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](c1ccc(F)cc1F)C(C)(C)C)c1nccs1 ZINC000091736529 193098804 /nfs/dbraw/zinc/09/88/04/193098804.db2.gz OVFAPKCHWPZORE-QMTHXVAHSA-N 1 2 310.413 4.859 20 0 DJADLO C[C@@H](Nc1ccc([NH+](C)C)cc1)c1ccccc1Br ZINC000036335416 182816348 /nfs/dbraw/zinc/81/63/48/182816348.db2.gz JJGCMYHZVIXSNF-GFCCVEGCSA-N 1 2 319.246 4.688 20 0 DJADLO Cc1ccc(C(=O)Nc2ccc3[nH]c(C4CCC4)[nH+]c3c2)cc1F ZINC000060331855 184146108 /nfs/dbraw/zinc/14/61/08/184146108.db2.gz HDYJDNQBGVBFDL-UHFFFAOYSA-N 1 2 323.371 4.530 20 0 DJADLO C[C@@H]([NH2+]C1(c2ccc(Cl)c(Cl)c2)CC1)c1cscn1 ZINC000272009567 129990377 /nfs/dbraw/zinc/99/03/77/129990377.db2.gz VWAIVGOSZYIEKA-SECBINFHSA-N 1 2 313.253 4.790 20 0 DJADLO C[C@@H](Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1)c1cscn1 ZINC000272493925 130036182 /nfs/dbraw/zinc/03/61/82/130036182.db2.gz SPROGIMUWLZDDD-CYBMUJFWSA-N 1 2 324.453 4.516 20 0 DJADLO CC(C)[C@@H]([NH2+]Cc1ncc(C2CC2)o1)c1ccc(Cl)cc1F ZINC000272829971 130067433 /nfs/dbraw/zinc/06/74/33/130067433.db2.gz GRLDFEJWOVUQBV-QGZVFWFLSA-N 1 2 322.811 4.831 20 0 DJADLO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(-c3ccccc3)o2)s1 ZINC000274288452 130223022 /nfs/dbraw/zinc/22/30/22/130223022.db2.gz ZUFHGFFDQGGDQR-VXGBXAGGSA-N 1 2 313.426 4.518 20 0 DJADLO Cc1csc(C2([NH2+][C@H](C)c3csc(C(C)C)n3)CCC2)n1 ZINC000274470835 130237132 /nfs/dbraw/zinc/23/71/32/130237132.db2.gz PPCLQOLGCNVADM-GFCCVEGCSA-N 1 2 321.515 4.761 20 0 DJADLO Cc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2csc(C3CC3)n2)o1 ZINC000340194198 131121225 /nfs/dbraw/zinc/12/12/25/131121225.db2.gz GKFJEXQPBITTOA-BLLLJJGKSA-N 1 2 316.470 4.895 20 0 DJADLO Cc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2csc(C3CC3)n2)o1 ZINC000340194198 131121226 /nfs/dbraw/zinc/12/12/26/131121226.db2.gz GKFJEXQPBITTOA-BLLLJJGKSA-N 1 2 316.470 4.895 20 0 DJADLO Cc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2csc(C3CC3)n2)o1 ZINC000340194199 131121387 /nfs/dbraw/zinc/12/13/87/131121387.db2.gz GKFJEXQPBITTOA-LRDDRELGSA-N 1 2 316.470 4.895 20 0 DJADLO Cc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2csc(C3CC3)n2)o1 ZINC000340194199 131121390 /nfs/dbraw/zinc/12/13/90/131121390.db2.gz GKFJEXQPBITTOA-LRDDRELGSA-N 1 2 316.470 4.895 20 0 DJADLO CCCC[C@@H](CC)CC(=O)N1CCCC[C@@H]1c1[nH+]ccn1CC ZINC000366646707 131266810 /nfs/dbraw/zinc/26/68/10/131266810.db2.gz HTMLJJOISLMBND-IAGOWNOFSA-N 1 2 319.493 4.563 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N(Cc1ccccc1)CC1CCC1 ZINC000287468572 131282426 /nfs/dbraw/zinc/28/24/26/131282426.db2.gz JHFBIFIIUKLZOO-UHFFFAOYSA-N 1 2 323.440 4.533 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCCCC[C@H]1c1ccccc1 ZINC000287478106 131282913 /nfs/dbraw/zinc/28/29/13/131282913.db2.gz JZOKGGYFIXPULY-SFHVURJKSA-N 1 2 323.440 4.848 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)[C@H](C)c1cccc(Cl)c1 ZINC000287637409 131292358 /nfs/dbraw/zinc/29/23/58/131292358.db2.gz VKWTZSCYWMBXQJ-CYBMUJFWSA-N 1 2 317.820 4.577 20 0 DJADLO Cc1ccc([C@H]2CCCCN2C(=O)Nc2c(C)cc[nH+]c2C)cc1 ZINC000287689906 131295583 /nfs/dbraw/zinc/29/55/83/131295583.db2.gz YVROPPIPDKIEFJ-GOSISDBHSA-N 1 2 323.440 4.766 20 0 DJADLO Cc1nc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)c3ccccc32)no1 ZINC000289307878 131372461 /nfs/dbraw/zinc/37/24/61/131372461.db2.gz CIVFVPYBPFUNRQ-WDEREUQCSA-N 1 2 315.804 4.596 20 0 DJADLO CC(C)Oc1cccc([C@@H](C)[NH2+]Cc2cc(C(C)(C)C)on2)c1 ZINC000289412287 131384335 /nfs/dbraw/zinc/38/43/35/131384335.db2.gz VAQKUUPJQIVYTM-CQSZACIVSA-N 1 2 316.445 4.610 20 0 DJADLO CSc1ccccc1[C@H](C)[NH2+]Cc1cc(C(C)(C)C)on1 ZINC000289440776 131386432 /nfs/dbraw/zinc/38/64/32/131386432.db2.gz TXEVVROSTBNONA-LBPRGKRZSA-N 1 2 304.459 4.545 20 0 DJADLO Cc1cnc(C[NH2+][C@H](c2c(Cl)cccc2Cl)C2CC2)o1 ZINC000289597372 131399607 /nfs/dbraw/zinc/39/96/07/131399607.db2.gz DDQZMWVCOJXOCL-HNNXBMFYSA-N 1 2 311.212 4.531 20 0 DJADLO CCn1ccnc1[C@@H](C)[NH2+][C@@H](c1ccc(F)cc1F)C(C)(C)C