMLIKNDB-PKOBYXMFSA-N 2 1 324.468 3.955 20 10 DHCDMP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1ccc(Cl)cc1O ZINC000853239124 1022240017 /nfs/dbraw/zinc/24/00/17/1022240017.db2.gz AKDOHSUEZDQAOY-HIFRSBDPSA-N 2 1 322.880 3.818 20 10 DHCDMP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(Cl)cc1O ZINC000853239124 1022240021 /nfs/dbraw/zinc/24/00/21/1022240021.db2.gz AKDOHSUEZDQAOY-HIFRSBDPSA-N 2 1 322.880 3.818 20 10 DHCDMP Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)c1 ZINC000186142451 1022554204 /nfs/dbraw/zinc/55/42/04/1022554204.db2.gz PONLVZHBYGYQKW-IAGOWNOFSA-N 2 1 304.478 3.719 20 10 DHCDMP C[N@@H+](CC[C@@H]1CCC[NH+]1C)Cc1ccc(N2CCCCC2)cc1 ZINC000767357902 1022696545 /nfs/dbraw/zinc/69/65/45/1022696545.db2.gz BXKQLHOJTSCFRV-IBGZPJMESA-N 2 1 315.505 3.593 20 10 DHCDMP C[NH+](CC[C@@H]1CCC[N@@H+]1C)Cc1ccc(N2CCCCC2)cc1 ZINC000767357902 1022696551 /nfs/dbraw/zinc/69/65/51/1022696551.db2.gz BXKQLHOJTSCFRV-IBGZPJMESA-N 2 1 315.505 3.593 20 10 DHCDMP C[NH+](CC[C@@H]1CCC[N@H+]1C)Cc1ccc(N2CCCCC2)cc1 ZINC000767357902 1022696556 /nfs/dbraw/zinc/69/65/56/1022696556.db2.gz BXKQLHOJTSCFRV-IBGZPJMESA-N 2 1 315.505 3.593 20 10 DHCDMP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](C(C)C)C2)c(O)c1C ZINC000756546549 1022889310 /nfs/dbraw/zinc/88/93/10/1022889310.db2.gz RSJDRJPJCHARLL-SJORKVTESA-N 2 1 304.478 3.780 20 10 DHCDMP CCN(C)c1ccc([C@@H](C)[NH2+]CCCCn2cc[nH+]c2C)cc1 ZINC000164608510 1023807994 /nfs/dbraw/zinc/80/79/94/1023807994.db2.gz YAMWKFBYTVKIDD-MRXNPFEDSA-N 2 1 314.477 3.779 20 10 DHCDMP CC[N@@H+](C)Cc1cccc(C[NH2+]Cc2c(O)cccc2Cl)c1 ZINC000113336050 1024797237 /nfs/dbraw/zinc/79/72/37/1024797237.db2.gz AYICCPJBGFMBOJ-UHFFFAOYSA-N 2 1 318.848 3.787 20 10 DHCDMP CC[C@@H](c1ccccc1O)[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000367321743 1028167943 /nfs/dbraw/zinc/16/79/43/1028167943.db2.gz JNNIEGKTFRGLQV-AEFFLSMTSA-N 2 1 302.462 3.794 20 10 DHCDMP Cc1cc(C)c([C@H](C)[NH2+]CCC[N@H+]2CCCC[C@@H]2C)c(O)c1 ZINC000815555451 1028539850 /nfs/dbraw/zinc/53/98/50/1028539850.db2.gz ZUZWZQCGQQMVIC-IRXDYDNUSA-N 2 1 304.478 3.924 20 10 DHCDMP CC(C)[NH2+]CCC[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000817953972 1029295706 /nfs/dbraw/zinc/29/57/06/1029295706.db2.gz TZFGYRIBVDPCCI-SNVBAGLBSA-N 2 1 305.249 3.738 20 10 DHCDMP CC(C)C[C@H](C[NH3+])[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000817960485 1029300622 /nfs/dbraw/zinc/30/06/22/1029300622.db2.gz ZQMUFGBUBNACAH-SJLPKXTDSA-N 2 1 303.494 3.701 20 10 DHCDMP COc1cccc([C@@H](C)[NH2+]CCC[N@@H+](C)C2CCCCC2)c1O ZINC000846135524 1031900447 /nfs/dbraw/zinc/90/04/47/1031900447.db2.gz DPMMAVPRAUFLGW-OAHLLOKOSA-N 2 1 320.477 3.706 20 10 DHCDMP COc1cccc([C@@H](C)[NH2+]CCCC[N@H+]2CCCC[C@H]2C)c1O ZINC000846140152 1031900674 /nfs/dbraw/zinc/90/06/74/1031900674.db2.gz HMYBMOBVXBSRQK-HZPDHXFCSA-N 2 1 320.477 3.706 20 10 DHCDMP C[C@@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(F)cc1O ZINC000186518271 1034637415 /nfs/dbraw/zinc/63/74/15/1034637415.db2.gz UGACFSIQHDCTFH-RRFJBIMHSA-N 2 1 320.452 3.835 20 10 DHCDMP C[C@@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc(F)cc1O ZINC000186518271 1034637418 /nfs/dbraw/zinc/63/74/18/1034637418.db2.gz UGACFSIQHDCTFH-RRFJBIMHSA-N 2 1 320.452 3.835 20 10 DHCDMP C[C@@H]([NH2+][C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cc(F)ccc1O ZINC000186518940 1034638576 /nfs/dbraw/zinc/63/85/76/1034638576.db2.gz FPQLFRJDJAAAKD-RRFJBIMHSA-N 2 1 320.452 3.835 20 10 DHCDMP CCc1cc(C[N@H+]2CC[C@@H](C[NH+](C)C)C2)c(O)c(C(C)(C)C)c1 ZINC000153144265 1035768203 /nfs/dbraw/zinc/76/82/03/1035768203.db2.gz ZWLAMTJYIIWUJM-INIZCTEOSA-N 2 1 318.505 3.636 20 10 DHCDMP CC(C)[NH+](CCC[NH2+]Cc1ccc2c(c1)CCCO2)C(C)C ZINC001200923880 1037466674 /nfs/dbraw/zinc/46/66/74/1037466674.db2.gz URNURJNTBGROJK-UHFFFAOYSA-N 2 1 