ZINC000297588796 132024206 /nfs/dbraw/zinc/02/42/06/132024206.db2.gz HMVIIJOUDGJXCB-WBMJQRKESA-N 1 2 321.415 4.619 20 0 DJADLO Cc1nc(C[N@@H+](C)[C@@H](C)c2cccc(C(F)(F)F)c2)oc1C ZINC000299410959 132104093 /nfs/dbraw/zinc/10/40/93/132104093.db2.gz ZUIPFOCRIKRYQC-NSHDSACASA-N 1 2 312.335 4.503 20 0 DJADLO Cc1nc(C[N@H+](C)[C@@H](C)c2cccc(C(F)(F)F)c2)oc1C ZINC000299410959 132104095 /nfs/dbraw/zinc/10/40/95/132104095.db2.gz ZUIPFOCRIKRYQC-NSHDSACASA-N 1 2 312.335 4.503 20 0 DJADLO Cc1cnc(C[N@@H+](Cc2ccccc2)[C@@H](C)c2cccs2)nc1 ZINC000340683478 132148073 /nfs/dbraw/zinc/14/80/73/132148073.db2.gz LCXLNQUZTZHLLO-INIZCTEOSA-N 1 2 323.465 4.610 20 0 DJADLO Cc1cnc(C[N@H+](Cc2ccccc2)[C@@H](C)c2cccs2)nc1 ZINC000340683478 132148075 /nfs/dbraw/zinc/14/80/75/132148075.db2.gz LCXLNQUZTZHLLO-INIZCTEOSA-N 1 2 323.465 4.610 20 0 DJADLO Cc1cc2cc([C@@H](C)[NH2+][C@@H](C)c3cscn3)oc2cc1C ZINC000570739485 332809550 /nfs/dbraw/zinc/80/95/50/332809550.db2.gz BJGUTKPMVOCYJU-QWHCGFSZSA-N 1 2 300.427 4.918 20 0 DJADLO Cc1ccc(C)c([C@@H]([NH2+]Cc2ncccc2F)c2ccccc2)c1 ZINC000530530892 331574823 /nfs/dbraw/zinc/57/48/23/331574823.db2.gz RFTPTMIKPYFJLS-NRFANRHFSA-N 1 2 320.411 4.717 20 0 DJADLO Cc1cc(C)c([C@@H](C)[NH2+][C@H](C)c2nc(C(C)(C)C)no2)c(C)c1 ZINC000565649752 331759674 /nfs/dbraw/zinc/75/96/74/331759674.db2.gz WDIOIBPIDOHRFW-HUUCEWRRSA-N 1 2 315.461 4.704 20 0 DJADLO Cc1cc([C@H](C)[NH2+][C@H](c2ccccc2)c2cccc(F)c2)no1 ZINC000558499422 331913581 /nfs/dbraw/zinc/91/35/81/331913581.db2.gz YWXKFUBRDPCYQJ-IFXJQAMLSA-N 1 2 310.372 4.562 20 0 DJADLO Cc1ccc(CNc2cc(C)c(Br)cc2F)c(C)[nH+]1 ZINC000569388589 332073427 /nfs/dbraw/zinc/07/34/27/332073427.db2.gz XMJQGHJYIJQNHU-UHFFFAOYSA-N 1 2 323.209 4.521 20 0 DJADLO CC(C)n1nccc1C[N@H+]([C@H](C)c1ccccc1Cl)C1CC1 ZINC000410347272 332114722 /nfs/dbraw/zinc/11/47/22/332114722.db2.gz AFEOQWWYBCLUDB-CQSZACIVSA-N 1 2 317.864 4.843 20 0 DJADLO CC(C)n1nccc1C[N@@H+]([C@H](C)c1ccccc1Cl)C1CC1 ZINC000410347272 332114724 /nfs/dbraw/zinc/11/47/24/332114724.db2.gz AFEOQWWYBCLUDB-CQSZACIVSA-N 1 2 317.864 4.843 20 0 DJADLO C[C@@H](c1nc2ccccc2o1)[N@H+](C)Cc1nc2ccccc2s1 ZINC000180949915 332169241 /nfs/dbraw/zinc/16/92/41/332169241.db2.gz PFRMTIQYVRXIPT-LBPRGKRZSA-N 1 2 323.421 4.631 20 0 DJADLO C[C@@H](c1nc2ccccc2o1)[N@@H+](C)Cc1nc2ccccc2s1 ZINC000180949915 332169244 /nfs/dbraw/zinc/16/92/44/332169244.db2.gz PFRMTIQYVRXIPT-LBPRGKRZSA-N 1 2 323.421 4.631 20 0 DJADLO CCC(C)(C)c1ccc(NC2CC[NH+](CC(F)F)CC2)cc1 ZINC000448020535 332178985 /nfs/dbraw/zinc/17/89/85/332178985.db2.gz CMQNTJPKEQOSJO-UHFFFAOYSA-N 1 2 310.432 4.516 20 0 DJADLO CC(C)(CC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1)C1CC1 ZINC000559755080 332279232 /nfs/dbraw/zinc/27/92/32/332279232.db2.gz CQDABYJTNJATAQ-UHFFFAOYSA-N 1 2 310.397 4.639 20 0 DJADLO C[C@H]([NH2+]Cc1cc(-c2cccs2)on1)c1ccccc1Cl ZINC000096980627 332299060 /nfs/dbraw/zinc/29/90/60/332299060.db2.gz IOHAOMKZTPKODH-NSHDSACASA-N 1 2 318.829 4.907 20 0 DJADLO C[C@@H](Nc1ccc(CCCc2ccccc2)cc1)c1[nH]cc[nH+]1 ZINC000560548987 332357203 /nfs/dbraw/zinc/35/72/03/332357203.db2.gz LPVSKKPRZQIKOF-MRXNPFEDSA-N 1 2 305.425 4.758 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)CSc1ccc(C(C)C)cc1 ZINC000425590160 335108361 /nfs/dbraw/zinc/10/83/61/335108361.db2.gz VVIHMLLDIRVMOV-UHFFFAOYSA-N 1 2 314.454 4.553 20 0 DJADLO Clc1cccc(C[N@@H+]2CCC[C@@H]2c2cccnc2)c1Cl ZINC000583423061 332398738 /nfs/dbraw/zinc/39/87/38/332398738.db2.gz IGTDOARODOMPQE-OAHLLOKOSA-N 1 2 307.224 4.726 20 0 DJADLO Clc1cccc(C[N@H+]2CCC[C@@H]2c2cccnc2)c1Cl ZINC000583423061 332398740 /nfs/dbraw/zinc/39/87/40/332398740.db2.gz IGTDOARODOMPQE-OAHLLOKOSA-N 1 2 307.224 4.726 20 0 DJADLO Cc1cc[nH+]c(NC[C@H]2CCCO[C@@H]2c2ccccc2)c1Cl ZINC000561156793 332417711 /nfs/dbraw/zinc/41/77/11/332417711.db2.gz DFJXZQDAZXZTIP-NVXWUHKLSA-N 1 2 316.832 4.623 20 0 DJADLO COCC[C@@H](Nc1cc[nH+]c2c(Cl)cccc12)c1ccco1 ZINC000561291535 332434662 /nfs/dbraw/zinc/43/46/62/332434662.db2.gz QCIGSDPAGISSAN-OAHLLOKOSA-N 