304.478 3.610 20 10 DHCDMP CC[C@@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1ccc(F)cc1O ZINC000286013418 131214977 /nfs/dbraw/zinc/21/49/77/131214977.db2.gz JHQYSQZGNQNCCK-GOSISDBHSA-N 2 1 320.452 3.979 20 10 DHCDMP Oc1c(C[N@H+]2CCCC3(CC[NH2+]CC3)C2)ccc2ccccc21 ZINC001204743063 1013391936 /nfs/dbraw/zinc/39/19/36/1013391936.db2.gz ZJSYUYXOEFFKGK-UHFFFAOYSA-N 2 1 310.441 3.511 20 10 DHCDMP C[C@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1ccc(F)cc1O ZINC000185036371 1016523337 /nfs/dbraw/zinc/52/33/37/1016523337.db2.gz RCJWTFGVMCBSSH-HNNXBMFYSA-N 2 1 308.441 3.694 20 10 DHCDMP Cc1ccc(O)c([C@H](C)[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)c1 ZINC000185034205 1016524015 /nfs/dbraw/zinc/52/40/15/1016524015.db2.gz ITTNGZMGCDTPTN-IRXDYDNUSA-N 2 1 304.478 3.863 20 10 DHCDMP CC[C@H](C[NH2+][C@H](CC)c1ccc(N(C)C)cc1)[NH+]1CCCC1 ZINC000764867699 1018409809 /nfs/dbraw/zinc/40/98/09/1018409809.db2.gz CZMPEQSTBDOHCQ-IEBWSBKVSA-N 2 1 303.494 3.668 20 10 DHCDMP C[C@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccc(N(C)C)cc1 ZINC000764963477 1018441828 /nfs/dbraw/zinc/44/18/28/1018441828.db2.gz PKASIQCWRJWIQF-MSOLQXFVSA-N 2 1 317.521 3.915 20 10 DHCDMP COc1ccc(C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1C ZINC000310077282 1020317022 /nfs/dbraw/zinc/31/70/22/1020317022.db2.gz GZOIOGRGQIPGAD-FQEVSTJZSA-N 2 1 324.468 3.615 20 10 DHCDMP CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H]2CCCC[N@@H+](C)C2)cc1 ZINC000858490436 1032915310 /nfs/dbraw/zinc/91/53/10/1032915310.db2.gz HIOZZVKZRDIFMZ-IRXDYDNUSA-N 2 1 303.494 3.525 20 10 DHCDMP CC[C@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1ccc(N(C)C)cc1 ZINC000858490277 1032919053 /nfs/dbraw/zinc/91/90/53/1032919053.db2.gz DPFBQRRJPXGYFD-APWZRJJASA-N 2 1 303.494 3.525 20 10 DHCDMP CC[C@@H]([NH2+]C[C@H]1CCCC[N@@H+](C)C1)c1cc(Cl)ccc1O ZINC000858490705 1032919176 /nfs/dbraw/zinc/91/91/76/1032919176.db2.gz MHSJNFYLBHJNGX-CZUORRHYSA-N 2 1 310.869 3.818 20 10 DHCDMP C[N@H+](Cc1cc(-c2ccccc2)ccc1O)C[C@H]1CCC[NH+](C)C1 ZINC000768547647 1022994698 /nfs/dbraw/zinc/99/46/98/1022994698.db2.gz WKOUBNVLOFJNON-KRWDZBQOSA-N 2 1 324.468 3.833 20 10 DHCDMP C[NH+](Cc1cc(-c2ccccc2)ccc1O)C[C@H]1CCC[N@H+](C)C1 ZINC000768547647 1022994706 /nfs/dbraw/zinc/99/47/06/1022994706.db2.gz WKOUBNVLOFJNON-KRWDZBQOSA-N 2 1 324.468 3.833 20 10 DHCDMP C[NH+](Cc1cc(-c2ccccc2)ccc1O)C[C@H]1CCC[N@@H+](C)C1 ZINC000768547647 1022994713 /nfs/dbraw/zinc/99/47/13/1022994713.db2.gz WKOUBNVLOFJNON-KRWDZBQOSA-N 2 1 324.468 3.833 20 10 DHCDMP Cc1cc(C)c([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](C(C)C)C2)c(O)c1 ZINC000788593629 1023910716 /nfs/dbraw/zinc/91/07/16/1023910716.db2.gz HBMCAVCKAKOKCM-IAGOWNOFSA-N 2 1 304.478 3.780 20 10 DHCDMP Cc1nccn1CC[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000278858154 1023970082 /nfs/dbraw/zinc/97/00/82/1023970082.db2.gz WBXNAEQCHZLIKR-VIFPVBQESA-N 2 1 314.216 3.555 20 10 DHCDMP CCN(CC)c1ccc(C[NH2+]C2CC([NH+]3CCCCC3)C2)cc1 ZINC000793335618 1024994066 /nfs/dbraw/zinc/99/40/66/1024994066.db2.gz HICCHOQWHGECRI-UHFFFAOYSA-N 2 1 315.505 3.639 20 10 DHCDMP Cc1cc(C[N@@H+](C)CC2CC[NH+](C)CC2)c(O)c(C(C)(C)C)c1 ZINC000728907184 1025163629 /nfs/dbraw/zinc/16/36/29/1025163629.db2.gz PMEFUAKQSIUSGJ-UHFFFAOYSA-N 2 1 318.505 3.772 20 10 DHCDMP Cc1cc(O)c(C[N@@H+]2CCC(C)(C)[NH2+]C(C)(C)C2)cc1Cl ZINC001207836644 1025678589 /nfs/dbraw/zinc/67/85/89/1025678589.db2.gz KMPJJUDMJPOTQN-UHFFFAOYSA-N 2 1 310.869 3.707 20 10 DHCDMP Cc1cc(O)c(C[N@H+]2CCC(C)(C)[NH2+]C(C)(C)C2)cc1Cl ZINC001207836644 1025678606 /nfs/dbraw/zinc/67/86/06/1025678606.db2.gz KMPJJUDMJPOTQN-UHFFFAOYSA-N 2 1 310.869 3.707 20 10 DHCDMP Cc1cc(Cl)cc([C@@H](C)[NH2+]C2CC[NH+](C3CC3)CC2)c1O ZINC000808673743 1026353500 /nfs/dbraw/zinc/35/35/00/1026353500.db2.gz SRLWSAQUPQTTQH-GFCCVEGCSA-N 