1 2 316.788 4.671 20 0 DJADLO COc1ccccc1-c1ccc([C@H](C)Nc2cccc[nH+]2)cc1 ZINC000561764837 332493099 /nfs/dbraw/zinc/49/30/99/332493099.db2.gz PLAIJZAYDQHRQY-HNNXBMFYSA-N 1 2 304.393 4.930 20 0 DJADLO CC[C@@H]([NH2+][C@H](C)c1cc(Cl)ccc1Cl)c1ccn(C)n1 ZINC000427886768 332556019 /nfs/dbraw/zinc/55/60/19/332556019.db2.gz QOJDCNJKDLGMPN-QMTHXVAHSA-N 1 2 312.244 4.529 20 0 DJADLO Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+][C@@H](C)c1cscn1 ZINC000570058395 332707060 /nfs/dbraw/zinc/70/70/60/332707060.db2.gz SUNFCSCRDYQWFY-VHSXEESVSA-N 1 2 309.504 4.617 20 0 DJADLO CC(C)c1ccoc1C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000580222213 333023001 /nfs/dbraw/zinc/02/30/01/333023001.db2.gz HTQZTJCKGBXLLC-UHFFFAOYSA-N 1 2 322.364 4.843 20 0 DJADLO Cc1nc([C@H](C)[NH2+][C@H](C)c2cc3cccc(F)c3o2)cs1 ZINC000462821571 333119463 /nfs/dbraw/zinc/11/94/63/333119463.db2.gz ZTRXVRPRGXALCV-VHSXEESVSA-N 1 2 304.390 4.749 20 0 DJADLO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2c(F)cccc2F)c(F)c1 ZINC000314530156 333138244 /nfs/dbraw/zinc/13/82/44/333138244.db2.gz HBBBGHSDJQEQRM-MNOVXSKESA-N 1 2 309.331 4.524 20 0 DJADLO CC(C)n1ccc(C[NH2+][C@@H](C)c2cccc(Cl)c2Cl)n1 ZINC000178509111 333139999 /nfs/dbraw/zinc/13/99/99/333139999.db2.gz PQNFWUUSSZZDCS-NSHDSACASA-N 1 2 312.244 4.622 20 0 DJADLO CC[C@H]([NH2+][C@H](C)c1nc2c(s1)CCC2)c1cc(F)ccc1F ZINC000502057912 333284440 /nfs/dbraw/zinc/28/44/40/333284440.db2.gz NRRRJVWQQLIWID-YGRLFVJLSA-N 1 2 322.424 4.712 20 0 DJADLO CC(C)c1nc(C[N@@H+]2CC[C@@H](C)C[C@H]2c2ccco2)cs1 ZINC000525781995 333307351 /nfs/dbraw/zinc/30/73/51/333307351.db2.gz NMJDKSFIVMOVHK-HIFRSBDPSA-N 1 2 304.459 4.833 20 0 DJADLO CC(C)c1nc(C[N@H+]2CC[C@@H](C)C[C@H]2c2ccco2)cs1 ZINC000525781995 333307353 /nfs/dbraw/zinc/30/73/53/333307353.db2.gz NMJDKSFIVMOVHK-HIFRSBDPSA-N 1 2 304.459 4.833 20 0 DJADLO CCCCc1nc(C[N@H+](CC)Cc2cccc(F)c2)cs1 ZINC000497966273 333315282 /nfs/dbraw/zinc/31/52/82/333315282.db2.gz FCZYOYLJAOTVEP-UHFFFAOYSA-N 1 2 306.450 4.647 20 0 DJADLO CCCCc1nc(C[N@@H+](CC)Cc2cccc(F)c2)cs1 ZINC000497966273 333315283 /nfs/dbraw/zinc/31/52/83/333315283.db2.gz FCZYOYLJAOTVEP-UHFFFAOYSA-N 1 2 306.450 4.647 20 0 DJADLO Cc1ccc2[nH+]c(CNc3ccc4c5c(cccc53)CC4)cn2c1 ZINC000531231151 333336578 /nfs/dbraw/zinc/33/65/78/333336578.db2.gz LDBVULVMTFNABK-UHFFFAOYSA-N 1 2 313.404 4.507 20 0 DJADLO C[C@@H]1c2ccccc2CC[N@H+]1Cc1coc(-c2cccs2)n1 ZINC000531378414 333347649 /nfs/dbraw/zinc/34/76/49/333347649.db2.gz IWTBODXBCZVZSA-CYBMUJFWSA-N 1 2 310.422 4.522 20 0 DJADLO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1coc(-c2cccs2)n1 ZINC000531378414 333347650 /nfs/dbraw/zinc/34/76/50/333347650.db2.gz IWTBODXBCZVZSA-CYBMUJFWSA-N 1 2 310.422 4.522 20 0 DJADLO CCOc1ccc(C(C)=O)cc1C[N@H+](C)[C@H](C)c1cccs1 ZINC000185400616 333369969 /nfs/dbraw/zinc/36/99/69/333369969.db2.gz NSIAEPMPKGUOSF-CYBMUJFWSA-N 1 2 317.454 4.542 20 0 DJADLO CCOc1ccc(C(C)=O)cc1C[N@@H+](C)[C@H](C)c1cccs1 ZINC000185400616 333369970 /nfs/dbraw/zinc/36/99/70/333369970.db2.gz NSIAEPMPKGUOSF-CYBMUJFWSA-N 1 2 317.454 4.542 20 0 DJADLO C[C@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1ccc(F)c(F)c1 ZINC000319684749 333396901 /nfs/dbraw/zinc/39/69/01/333396901.db2.gz KBKPGGOPIXXSDV-ZDUSSCGKSA-N 1 2 317.383 4.523 20 0 DJADLO CCc1nc(C[NH+]2CCC(=Cc3ccccc3F)CC2)cs1 ZINC000531548546 333533338 /nfs/dbraw/zinc/53/33/38/333533338.db2.gz ICMVQLMQMJDYJY-UHFFFAOYSA-N 1 2 316.445 4.524 20 0 DJADLO CCC[C@@H]([NH2+]Cc1cc(C(C)(C)C)on1)c1ccc(F)cc1F ZINC000563314088 333589829 /nfs/dbraw/zinc/58/98/29/333589829.db2.gz SMNAAYASANYXJM-MRXNPFEDSA-N 1 2 322.399 4.881 20 0 DJADLO CC[C@@H]([NH2+][C@@H](C)c1csc(C(C)C)n1)c1c(C)noc1C ZINC000186434623 335158139 /nfs/dbraw/zinc/15/81/39/335158139.db2.gz AISXFCOYUBJDNF-GXFFZTMASA-N 1 2 307.463 4.673 20 0 DJADLO CC(C)c1nc([C@@H](C)[NH2+]Cc2cnccc2C(C)(C)C)cs1 ZINC000414239752 333918429 /nfs/dbraw/zinc/91/84/29/333918429.db2.gz YYBJFHAHZWGPHP-CYBMUJFWSA-N 1 2 317.502 4.810 