2 1 308.853 3.631 20 10 DHCDMP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2c(O)cccc2Cl)cc1 ZINC000809739168 1026611700 /nfs/dbraw/zinc/61/17/00/1026611700.db2.gz ZVNGIOYNJKRZGK-UHFFFAOYSA-N 2 1 318.848 3.739 20 10 DHCDMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C(C)C)C1)c1ccc(C)cc1O ZINC000280243581 1026616962 /nfs/dbraw/zinc/61/69/62/1026616962.db2.gz WDUCVJOAIZEMQY-FUHWJXTLSA-N 2 1 304.478 3.862 20 10 DHCDMP C[C@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000809765519 1026620894 /nfs/dbraw/zinc/62/08/94/1026620894.db2.gz NSEGANLEUGTAJA-JXFKEZNVSA-N 2 1 324.468 3.831 20 10 DHCDMP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000809765519 1026620901 /nfs/dbraw/zinc/62/09/01/1026620901.db2.gz NSEGANLEUGTAJA-JXFKEZNVSA-N 2 1 324.468 3.831 20 10 DHCDMP C[C@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000809765519 1026620904 /nfs/dbraw/zinc/62/09/04/1026620904.db2.gz NSEGANLEUGTAJA-JXFKEZNVSA-N 2 1 324.468 3.831 20 10 DHCDMP C[C@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000809765519 1026620914 /nfs/dbraw/zinc/62/09/14/1026620914.db2.gz NSEGANLEUGTAJA-JXFKEZNVSA-N 2 1 324.468 3.831 20 10 DHCDMP CC[C@@H](c1ccccc1O)[N@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000367356508 1028173166 /nfs/dbraw/zinc/17/31/66/1028173166.db2.gz NOQYGAIODNCROT-KRWDZBQOSA-N 2 1 302.462 3.651 20 10 DHCDMP CC(C)C[C@@H](C[NH3+])[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000817960483 1029302138 /nfs/dbraw/zinc/30/21/38/1029302138.db2.gz ZQMUFGBUBNACAH-AEFFLSMTSA-N 2 1 303.494 3.701 20 10 DHCDMP C[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccc(F)cc1O ZINC000817984014 1029322932 /nfs/dbraw/zinc/32/29/32/1029322932.db2.gz UVUMQUJIGBNQIF-CXAGYDPISA-N 2 1 302.393 3.662 20 10 DHCDMP CCC[N@@H+](C)C[C@@H]1CCN(Cc2cc(Cl)c(C)cc2O)C1 ZINC000824888543 1030668175 /nfs/dbraw/zinc/66/81/75/1030668175.db2.gz FZEIQLCRRJANHG-AWEZNQCLSA-N 2 1 310.869 3.518 20 10 DHCDMP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2cc(Cl)c(C)cc2O)C1 ZINC000824888543 1030668182 /nfs/dbraw/zinc/66/81/82/1030668182.db2.gz FZEIQLCRRJANHG-AWEZNQCLSA-N 2 1 310.869 3.518 20 10 DHCDMP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2cc(Cl)c(C)cc2O)C1 ZINC000824888543 1030668189 /nfs/dbraw/zinc/66/81/89/1030668189.db2.gz FZEIQLCRRJANHG-AWEZNQCLSA-N 2 1 310.869 3.518 20 10 DHCDMP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2c(O)ccc3ccccc32)C1 ZINC000173444145 1033750058 /nfs/dbraw/zinc/75/00/58/1033750058.db2.gz UHTBOTOYNFSITB-INIZCTEOSA-N 2 1 312.457 3.709 20 10 DHCDMP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000173444145 1033750071 /nfs/dbraw/zinc/75/00/71/1033750071.db2.gz UHTBOTOYNFSITB-INIZCTEOSA-N 2 1 312.457 3.709 20 10 DHCDMP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000173444145 1033750087 /nfs/dbraw/zinc/75/00/87/1033750087.db2.gz UHTBOTOYNFSITB-INIZCTEOSA-N 2 1 312.457 3.709 20 10 DHCDMP CC[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cc(F)ccc2O)c1 ZINC000185352754 1034542417 /nfs/dbraw/zinc/54/24/17/1034542417.db2.gz SURWGZCIALYUKZ-CQSZACIVSA-N 2 1 316.420 3.834 20 10 DHCDMP C[C@@H]([NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(F)cc1O ZINC000186518304 1034639369 /nfs/dbraw/zinc/63/93/69/1034639369.db2.gz UGACFSIQHDCTFH-RBSFLKMASA-N 2 1 320.452 3.835 20 10 DHCDMP C[C@@H]([NH2+][C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc(F)cc1O ZINC000186518304 1034639375 /nfs/dbraw/zinc/63/93/75/1034639375.db2.gz UGACFSIQHDCTFH-RBSFLKMASA-N 2 1 320.452 3.835 20 10 DHCDMP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1O ZINC000195134663 1035415462 /nfs/dbraw/zinc/41/54/62/1035415462.db2.gz XPGHJKOOTMZXDK-AEFFLSMTSA-N 2 1 310.441 3.565 20 10 DHCDMP Cc1cc(O)c(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)c(Cl)c1 ZINC001180165182 1035617297 /nfs/dbraw/zinc/61/72/97/1035617297.db2.gz DWLATBHGQPGQHD-UHFFFAOYSA-N 2 1 324.896 3.906 20 10 DHCDMP C[C@H]1CC[N@H+](Cc2cc(Cl)c(Cl)cc2O)CC[C@@H]1C[NH3+] ZINC001205651216 1035760475 /nfs/dbraw/zinc/76/04/75/1035760475.db2.gz BBSJXVIJUKZSCS-WDEREUQCSA-N 2 1 317.260 3.506 20 10 DHCDMP C[C@H]1CC[N@@H+](Cc2cc(Cl)c(Cl)cc2O)CC[C@@H]1C[NH3+] ZINC001205651216 1035760487 /nfs/dbraw/zinc/76/04/87/1035760487.db2.gz BBSJXVIJUKZSCS-WDEREUQCSA-N 2 1 317.260 3.506 20 10 DHCDMP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000284033399 131042618 /nfs/dbraw/zinc/04/26/18/131042618.db2.gz JJTRXYXGCSYJQW-OAHLLOKOSA-N 2 1 301.434 3.645 20 10 DHCDMP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1cccc(Cl)c1[O-] ZINC000287319325 131275041 /nfs/dbraw/zinc/27/50/41/131275041.db2.gz DIEPMFUUKGWGBT-MLGOLLRUSA-N 2 1 308.853 3.571 20 10 DHCDMP CC[C@@H]([NH2+]C[C@H]1CCN(C2CC2)C1)c1cccc(Cl)c1[O-] ZINC000287319325 131275042 /nfs/dbraw/zinc/27/50/42/131275042.db2.gz DIEPMFUUKGWGBT-MLGOLLRUSA-N 2 1 308.853 3.571 20 10 DHCDMP C[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc(F)cc1O ZINC000185634411 333211186 /nfs/dbraw/zinc/21/11/86/333211186.db2.gz BWZWCPMYGZEJKZ-CQSZACIVSA-N 2 1 320.452 3.979 20 10 DHCDMP Cc1ccc(O)c([C@H](C)[NH2+]CCC[N@@H+](C)Cc2ccccc2)c1 ZINC000302868060 1013475289 /nfs/dbraw/zinc/47/52/89/1013475289.db2.gz CYXVGNJHSSPPGK-KRWDZBQOSA-N 2 1 312.457 3.873 20 10 DHCDMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(N(C)C)cc2)C1 ZINC000773074817 1032548204 /nfs/dbraw/zinc/54/82/04/1032548204.db2.gz HZEDNPLVTICRFU-QZTJIDSGSA-N 2 1 317.521 3.771 20 10 DHCDMP CC[C@@H]([NH2+]C[C@H](CC)[NH+]1CCCC1)c1ccc(N(C)C)cc1 ZINC000764867701 1018408739 /nfs/dbraw/zinc/40/87/39/1018408739.db2.gz CZMPEQSTBDOHCQ-PKOBYXMFSA-N 2 1 303.494 3.668 20 10 DHCDMP C[C@@H]([NH2+]CCCC[N@H+]1CCC[C@@H](C)C1)c1ccc(N(C)C)cc1 ZINC000764963479 1018441386 /nfs/dbraw/zinc/44/13/86/1018441386.db2.gz PKASIQCWRJWIQF-QZTJIDSGSA-N 2 1 317.521 3.915 20 10 DHCDMP CN(C)c1ccc(C[N@@H+](C)C2CC(C)(C)[NH+](C)C(C)(C)C2)cc1 ZINC001171643866 1032840155 /nfs/dbraw/zinc/84/01/55/1032840155.db2.gz XAZPJSSJISLBNV-UHFFFAOYSA-N 2 1 317.521 3.836 20 10 DHCDMP Cc1ccc(O)c(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000379630257 1021612433 /nfs/dbraw/zinc/61/24/33/1021612433.db2.gz PIEVLRYFWVMHRK-PXNSSMCTSA-N 2 1 324.468 3.843 20 10 DHCDMP Cc1ccc(O)c(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000379630257 1021612438 /nfs/dbraw/zinc/61/24/38/1021612438.db2.gz PIEVLRYFWVMHRK-PXNSSMCTSA-N 2 1 324.468 3.843 20 10 DHCDMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccccc1O ZINC000853239339 1022241685 /nfs/dbraw/zinc/24/16/85/1022241685.db2.gz FTVWHHVFCYAOLD-WMZOPIPTSA-N 2 1 302.462 3.555 20 10 DHCDMP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccc(C)cc1O ZINC000853239380 1022242717 /nfs/dbraw/zinc/24/27/17/1022242717.db2.gz GLYHQPVTWIBAHK-HKUYNNGSSA-N 2 1 316.489 3.863 20 10 DHCDMP C[C@H]1C[N@H+](Cc2c(O)ccc(Cl)c2Cl)CCC[C@@H]1C[NH3+] ZINC001206022787 1022565923 /nfs/dbraw/zinc/56/59/23/1022565923.db2.gz CTEDRHYTSAZBIT-WDEREUQCSA-N 2 1 317.260 3.506 20 10 DHCDMP C[C@H]1C[N@@H+](Cc2c(O)ccc(Cl)c2Cl)CCC[C@@H]1C[NH3+] ZINC001206022787 1022565931 /nfs/dbraw/zinc/56/59/31/1022565931.db2.gz CTEDRHYTSAZBIT-WDEREUQCSA-N 2 1 317.260 3.506 20 10 DHCDMP Cc1ccc(O)c(C[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)c1 ZINC000769315688 1023119207 /nfs/dbraw/zinc/11/92/07/1023119207.db2.gz KQWRTJVWFXOBHJ-SFHVURJKSA-N 2 1 316.489 3.789 20 10 DHCDMP CCCN(CCC)c1ccc(C[N@H+]2CC[C@H](C[NH+](C)C)C2)cc1 ZINC000769405568 1023143479 /nfs/dbraw/zinc/14/34/79/1023143479.db2.gz XTTRUGHCENSYBV-LJQANCHMSA-N 2 1 317.521 3.697 20 10 DHCDMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000808691750 1026350068 /nfs/dbraw/zinc/35/00/68/1026350068.db2.gz NOMVWYGIKQZCIT-AAEUAGOBSA-N 