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1nccs1)c1csc(-c2ccccc2)n1 ZINC000414228244 333926094 /nfs/dbraw/zinc/92/60/94/333926094.db2.gz XSHLSMKJVCACFI-NEPJUHHUSA-N 1 2 315.467 4.678 20 0 DJADLO C[C@@H](Nc1cccc([NH+]2CCCCCC2)c1)c1cscn1 ZINC000272272055 334032674 /nfs/dbraw/zinc/03/26/74/334032674.db2.gz OYEGWGJXNKIRCV-CQSZACIVSA-N 1 2 301.459 4.697 20 0 DJADLO C[C@H]1CC[N@H+](Cc2nc(C3CC3)cs2)[C@@H](c2ccco2)C1 ZINC000343597785 335175723 /nfs/dbraw/zinc/17/57/23/335175723.db2.gz DEAOLWOMTXHEGW-SWLSCSKDSA-N 1 2 302.443 4.587 20 0 DJADLO C[C@H]1CC[N@@H+](Cc2nc(C3CC3)cs2)[C@@H](c2ccco2)C1 ZINC000343597785 335175724 /nfs/dbraw/zinc/17/57/24/335175724.db2.gz DEAOLWOMTXHEGW-SWLSCSKDSA-N 1 2 302.443 4.587 20 0 DJADLO CC(F)(F)c1cccc(NCc2cn3cc(Cl)ccc3[nH+]2)c1 ZINC000187585048 334265754 /nfs/dbraw/zinc/26/57/54/334265754.db2.gz HHQLAPVWJBHRPW-UHFFFAOYSA-N 1 2 321.758 4.712 20 0 DJADLO C[C@@H](c1cccc(Cl)c1)[N@@H+]1CCO[C@H](c2ccccc2F)C1 ZINC000303225072 334304958 /nfs/dbraw/zinc/30/49/58/334304958.db2.gz WGUPQZOKMFAFKA-UGSOOPFHSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@@H](c1cccc(Cl)c1)[N@H+]1CCO[C@H](c2ccccc2F)C1 ZINC000303225072 334304960 /nfs/dbraw/zinc/30/49/60/334304960.db2.gz WGUPQZOKMFAFKA-UGSOOPFHSA-N 1 2 319.807 4.614 20 0 DJADLO CC(C)(C)c1nc(C[NH2+]Cc2ccc(F)c(Cl)c2)cs1 ZINC000101600588 334334846 /nfs/dbraw/zinc/33/48/46/334334846.db2.gz ZXOZXCWUHYDQGI-UHFFFAOYSA-N 1 2 312.841 4.523 20 0 DJADLO C[C@@H]1CCC[C@@H](C(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)C1 ZINC000303897155 334339836 /nfs/dbraw/zinc/33/98/36/334339836.db2.gz PNTRKGRPIRNJOG-HUUCEWRRSA-N 1 2 310.397 4.639 20 0 DJADLO C[C@H]1CCC[C@@H](C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000303938010 334346582 /nfs/dbraw/zinc/34/65/82/334346582.db2.gz WTZNPVMZZBGQPY-LSDHHAIUSA-N 1 2 310.397 4.639 20 0 DJADLO CC[C@](C)([NH2+]Cc1c(Cl)oc2ccccc21)c1nccs1 ZINC000534899763 334347777 /nfs/dbraw/zinc/34/77/77/334347777.db2.gz DFBMOLDJAWZHCB-INIZCTEOSA-N 1 2 320.845 4.958 20 0 DJADLO Cc1ccc(C)c(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)c1 ZINC000112183197 334368581 /nfs/dbraw/zinc/36/85/81/334368581.db2.gz OUFMUBDCZHBLEA-UHFFFAOYSA-N 1 2 318.376 4.743 20 0 DJADLO Cc1ccc(N[C@H](c2[nH]cc[nH+]2)c2ccc(F)cc2)cc1Cl ZINC000188312225 334684654 /nfs/dbraw/zinc/68/46/54/334684654.db2.gz YUWROMPCOXCNEI-INIZCTEOSA-N 1 2 315.779 4.712 20 0 DJADLO CCSc1cccc(N[C@@H](c2[nH]cc[nH+]2)c2ccccc2)c1 ZINC000188418152 334708257 /nfs/dbraw/zinc/70/82/57/334708257.db2.gz DFJJNRGVKAUMFS-QGZVFWFLSA-N 1 2 309.438 4.723 20 0 DJADLO CC(F)(F)c1cccc(NCc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000189549411 334900283 /nfs/dbraw/zinc/90/02/83/334900283.db2.gz WRXZDIFODHPCRZ-UHFFFAOYSA-N 1 2 313.351 4.596 20 0 DJADLO COc1cccc2cc([C@H](C)[NH2+][C@H](C)c3csc(C)n3)oc21 ZINC000344099348 335218009 /nfs/dbraw/zinc/21/80/09/335218009.db2.gz KCMQBJCODPESFH-MNOVXSKESA-N 1 2 316.426 4.618 20 0 DJADLO Cc1nc(C[N@H+](C)Cc2ccoc2)oc1-c1ccc(Cl)cc1 ZINC000344371552 335245315 /nfs/dbraw/zinc/24/53/15/335245315.db2.gz SJTMBJGSGMMGRZ-UHFFFAOYSA-N 1 2 316.788 4.528 20 0 DJADLO Cc1nc(C[N@@H+](C)Cc2ccoc2)oc1-c1ccc(Cl)cc1 ZINC000344371552 335245316 /nfs/dbraw/zinc/24/53/16/335245316.db2.gz SJTMBJGSGMMGRZ-UHFFFAOYSA-N 1 2 316.788 4.528 20 0 DJADLO CCc1cnc(C[N@H+](Cc2ccc([C@@H]3C[C@@H]3C)o2)C2CC2)s1 ZINC000346138112 335380278 /nfs/dbraw/zinc/38/02/78/335380278.db2.gz RSXFZNDDZYAUAE-BLLLJJGKSA-N 1 2 316.470 4.587 20 0 DJADLO CCc1cnc(C[N@@H+](Cc2ccc([C@@H]3C[C@@H]3C)o2)C2CC2)s1 ZINC000346138112 335380280 /nfs/dbraw/zinc/38/02/80/335380280.db2.gz RSXFZNDDZYAUAE-BLLLJJGKSA-N 1 2 316.470 4.587 20 0 DJADLO Cc1csc([C@H](C)[NH2+]Cc2nc(C3CCCCC3)cs2)n1 ZINC000444677763 338481758 /nfs/dbraw/zinc/48/17/58/338481758.db2.gz UVOWWEZASZRRRB-LBPRGKRZSA-N 1 2 321.515 4.807 20 0 DJADLO CC[C@H]([NH2+]C1(c2nc(C)cs2)CCC1)c1ccc(F)cc1F ZINC000346665137 335427696 /nfs/dbraw/zinc/42/76/96/335427696.db2.gz GMTSMNFAHCDTCC-HNNXBMFYSA-N 1 2 322.424 