2 1 321.852 3.846 20 10 DHCDMP CC[N@@H+](CCC1CC[NH+](Cc2ccccc2O)CC1)CC(C)C ZINC000809755132 1026616062 /nfs/dbraw/zinc/61/60/62/1026616062.db2.gz FNSABLGBYFTXTL-UHFFFAOYSA-N 2 1 318.505 3.972 20 10 DHCDMP Oc1c(C[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)ccc2ccccc21 ZINC000816515564 1028917031 /nfs/dbraw/zinc/91/70/31/1028917031.db2.gz DFHVZALSZAOYQE-KRWDZBQOSA-N 2 1 324.468 3.853 20 10 DHCDMP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3ccc4ccccc4c3O)C2)CC1 ZINC000816610874 1028959019 /nfs/dbraw/zinc/95/90/19/1028959019.db2.gz BLUWDERIGQOXSN-GOSISDBHSA-N 2 1 324.468 3.709 20 10 DHCDMP CCCN(CCC)c1ccc(C[NH+]2CCC3(CC[NH2+]3)CC2)cc1 ZINC000817865147 1029267408 /nfs/dbraw/zinc/26/74/08/1029267408.db2.gz JAHRKGWPJDHZIN-UHFFFAOYSA-N 2 1 315.505 3.641 20 10 DHCDMP Cc1ccc(O)c(C[N@@H+]2CCC[C@@H](n3ccnc3C(C)C)C2)c1 ZINC000374274605 1029268961 /nfs/dbraw/zinc/26/89/61/1029268961.db2.gz ZNVKGHDYDTVDIW-QGZVFWFLSA-N 2 1 313.445 3.858 20 10 DHCDMP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1cc(Cl)c(Cl)cc1O ZINC000817970278 1029310967 /nfs/dbraw/zinc/31/09/67/1029310967.db2.gz QHTXQZVSFWMONS-LPEHRKFASA-N 2 1 303.233 3.620 20 10 DHCDMP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000817976765 1029314276 /nfs/dbraw/zinc/31/42/76/1029314276.db2.gz SXFSRLATRDXDKI-QWRGUYRKSA-N 2 1 304.356 3.579 20 10 DHCDMP C[C@@H]([NH2+]C1CCC(C)([NH+]2CCC2)CC1)c1ccc(F)cc1O ZINC000927036592 1031045441 /nfs/dbraw/zinc/04/54/41/1031045441.db2.gz DGICBPSYFHTSAY-MJJDPTRDSA-N 2 1 306.425 3.589 20 10 DHCDMP C[C@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1cc(Cl)c(Cl)cc1O ZINC000873272977 1031784039 /nfs/dbraw/zinc/78/40/39/1031784039.db2.gz XPLWBHCGQZRXPY-UWVGGRQHSA-N 2 1 317.260 3.738 20 10 DHCDMP C[C@@H]([NH2+][C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1O ZINC000877755965 1033432327 /nfs/dbraw/zinc/43/23/27/1033432327.db2.gz UZWNTZWZAQVWAO-YQVWRLOYSA-N 2 1 324.468 3.953 20 10 DHCDMP CCCC[N@@H+](C)CC1CC[NH+](Cc2cccc(CC)c2O)CC1 ZINC001180124090 1035604048 /nfs/dbraw/zinc/60/40/48/1035604048.db2.gz FKUMRHDVVNLENO-UHFFFAOYSA-N 2 1 318.505 3.899 20 10 DHCDMP C[C@@H]1CCC[N@H+]1C1CC[NH+](Cc2c(O)ccc3ccccc32)CC1 ZINC000151633436 1016085716 /nfs/dbraw/zinc/08/57/16/1016085716.db2.gz APMWWKBVWJQILU-MRXNPFEDSA-N 2 1 324.468 3.994 20 10 DHCDMP Cc1ccc([C@H](C)[NH2+]CCCC[N@H+]2CCC[C@H](C)C2)c(O)c1 ZINC000185034354 1016524041 /nfs/dbraw/zinc/52/40/41/1016524041.db2.gz HWQSBBHHHOFEOR-IRXDYDNUSA-N 2 1 304.478 3.863 20 10 DHCDMP Cc1cc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c(C)n1-c1ccccc1 ZINC000322834605 1032240544 /nfs/dbraw/zinc/24/05/44/1032240544.db2.gz HTRYXVJNGPVRGB-VCSGRIEYSA-N 2 1 323.484 3.809 20 10 DHCDMP C[C@H]([NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000766167145 1019098185 /nfs/dbraw/zinc/09/81/85/1019098185.db2.gz SFNBUTQWFHCCRZ-LNLFQRSKSA-N 2 1 315.505 3.810 20 10 DHCDMP C[C@H]([NH2+][C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000766167145 1019098196 /nfs/dbraw/zinc/09/81/96/1019098196.db2.gz SFNBUTQWFHCCRZ-LNLFQRSKSA-N 2 1 315.505 3.810 20 10 DHCDMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccccc2O)CC[N@@H+]1Cc1ccccc1 ZINC000179573365 1020410084 /nfs/dbraw/zinc/41/00/84/1020410084.db2.gz BUTSHQBQXOJHAN-XLIONFOSSA-N 2 1 324.468 3.877 20 10 DHCDMP C[C@@H]1C[C@@H]([NH+](C)Cc2ccccc2O)CC[N@H+]1Cc1ccccc1 ZINC000179573365 1020410092 /nfs/dbraw/zinc/41/00/92/1020410092.db2.gz BUTSHQBQXOJHAN-XLIONFOSSA-N 2 1 324.468 3.877 20 10 DHCDMP C[C@@H]1C[C@@H]([N@H+](C)Cc2ccccc2O)CC[NH+]1Cc1ccccc1 ZINC000179573365 1020410097 /nfs/dbraw/zinc/41/00/97/1020410097.db2.gz BUTSHQBQXOJHAN-XLIONFOSSA-N 2 1 324.468 3.877 20 10 DHCDMP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccccc2O)CC[NH+]1Cc1ccccc1 ZINC000179573365 1020410104 /nfs/dbraw/zinc/41/01/04/1020410104.db2.gz BUTSHQBQXOJHAN-XLIONFOSSA-N 2 1 324.468 3.877 20 10 DHCDMP CC1(C)C[C@@H]([NH2+]Cc2ccccc2O)CC[N@H+]1Cc1ccccc1 ZINC001171970056 1032953325 /nfs/dbraw/zinc/95/33/25/1032953325.db2.gz XTFHNCXZMRPHSV-IBGZPJMESA-N 2 1 324.468 3.925 20 10 DHCDMP C[C@H]1C[C@@H]([NH2+]Cc2cc(-c3ccccc3)ccc2O)CC[N@@H+]1C ZINC000742375631 1021114441 /nfs/dbraw/zinc/11/44/41/1021114441.db2.gz SRFYMWWKYLFNRA-KXBFYZLASA-N 2 1 310.441 3.632 20 10 DHCDMP C[C@H]1C[C@@H]([NH2+]Cc2cc(-c3ccccc3)ccc2O)CC[N@H+]1C ZINC000742375631 1021114444 /nfs/dbraw/zinc/11/44/44/1021114444.db2.gz SRFYMWWKYLFNRA-KXBFYZLASA-N 2 1 310.441 3.632 20 10 DHCDMP CN(C)c1ccc(C[NH2+]C[C@@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)cc1 ZINC000377757672 1021851562 /nfs/dbraw/zinc/85/15/62/1021851562.db2.gz AIZJDMGEGGNQFS-PZJWPPBQSA-N 2 1 323.484 3.535 20 10 DHCDMP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1ccccc1O ZINC000272842033 1022516349 /nfs/dbraw/zinc/51/63/49/1022516349.db2.gz JVEKPVSEPHHLOL-FUHIMQAGSA-N 2 1 324.468 3.953 20 10 DHCDMP C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)c1ccccc1O ZINC000272842033 1022516359 /nfs/dbraw/zinc/51/63/59/1022516359.db2.gz JVEKPVSEPHHLOL-FUHIMQAGSA-N 2 1 324.468 3.953 20 10 DHCDMP Cc1cc(O)c(C[N@@H+](C)CC2CC[NH+](C)CC2)cc1C(C)C ZINC000103462124 1022592023 /nfs/dbraw/zinc/59/20/23/1022592023.db2.gz BBPCWGMRLCPQFC-UHFFFAOYSA-N 2 1 304.478 3.598 20 10 DHCDMP Cc1[nH+]ccn1CC[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000268835882 1024173830 /nfs/dbraw/zinc/17/38/30/1024173830.db2.gz UKXVXWUXEICFKM-MRXNPFEDSA-N 2 1 312.461 3.533 20 10 DHCDMP Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CC[N@H+]3CCC[C@@H]3C2)c1O ZINC000808678622 1026355645 /nfs/dbraw/zinc/35/56/45/1026355645.db2.gz TWLDZNIPLNJMJJ-NWANDNLSSA-N 2 1 308.853 3.631 20 10 DHCDMP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cc(F)ccc1O ZINC000809740122 1026611560 /nfs/dbraw/zinc/61/15/60/1026611560.db2.gz ZYEVFJGRXQZYEM-UHFFFAOYSA-N 2 1 316.420 3.615 20 10 DHCDMP C[C@H]([NH2+][C@H]1CCc2cccc(O)c21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000296294407 1027600747 /nfs/dbraw/zinc/60/07/47/1027600747.db2.gz DFHSPMDFIXJIHW-ZVZYQTTQSA-N 2 1 314.473 3.622 20 10 DHCDMP CC[C@H]([NH2+]CCCCC[NH+]1CCCC1)c1ccc(F)cc1O ZINC000815647648 1028591382 /nfs/dbraw/zinc/59/13/82/1028591382.db2.gz QPNFQOKXDIHSDB-KRWDZBQOSA-N 2 1 308.441 3.838 20 10 DHCDMP C[C@@H]1CCCC[N@H+]1CCC[NH2+]Cc1ccc2ccccc2c1O ZINC000816529931 1028923072 /nfs/dbraw/zinc/92/30/72/1028923072.db2.gz MPPNUVAPCMCGBU-MRXNPFEDSA-N 2 1 312.457 3.900 20 10 DHCDMP C[C@H]([NH2+]C1CCC([NH3+])CC1)c1cc(Cl)c(Cl)cc1O ZINC000817946669 1029288729 /nfs/dbraw/zinc/28/87/29/1029288729.db2.gz CVRIVSONRDBZHK-IDKOKCKLSA-N 2 1 303.233 3.620 20 10 DHCDMP C[C@@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O)[C@@H]1CCC[NH2+]C1 ZINC000817948382 1029289971 /nfs/dbraw/zinc/28/99/71/1029289971.db2.gz ZDQKPSIZNFFYRF-OUAUKWLOSA-N 2 1 317.260 3.738 20 10 DHCDMP CC[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1ccc(F)cc1O ZINC000817962151 1029300551 /nfs/dbraw/zinc/30/05/51/1029300551.db2.gz GMNHXLOFOOBYAY-YVEFUNNKSA-N 2 1 302.393 3.792 20 10 DHCDMP CC(C)C[C@H](C[NH3+])[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000817960484 1029302637 /nfs/dbraw/zinc/30/26/37/1029302637.db2.gz ZQMUFGBUBNACAH-FUHWJXTLSA-N 2 1 303.494 3.701 20 10 DHCDMP C[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cccc(C(F)(F)F)c1O ZINC000817979443 1029316905 /nfs/dbraw/zinc/31/69/05/1029316905.db2.gz BCYXTKZRRCYAGM-NEPJUHHUSA-N 2 1 316.367 3.594 20 10 DHCDMP COc1ccc(O)c([C@H](C)[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)c1 ZINC000185033924 1034522437 /nfs/dbraw/zinc/52/24/37/1034522437.db2.gz NLQBRNBLFRSYDY-HOTGVXAUSA-N 2 1 320.477 3.706 20 10 DHCDMP CCC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc3ccccc3c2O)C1 