4.850 20 0 DJADLO C[C@H](Sc1ccccc1)c1ccc(NCc2c[nH+]cn2C)cc1 ZINC000347768782 335523695 /nfs/dbraw/zinc/52/36/95/335523695.db2.gz RVEWTOMGFFGUNS-HNNXBMFYSA-N 1 2 323.465 4.886 20 0 DJADLO CCCCCOc1cc(C)ccc1C[NH2+][C@H](C)c1cscn1 ZINC000536625299 335845611 /nfs/dbraw/zinc/84/56/11/335845611.db2.gz DKSZEELKNRIBJY-OAHLLOKOSA-N 1 2 318.486 4.871 20 0 DJADLO CC[C@H]([NH2+][C@H](C)c1cscn1)c1cc(Cl)ccc1OC ZINC000519833118 335899048 /nfs/dbraw/zinc/89/90/48/335899048.db2.gz MSNQHJCJZQNYSN-MFKMUULPSA-N 1 2 310.850 4.607 20 0 DJADLO CC[C@H]([NH2+][C@@H](C)c1cscn1)c1cc(Cl)ccc1OC ZINC000519833093 335899074 /nfs/dbraw/zinc/89/90/74/335899074.db2.gz MSNQHJCJZQNYSN-GWCFXTLKSA-N 1 2 310.850 4.607 20 0 DJADLO CSCc1cnc(C[N@@H+]2CCCCC[C@@H]2c2ccco2)s1 ZINC000351599784 336048611 /nfs/dbraw/zinc/04/86/11/336048611.db2.gz CXUBZYVSPWBMFB-CQSZACIVSA-N 1 2 322.499 4.716 20 0 DJADLO CSCc1cnc(C[N@H+]2CCCCC[C@@H]2c2ccco2)s1 ZINC000351599784 336048612 /nfs/dbraw/zinc/04/86/12/336048612.db2.gz CXUBZYVSPWBMFB-CQSZACIVSA-N 1 2 322.499 4.716 20 0 DJADLO Cc1ccc(C[N@@H+](C)Cc2nc(-c3ccc(C)cc3)cs2)o1 ZINC000351853871 336073605 /nfs/dbraw/zinc/07/36/05/336073605.db2.gz NAKSIBPNNYBQFL-UHFFFAOYSA-N 1 2 312.438 4.652 20 0 DJADLO Cc1ccc(C[N@H+](C)Cc2nc(-c3ccc(C)cc3)cs2)o1 ZINC000351853871 336073607 /nfs/dbraw/zinc/07/36/07/336073607.db2.gz NAKSIBPNNYBQFL-UHFFFAOYSA-N 1 2 312.438 4.652 20 0 DJADLO Cc1c[nH]c(-c2ccccc2NC(=O)C[C@@H]2CCC[C@@H](C)C2)[nH+]1 ZINC000331707887 336145046 /nfs/dbraw/zinc/14/50/46/336145046.db2.gz BRILVWMBKBPIIT-UKRRQHHQSA-N 1 2 311.429 4.540 20 0 DJADLO Fc1ccc(NCc2[nH+]ccn2Cc2ccccc2)cc1C1CC1 ZINC000352618111 336227191 /nfs/dbraw/zinc/22/71/91/336227191.db2.gz MFKBQMJTADZXGY-UHFFFAOYSA-N 1 2 321.399 4.560 20 0 DJADLO Cc1cc([C@H](C)[NH2+]Cc2csc(-c3cccs3)n2)c(C)o1 ZINC000103170624 336238276 /nfs/dbraw/zinc/23/82/76/336238276.db2.gz CAMJWXKVBNEKNB-NSHDSACASA-N 1 2 318.467 4.932 20 0 DJADLO CCC1(C)CCN(C(=O)c2cccc(Oc3cc[nH+]cc3)c2)CC1 ZINC000352806952 336242623 /nfs/dbraw/zinc/24/26/23/336242623.db2.gz VFLLINNIVCRPCS-UHFFFAOYSA-N 1 2 324.424 4.526 20 0 DJADLO C[C@@H](c1ccc(Cl)cc1)[N@@H+]1CCO[C@@H](c2cccs2)C1 ZINC000532379405 336244235 /nfs/dbraw/zinc/24/42/35/336244235.db2.gz KEFHRLJLMHYGTO-SWLSCSKDSA-N 1 2 307.846 4.536 20 0 DJADLO C[C@@H](c1ccc(Cl)cc1)[N@H+]1CCO[C@@H](c2cccs2)C1 ZINC000532379405 336244236 /nfs/dbraw/zinc/24/42/36/336244236.db2.gz KEFHRLJLMHYGTO-SWLSCSKDSA-N 1 2 307.846 4.536 20 0 DJADLO COc1cc(C)ccc1[C@@H](C)[NH2+]Cc1c(F)cccc1Cl ZINC000532463790 336249084 /nfs/dbraw/zinc/24/90/84/336249084.db2.gz FPACGKFKLQVPJP-GFCCVEGCSA-N 1 2 307.796 4.647 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1cc(F)ccc1F ZINC000324827670 336260962 /nfs/dbraw/zinc/26/09/62/336260962.db2.gz HJVISYRUAXTEHI-VLIAUNLRSA-N 1 2 324.374 4.800 20 0 DJADLO Clc1ccc2c(c1)C[N@@H+](Cc1ccno1)[C@@H](c1ccccc1)C2 ZINC000532646348 336265627 /nfs/dbraw/zinc/26/56/27/336265627.db2.gz VMUCVDFQAFLIIE-LJQANCHMSA-N 1 2 324.811 4.628 20 0 DJADLO Clc1ccc2c(c1)C[N@H+](Cc1ccno1)[C@@H](c1ccccc1)C2 ZINC000532646348 336265628 /nfs/dbraw/zinc/26/56/28/336265628.db2.gz VMUCVDFQAFLIIE-LJQANCHMSA-N 1 2 324.811 4.628 20 0 DJADLO CC[C@@H](c1ccc(F)cc1F)[N@H+](C)Cc1nc2ccccc2o1 ZINC000532749122 336269571 /nfs/dbraw/zinc/26/95/71/336269571.db2.gz NUSKJNUYLMDIIP-INIZCTEOSA-N 1 2 316.351 4.689 20 0 DJADLO CC[C@@H](c1ccc(F)cc1F)[N@@H+](C)Cc1nc2ccccc2o1 ZINC000532749122 336269572 /nfs/dbraw/zinc/26/95/72/336269572.db2.gz NUSKJNUYLMDIIP-INIZCTEOSA-N 1 2 316.351 4.689 20 0 DJADLO C[C@@H](c1ncc(-c2ccccc2)o1)[N@H+](C)Cc1cccc(F)c1 ZINC000532760744 336270007 /nfs/dbraw/zinc/27/00/07/336270007.db2.gz NDAJAPBHDGCTBG-AWEZNQCLSA-N 1 2 310.372 4.674 20 0 DJADLO C[C@@H](c1ncc(-c2ccccc2)o1)[N@@H+](C)Cc1cccc(F)c1 ZINC000532760744 336270008 /nfs/dbraw/zinc/27/00/08/336270008.db2.gz NDAJAPBHDGCTBG-AWEZNQCLSA-N 1 2 310.372 4.674 20 0 DJADLO CC(C)COC[C@@H]([NH2+]Cc1cc2ccccc2o1)c1ccco1 ZINC000101596991 336283491 /nfs/dbraw/zinc/28/34/91/336283491.db2.gz