ZINC000185112413 1034527782 /nfs/dbraw/zinc/52/77/82/1034527782.db2.gz LOOQDGHEZIVXNN-JKSUJKDBSA-N 2 1 312.457 3.928 20 10 DHCDMP CCC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc3ccccc3c2O)C1 ZINC000185112429 1034530279 /nfs/dbraw/zinc/53/02/79/1034530279.db2.gz LOOQDGHEZIVXNN-HOTGVXAUSA-N 2 1 312.457 3.928 20 10 DHCDMP CC(C)(C)c1cccc(C[N@H+]2CCC[C@](C)(C[NH3+])CC2)c1O ZINC001206311555 1035401129 /nfs/dbraw/zinc/40/11/29/1035401129.db2.gz QPWUVFUPMHPCCV-IBGZPJMESA-N 2 1 304.478 3.641 20 10 DHCDMP C[C@H]([NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1O ZINC000195134676 1035415013 /nfs/dbraw/zinc/41/50/13/1035415013.db2.gz XPGHJKOOTMZXDK-FUHWJXTLSA-N 2 1 310.441 3.565 20 10 DHCDMP Cc1cc(C[NH+]2CCC([NH+]3CCCCC3)CC2)ccc1N(C)C ZINC000815018194 1035498872 /nfs/dbraw/zinc/49/88/72/1035498872.db2.gz IYERKWLEQLNFMP-UHFFFAOYSA-N 2 1 315.505 3.511 20 10 DHCDMP Cc1cccc(C[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)c1O ZINC000775678730 1036409822 /nfs/dbraw/zinc/40/98/22/1036409822.db2.gz JCMDBENDIZPCST-SFHVURJKSA-N 2 1 316.489 3.789 20 10 DHCDMP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1)c1ccccc1O ZINC000156813115 1038324991 /nfs/dbraw/zinc/32/49/91/1038324991.db2.gz NNCVJCOKGXDMHW-AEFFLSMTSA-N 2 1 304.478 3.801 20 10 DHCDMP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000173489697 1040308875 /nfs/dbraw/zinc/30/88/75/1040308875.db2.gz ICGHEBOFQPNRSB-INIZCTEOSA-N 2 1 318.505 3.772 20 10 DHCDMP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000173489697 1040308881 /nfs/dbraw/zinc/30/88/81/1040308881.db2.gz ICGHEBOFQPNRSB-INIZCTEOSA-N 2 1 318.505 3.772 20 10 DHCDMP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000173489697 1040308894 /nfs/dbraw/zinc/30/88/94/1040308894.db2.gz ICGHEBOFQPNRSB-INIZCTEOSA-N 2 1 318.505 3.772 20 10 DHCDMP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000273563043 130137440 /nfs/dbraw/zinc/13/74/40/130137440.db2.gz ISEUGNVRSCYXPA-SWLSCSKDSA-N 2 1 301.434 3.501 20 10 DHCDMP CC(C)[N@@H+](C)Cc1cccc(C[NH2+]Cc2cc(F)ccc2O)c1 ZINC000180526558 519629883 /nfs/dbraw/zinc/62/98/83/519629883.db2.gz UHXASRABEJBGGC-UHFFFAOYSA-N 2 1 316.420 3.661 20 10 DHCDMP CC[C@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1ccc(C)cc1O ZINC000280286015 535894385 /nfs/dbraw/zinc/89/43/85/535894385.db2.gz YVRWNVXCBULHCK-SFHVURJKSA-N 2 1 302.462 3.758 20 10 DHCDMP C[NH+](C)Cc1cccc(C[NH2+]Cc2cc(Cl)c(F)cc2O)c1 ZINC000293719584 536033408 /nfs/dbraw/zinc/03/34/08/536033408.db2.gz VKHCVHOMZDHKBT-UHFFFAOYSA-N 2 1 322.811 3.536 20 10 DHCDMP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000158087643 1016324815 /nfs/dbraw/zinc/32/48/15/1016324815.db2.gz KRVCDDOOMYTJJU-QZTJIDSGSA-N 2 1 315.505 3.669 20 10 DHCDMP CC(C)C[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)C1 ZINC000773074821 1032548562 /nfs/dbraw/zinc/54/85/62/1032548562.db2.gz HZEDNPLVTICRFU-ZWKOTPCHSA-N 2 1 317.521 3.771 20 10 DHCDMP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1c(O)cccc1Cl ZINC000113322553 1018389007 /nfs/dbraw/zinc/38/90/07/1018389007.db2.gz LVHIVVHEQAVLCH-CQSZACIVSA-N 2 1 310.869 3.790 20 10 DHCDMP CN(C)c1ccc(C[NH2+]CCC[N@H+](C)C2CCCCC2)cc1F ZINC000733322617 1020370219 /nfs/dbraw/zinc/37/02/19/1020370219.db2.gz QIXBQVMOPVKBRX-UHFFFAOYSA-N 2 1 321.484 3.636 20 10 DHCDMP CN(C)c1ccc(C[NH2+]CCC[N@@H+](C)C2CCCCC2)cc1F ZINC000733322617 1020370226 /nfs/dbraw/zinc/37/02/26/1020370226.db2.gz QIXBQVMOPVKBRX-UHFFFAOYSA-N 2 1 321.484 3.636 20 10 DHCDMP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000743388935 1021278234 /nfs/dbraw/zinc/27/82/34/1021278234.db2.gz WRHIWYHNEGUZKT-KRWDZBQOSA-N 2 1 318.505 3.988 20 10 DHCDMP C[C@H]1C[N@H+](Cc2c(O)ccc(Cl)c2Cl)CCC[C@H]1C[NH3+] ZINC001206022786 1022564998 /nfs/dbraw/zinc/56/49/98/1022564998.db2.gz CTEDRHYTSAZBIT-QWRGUYRKSA-N 2 1 317.260 3.506 20 10 DHCDMP C[C@H]1C[N@@H+](Cc2c(O)ccc(Cl)c2Cl)CCC[C@H]1C[NH3+] ZINC001206022786 1022565005 /nfs/dbraw/zinc/56/50/05/1022565005.db2.gz CTEDRHYTSAZBIT-QWRGUYRKSA-N 2 1 317.260 3.506 20 10 DHCDMP Cc1cc(C)c([C@H](C)[NH2+]C2CC([NH+]3CCCCC3)C2)c(O)c1 ZINC000788804508 1023936695 /nfs/dbraw/zinc/93/66/95/1023936695.db2.gz ILXGPZQWJOZIGV-GTPINHCMSA-N 2 1 302.462 3.677 20 10 DHCDMP C[C@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc2ccccc2c1O ZINC000193508394 1024161328 /nfs/dbraw/zinc/16/13/28/1024161328.db2.gz ZWZUKRKGZRJANU-LSDHHAIUSA-N 2 1 310.441 3.680 20 10 DHCDMP C[C@@H]([NH2+]C[C@H]1CC[N@H+](C2CC2)C1)c1ccc2ccccc2c1O ZINC000193508404 1024162250 /nfs/dbraw/zinc/16/22/50/1024162250.db2.gz ZWZUKRKGZRJANU-HUUCEWRRSA-N 2 1 310.441 3.680 20 10 DHCDMP Cc1cc(C)c(O)c(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)c1 ZINC000754732846 1024356164 /nfs/dbraw/zinc/35/61/64/1024356164.db2.gz VSVULWKAVOKTLN-UHFFFAOYSA-N 2 1 304.478 3.561 20 10 DHCDMP C[C@@H]1C[C@H]([NH+](C)Cc2ccc(N3CCCCC3)cc2)CC[N@@H+]1C ZINC000093643817 1026120497 /nfs/dbraw/zinc/12/04/97/1026120497.db2.gz GCEYNGOCJYGTGA-YLJYHZDGSA-N 2 1 315.505 3.591 20 10 DHCDMP C[C@@H]1C[C@H]([NH+](C)Cc2ccc(N3CCCCC3)cc2)CC[N@H+]1C ZINC000093643817 1026120502 /nfs/dbraw/zinc/12/05/02/1026120502.db2.gz GCEYNGOCJYGTGA-YLJYHZDGSA-N 2 1 315.505 3.591 20 10 DHCDMP C[C@@H]1C[C@H]([N@H+](C)Cc2ccc(N3CCCCC3)cc2)CC[NH+]1C ZINC000093643817 1026120511 /nfs/dbraw/zinc/12/05/11/1026120511.db2.gz GCEYNGOCJYGTGA-YLJYHZDGSA-N 2 1 315.505 3.591 20 10 DHCDMP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(N3CCCCC3)cc2)CC[NH+]1C ZINC000093643817 1026120518 /nfs/dbraw/zinc/12/05/18/1026120518.db2.gz GCEYNGOCJYGTGA-YLJYHZDGSA-N 2 1 315.505 3.591 20 10 DHCDMP CC[C@@H]([NH2+]CCCCn1cc[nH+]c1C)c1ccc(C)cc1O ZINC000280040615 1026577389 /nfs/dbraw/zinc/57/73/89/1026577389.db2.gz IWFGIFOFLYCAPK-QGZVFWFLSA-N 2 1 301.434 3.727 20 10 DHCDMP CCN(C)c1ccc([C@H](C)[NH2+]C2CC([NH+]3CCCCC3)C2)cc1 ZINC000373519757 1029069496 /nfs/dbraw/zinc/06/94/96/1029069496.db2.gz GNKMENCQAQBXOC-VQSBYGRUSA-N 2 1 315.505 3.810 20 10 DHCDMP Cc1ccc([C@@H](C)[NH2+]C2CC([NH+]3CCCCC3)C2)c(O)c1C ZINC000373521059 1029071862 /nfs/dbraw/zinc/07/18/62/1029071862.db2.gz JPTQWMQFGDSMOH-KLAILNCOSA-N 2 1 302.462 3.677 20 10 DHCDMP C[C@H]([NH2+][C@H]1CCCC[C@@H]1C[NH3+])c1cccc(C(F)(F)F)c1O ZINC000817960634 1029301196 /nfs/dbraw/zinc/30/11/96/1029301196.db2.gz OLSAWBJGEGWEMR-WDMOLILDSA-N 2 1 316.367 3.579 20 10 DHCDMP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000817976606 1029314405 /nfs/dbraw/zinc/31/44/05/1029314405.db2.gz OXHIVBKIGNDJPN-ZJUUUORDSA-N 2 1 305.249 3.867 20 10 DHCDMP C[C@@H]([NH2+][C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1O ZINC000877755964 1033431123 /nfs/dbraw/zinc/43/11/23/1033431123.db2.gz UZWNTZWZAQVWAO-SCTDSRPQSA-N 2 1 324.468 3.953 20 10 DHCDMP Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c1O ZINC000775720243 1036546288 /nfs/dbraw/zinc/54/62/88/1036546288.db2.gz JPURWHKIGBBOII-HNNXBMFYSA-N 2 1 322.880 3.662 20 10 DHCDMP Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c1O ZINC000775720243 1036546294 /nfs/dbraw/zinc/54/62/94/1036546294.db2.gz JPURWHKIGBBOII-HNNXBMFYSA-N 2 1 322.880 3.662 20 10 DHCDMP CC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1)c1ccccc1O ZINC000156812971 1038325214 /nfs/dbraw/zinc/32/52/14/1038325214.db2.gz NNCVJCOKGXDMHW-FUHWJXTLSA-N 2 1 304.478 3.801 20 10 DHCDMP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000293708842 131761476 /nfs/dbraw/zinc/76/14/76/131761476.db2.gz LVNCOFJNXFUGAE-HIFRSBDPSA-N 2 1 301.434 3.501 20 10 DHCDMP C[C@H]([NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc2c(cc1O)CCCC2 ZINC000363845186 525569487 /nfs/dbraw/zinc/56/94/87/525569487.db2.gz AQLHAUFAKJRSPL-BMGDILEWSA-N 2 1 314.473 3.548 20 10 DHCDMP