DSHVJCIYAFVIKI-QGZVFWFLSA-N 1 2 313.397 4.529 20 0 DJADLO CCc1cc(N[C@H](C)c2ccc(C)s2)nc(-c2ccncc2)[nH+]1 ZINC000301168369 336293000 /nfs/dbraw/zinc/29/30/00/336293000.db2.gz IWLQDQNCVOAOAC-CYBMUJFWSA-N 1 2 324.453 4.644 20 0 DJADLO C[C@@H](Nc1cc[nH+]c(C2CC2)n1)c1cccc(C(F)(F)F)c1 ZINC000301222856 336295492 /nfs/dbraw/zinc/29/54/92/336295492.db2.gz BPJCFGXMDCNEHY-SNVBAGLBSA-N 1 2 307.319 4.546 20 0 DJADLO Clc1ccc2c(c1)[C@H](Nc1cc[nH+]c(C3CC3)n1)CCS2 ZINC000301283424 336298685 /nfs/dbraw/zinc/29/86/85/336298685.db2.gz QRCQNOYMHFPQSS-CYBMUJFWSA-N 1 2 317.845 4.656 20 0 DJADLO Clc1ccc2c(c1)[C@@H](Nc1cc[nH+]c(C3CC3)n1)CCS2 ZINC000301283425 336298691 /nfs/dbraw/zinc/29/86/91/336298691.db2.gz QRCQNOYMHFPQSS-ZDUSSCGKSA-N 1 2 317.845 4.656 20 0 DJADLO Cc1ccsc1[C@H](Cc1ccccc1)Nc1cc(C)[nH+]cn1 ZINC000301350151 336301924 /nfs/dbraw/zinc/30/19/24/336301924.db2.gz VNLXAUGDZZYASA-INIZCTEOSA-N 1 2 309.438 4.551 20 0 DJADLO Cc1ccc(-c2nc(CNc3ccc4ccccc4[nH+]3)co2)cc1 ZINC000301431805 336306371 /nfs/dbraw/zinc/30/63/71/336306371.db2.gz OXKKGBHZPPPXBQ-UHFFFAOYSA-N 1 2 315.376 4.810 20 0 DJADLO C[C@@H](Nc1ccc2ccccc2[nH+]1)c1ccc(-n2cccn2)cc1 ZINC000301432202 336306492 /nfs/dbraw/zinc/30/64/92/336306492.db2.gz JBEAAQCCVWIXRZ-OAHLLOKOSA-N 1 2 314.392 4.594 20 0 DJADLO CC[C@H](Nc1cc(C(F)(F)F)cc[nH+]1)c1ccc(OC)cc1 ZINC000301603438 336317873 /nfs/dbraw/zinc/31/78/73/336317873.db2.gz XCYWJWUQMSVNLQ-AWEZNQCLSA-N 1 2 310.319 4.672 20 0 DJADLO C[C@@H](Nc1ccc2ccccc2[nH+]1)c1ccccc1-n1cccn1 ZINC000301646535 336320453 /nfs/dbraw/zinc/32/04/53/336320453.db2.gz NZJDAJCGISMZRP-OAHLLOKOSA-N 1 2 314.392 4.594 20 0 DJADLO Cc1csc([C@H](C)Nc2cc(C)[nH+]c3c(F)cccc23)n1 ZINC000301672146 336322383 /nfs/dbraw/zinc/32/23/83/336322383.db2.gz OGKLMNLKBGUVBU-NSHDSACASA-N 1 2 301.390 4.620 20 0 DJADLO Cc1cc(N[C@@H](CCCO)c2ccccc2)c2cccc(F)c2[nH+]1 ZINC000301697847 336324177 /nfs/dbraw/zinc/32/41/77/336324177.db2.gz ZXCNBGJHCYNHQB-SFHVURJKSA-N 1 2 324.399 4.608 20 0 DJADLO Cc1cc(N[C@H](CCCO)c2ccccc2)c2cccc(F)c2[nH+]1 ZINC000301697846 336324207 /nfs/dbraw/zinc/32/42/07/336324207.db2.gz ZXCNBGJHCYNHQB-GOSISDBHSA-N 1 2 324.399 4.608 20 0 DJADLO Cc1cc2ccccc2[nH+]c1N1C[C@@H](c2ccsc2)O[C@@H](C)C1 ZINC000301737418 336326570 /nfs/dbraw/zinc/32/65/70/336326570.db2.gz VUVCMKVFNRUVLG-KSSFIOAISA-N 1 2 324.449 4.571 20 0 DJADLO CC[C@H](Nc1cc(C)[nH+]c2c(F)cccc12)c1c(C)noc1C ZINC000301838082 336333390 /nfs/dbraw/zinc/33/33/90/336333390.db2.gz WMJKTUQUPBUOGK-HNNXBMFYSA-N 1 2 313.376 4.850 20 0 DJADLO CC[C@H](Nc1cc(C(C)C)[nH+]c(C(C)C)n1)c1c(C)noc1C ZINC000301846558 336333928 /nfs/dbraw/zinc/33/39/28/336333928.db2.gz BANCANIXVJZGDO-AWEZNQCLSA-N 1 2 316.449 4.891 20 0 DJADLO CCCO[C@H]1CCCN(c2cc(C(C)C)[nH+]c(C(C)C)n2)CC1 ZINC000301867850 336335136 /nfs/dbraw/zinc/33/51/36/336335136.db2.gz NVYBSKRRIYCFLS-INIZCTEOSA-N 1 2 319.493 4.509 20 0 DJADLO Fc1cccc([C@@H]2CCCN2c2cc(C(F)(F)F)cc[nH+]2)c1 ZINC000301977568 336340994 /nfs/dbraw/zinc/34/09/94/336340994.db2.gz FPKMIEDCJNEWQO-AWEZNQCLSA-N 1 2 310.294 4.581 20 0 DJADLO C[C@H]1CCN(c2cc(C(F)(F)F)cc[nH+]2)[C@H](c2ccco2)C1 ZINC000302040363 336344898 /nfs/dbraw/zinc/34/48/98/336344898.db2.gz NKWQDCOOCCDJCY-AAEUAGOBSA-N 1 2 310.319 4.671 20 0 DJADLO Cc1cc(N[C@H](C)c2c(C)cccc2C)nc(-c2cccnc2)[nH+]1 ZINC000302244070 336356100 /nfs/dbraw/zinc/35/61/00/336356100.db2.gz ZEZMFIBICGQWSM-MRXNPFEDSA-N 1 2 318.424 4.637 20 0 DJADLO CCOc1ccc2c(c1)[C@H](Nc1ccc3ccccc3[nH+]1)CCO2 ZINC000302471797 336359425 /nfs/dbraw/zinc/35/94/25/336359425.db2.gz WOXUJYWRFMUSCG-GOSISDBHSA-N 1 2 320.392 4.569 20 0 DJADLO Cc1csc([C@H](C)Nc2cc(C(C)(C)C)[nH+]c(C(C)C)n2)n1 ZINC000302885277 336373339 /nfs/dbraw/zinc/37/33/39/336373339.db2.gz KPXBRJSBFOVRBS-LBPRGKRZSA-N 1 2 318.490 4.836 20 0 DJADLO Clc1oc2ccccc2c1CN1CCCC[C@H]1c1[nH]cc[nH+]1 ZINC000352899835 336375324 /nfs/dbraw/zinc/37/53/24/336375324.db2.gz SFAYSGXSIFHCOG-AWEZNQCLSA-N 1 2 315.804 4.537 20 0 DJADLO COc1ccccc1-c1ccc(CNc2ccc(C)[nH+]c2)cc1 ZINC000532886716 336393223 /nfs/dbraw/zinc/39/32/23/336393223.db2.gz HFDKUXUTXGZYFB-UHFFFAOYSA-N 1 2 304.393 4.678 20 0 DJADLO FC(F)[C@H](CCc1ccccc1)[NH2+][C@H]1CCCc2occc21 ZINC000353544227 336423850 /nfs/dbraw/zinc/42/38/50/336423850.db2.gz QJVFUVJNQIALKA-HOTGVXAUSA-N 1 2 305.368 4.513 20 0 DJADLO Cc1sc(CNc2[nH+]ccc3ccc(F)cc32)nc1C(C)C ZINC000354338594 336467352 /nfs/dbraw/zinc/46/73/52/336467352.db2.gz HEGOOXDBIGZCON-UHFFFAOYSA-N 1 2 315.417 4.874 20 0 DJADLO Fc1ccc2cc[nH+]c(NCc3coc(-c4ccccc4)n3)c2c1 ZINC000354343400 336467630 /nfs/dbraw/zinc/46/76/30/336467630.db2.gz NHEGRLVFZDVADA-UHFFFAOYSA-N 1 2 319.339 4.641 20 0 DJADLO Cc1cnc(C[NH+](Cc2ccccc2)Cc2ccccc2)s1 ZINC000357311700 336580238 /nfs/dbraw/zinc/58/02/38/336580238.db2.gz VBTVPGWPFDYFNV-UHFFFAOYSA-N 1 2 308.450 4.654 20 0 DJADLO C[C@H]([NH2+]Cc1ncc(Cl)s1)c1cccc(Cl)c1Cl ZINC000472048716 339360769 /nfs/dbraw/zinc/36/07/69/339360769.db2.gz SBDUTIMYQAHBCE-ZETCQYMHSA-N 1 2 321.660 4.954 20 0 DJADLO Cc1nc([C@@H](C)[NH2+][C@H](CC(F)(F)F)c2ccccc2)cs1 ZINC000361079123 336737536 /nfs/dbraw/zinc/73/75/36/336737536.db2.gz JWWABQNHQWWGOZ-ZWNOBZJWSA-N 1 2 314.376 4.796 20 0 DJADLO Cc1ccc(NC(=O)C[C@@H]2C[C@@H](C)c3c2cccc3C)c(C)[nH+]1 ZINC000362649279 336807762 /nfs/dbraw/zinc/80/77/62/336807762.db2.gz PMARLZNSQMGPOK-CJNGLKHVSA-N 1 2 308.425 4.626 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1cccc(F)c1F ZINC000371509825 336906632 /nfs/dbraw/zinc/90/66/32/336906632.db2.gz QYGNNUMPRKCQSK-VLIAUNLRSA-N 1 2 324.374 4.800 20 0 DJADLO Cc1c[nH+]cc(NCc2cnc(-c3ccc(Cl)cc3)s2)c1 ZINC000582367031 336944905 /nfs/dbraw/zinc/94/49/05/336944905.db2.gz DFPXITSALQLMQX-UHFFFAOYSA-N 1 2 315.829 4.779 20 0 DJADLO CC[C@H](C(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C)c1ccccc1 ZINC000373667308 336968265 /nfs/dbraw/zinc/96/82/65/336968265.db2.gz PLXJYQQFRHICHC-KRWDZBQOSA-N 1 2 319.408 4.517 20 0 DJADLO CCc1nc(C)c([C@H](C)[N@H+](C)Cc2csc(C(C)C)n2)s1 ZINC000122238575 337000065 /nfs/dbraw/zinc/00/00/65/337000065.db2.gz GHNVWPWPMORYPM-LBPRGKRZSA-N 1 2 323.531 4.787 20 0 DJADLO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2csc(C(C)C)n2)s1 ZINC000122238575 337000066 /nfs/dbraw/zinc/00/00/66/337000066.db2.gz GHNVWPWPMORYPM-LBPRGKRZSA-N 1 2 323.531 4.787 20 0 DJADLO CCc1nc(C)c([C@@H](C)[N@H+](C)Cc2csc(C(C)C)n2)s1 ZINC000122238354 337000129 /nfs/dbraw/zinc/00/01/29/337000129.db2.gz GHNVWPWPMORYPM-GFCCVEGCSA-N 1 2 323.531 4.787 20 0 DJADLO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2csc(C(C)C)n2)s1 ZINC000122238354 337000130 /nfs/dbraw/zinc/00/01/30/337000130.db2.gz GHNVWPWPMORYPM-GFCCVEGCSA-N 1 2 323.531 4.787 20 0 DJADLO COc1ccsc1[C@H](C)[NH2+][C@@H](c1ccccc1)c1ccccn1 ZINC000375085666 337003074 /nfs/dbraw/zinc/00/30/74/337003074.db2.gz ZYLCMRCHMDMIAI-KSSFIOAISA-N 1 2 324.449 4.592 20 0 DJADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2cc(C(C)C)oc2C)[nH+]1 ZINC000376070764 337026317 /nfs/dbraw/zinc/02/63/17/337026317.db2.gz VFDZIOVPISIWPL-UHFFFAOYSA-N 1 2 323.396 4.662 20 0 DJADLO C[C@H](Nc1cccc(-c2cn3c([nH+]2)CCCC3)c1)c1nccs1 ZINC000376165178 337028775 /nfs/dbraw/zinc/02/87/75/337028775.db2.gz HROPVTIPECLGIY-ZDUSSCGKSA-N 1 2 324.453 4.516 20 0 DJADLO Cc1ccc([C@@H](C)[NH2+][C@@H](c2nccs2)c2ccccc2)s1 ZINC000123070622 337035083 /nfs/dbraw/zinc/03/50/83/337035083.db2.gz VXTWELNTRMJWMZ-CZUORRHYSA-N 1 2 314.479 4.953 20 0 DJADLO COc1ccccc1[C@H](C)[NH2+][C@@H](c1nccs1)c1ccccc1 ZINC000123179593 337038867 /nfs/dbraw/zinc/03/88/67/337038867.db2.gz GQLIVBAEYJBVOS-KBXCAEBGSA-N 1 2 324.449 4.592 20 0 DJADLO COc1ccccc1[C@@H](C)[NH2+][C@@H](c1nccs1)c1ccccc1 ZINC000123179811 337038882 /nfs/dbraw/zinc/03/88/82/337038882.db2.gz GQLIVBAEYJBVOS-RDTXWAMCSA-N 1 2 324.449 4.592 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC[C@@H](c2ccccc2)CC1 ZINC000376669970 337039383 /nfs/dbraw/zinc/03/93/83/337039383.db2.gz FGINNMOTVMSGOP-GOSISDBHSA-N 1 2 323.440 4.500 20 0 DJADLO Cc1ccc2c(c1)[C@@H]([NH2+][C@H](c1nccs1)c1ccccc1)CC2 ZINC000123269601 337041751 /nfs/dbraw/zinc/04/17/51/337041751.db2.gz DJZFQRGUYSFATJ-OALUTQOASA-N 1 2 320.461 4.818 20 0 DJADLO Cc1ccc([C@@H](C)[NH2+][C@@H](c2nccs2)c2ccccc2)cc1 ZINC000123344125 337044936 /nfs/dbraw/zinc/04/49/36/337044936.db2.gz GZWXTHLOSNKPQX-CRAIPNDOSA-N 1 2 308.450 4.892 20 0 DJADLO COc1cccc([C@@H](C)[NH2+][C@@H](c2nccs2)c2ccccc2)c1 ZINC000177270515 337155109 /nfs/dbraw/zinc/15/51/09/337155109.db2.gz WALIIQCTABUPKQ-RDTXWAMCSA-N 1 2 324.449 4.592 20 0 DJADLO C[C@H]([NH2+][C@H](c1ccco1)c1ccccc1)c1ccc(Cl)nc1 ZINC000179098003 337167072 /nfs/dbraw/zinc/16/70/72/337167072.db2.gz YEIRKQGEFCEAEZ-UGSOOPFHSA-N 1 2 312.800 4.768 20 0 DJADLO Cc1csc([C@H](C)[NH2+]Cc2ccc(Oc3ccccc3)o2)n1 ZINC000180855705 337178119 /nfs/dbraw/zinc/17/81/19/337178119.db2.gz IIMHBLBQHLSSCC-ZDUSSCGKSA-N 1 2 314.410 4.688 20 0 DJADLO CCc1cccc(C[NH2+][C@@H](c2nccs2)c2ccccc2)c1 ZINC000189643431 337280961 /nfs/dbraw/zinc/28/09/61/337280961.db2.gz PTJMPEQRSWITQA-GOSISDBHSA-N 1 2 308.450 4.585 20 0 DJADLO CCc1cccc(C[NH2+][C@H](c2nccs2)c2ccccc2)c1 ZINC000189643415 337280964 /nfs/dbraw/zinc/28/09/64/337280964.db2.gz PTJMPEQRSWITQA-SFHVURJKSA-N 1 2 308.450 4.585 20 0 DJADLO Cc1c([C@@H](C)[NH2+][C@@H](c2ccco2)c2ccccc2)cnn1C(C)C ZINC000191134089 337294361 /nfs/dbraw/zinc/29/43/61/337294361.db2.gz QYGRSYFUZINNKC-FOIQADDNSA-N 1 2 323.440 4.806 20 0 DJADLO Cc1cc([C@@H](C)Nc2[nH+]ccc(C)c2Br)c(C)o1 ZINC000235290323 337307541 /nfs/dbraw/zinc/30/75/41/337307541.db2.gz NEKXUDDIQFIXIU-SNVBAGLBSA-N 1 2 309.207 4.535 20 0 DJADLO COc1ccccc1[C@H]([NH2+][C@@H](C)c1ccccc1)c1ccco1 ZINC000130804372 337434372 /nfs/dbraw/zinc/43/43/72/337434372.db2.gz LNQLEKBHSBOVKS-YWZLYKJASA-N 1 2 307.393 4.728 20 0 DJADLO COc1ccccc1[C@H]([NH2+][C@H](C)c1ccccc1)c1ccco1 ZINC000130804588 337434415 /nfs/dbraw/zinc/43/44/15/337434415.db2.gz LNQLEKBHSBOVKS-QRWLVFNGSA-N 1 2 307.393 4.728 20 0 DJADLO C[C@@H]([NH2+][C@H](c1nccs1)c1ccccc1)c1ccc(F)cc1 ZINC000195052711 337464749 /nfs/dbraw/zinc/46/47/49/337464749.db2.gz VWZIXXPHAWEFNH-DYVFJYSZSA-N 1 2 312.413 4.722 20 0 DJADLO C[C@@H]([NH2+][C@H](c1nccs1)c1ccccc1)c1cccc(F)c1 ZINC000195074164 337464795 /nfs/dbraw/zinc/46/47/95/337464795.db2.gz HSXLSMRPOAZTAB-DYVFJYSZSA-N 1 2 312.413 4.722 20 0 DJADLO CCCCc1noc([C@H](C)[NH2+][C@H](C)c2ccc(C3CC3)cc2)n1 ZINC000419332781 337479921 /nfs/dbraw/zinc/47/99/21/337479921.db2.gz DZNUMXYHPBBSCN-KGLIPLIRSA-N 1 2 313.445 4.701 20 0 DJADLO c1c2ccccc2oc1[C@@H]([NH2+]Cc1ccccn1)c1ccccc1 ZINC000073136945 337549540 /nfs/dbraw/zinc/54/95/40/337549540.db2.gz JHGAMFFCWZXUBK-NRFANRHFSA-N 1 2 314.388 4.707 20 0 DJADLO c1nc(C2CC2)sc1CNc1ccc(-c2ccccc2)c[nH+]1 ZINC000162227835 337611106 /nfs/dbraw/zinc/61/11/06/337611106.db2.gz PUDQZWLFAYXGEW-UHFFFAOYSA-N 1 2 307.422 4.695 20 0 DJADLO CCc1nc([C@H](C)[NH2+][C@@H](C)c2ccc(F)cc2Cl)cs1 ZINC000162315480 337614575 /nfs/dbraw/zinc/61/45/75/337614575.db2.gz PRLKBYCGIGWFLP-UWVGGRQHSA-N 1 2 312.841 4.910 20 0 DJADLO C[C@H]([NH2+]Cc1cc(Cl)sc1Cl)c1ccncc1Cl ZINC000421845665 337654296 /nfs/dbraw/zinc/65/42/96/337654296.db2.gz QMXXJRXOIBTKNB-ZETCQYMHSA-N 1 2 321.660 4.954 20 0 DJADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2cc(F)c(Cl)cc2F)o1 ZINC000433195353 337718938 /nfs/dbraw/zinc/71/89/38/337718938.db2.gz UDTNKQOOQMUVCM-SKDRFNHKSA-N 1 2 311.759 4.624 20 0 DJADLO CC(C)n1c[nH+]cc1CNc1ccccc1CCC(F)(F)F ZINC000424137717 337757622 /nfs/dbraw/zinc/75/76/22/337757622.db2.gz BEDAIHICNXXLDI-UHFFFAOYSA-N 1 2 311.351 4.571 20 0 DJADLO CC[C@H](C)c1ccc([C@@H](C)[NH2+]Cc2nnc(C3CC3)s2)cc1 ZINC000527909445 337770574 /nfs/dbraw/zinc/77/05/74/337770574.db2.gz QVXLQEVIPFQZSY-QWHCGFSZSA-N 1 2 315.486 4.780 20 0 DJADLO CC(C)c1nc([C@H](C)[NH2+]Cc2ccc(F)c(Cl)c2)cs1 ZINC000162805126 337777450 /nfs/dbraw/zinc/77/74/50/337777450.db2.gz AORBJFVJDVAZOA-JTQLQIEISA-N 1 2 312.841 4.910 20 0 DJADLO CCC(CC)[C@H]([NH2+]Cc1nnsc1Cl)c1cccs1 ZINC000537074176 337886405 /nfs/dbraw/zinc/88/64/05/337886405.db2.gz XTPLLKNVGZIIDU-LBPRGKRZSA-N 1 2 315.895 4.520 20 0 DJADLO Cc1cccc([C@@H]([NH2+][C@@H](C)c2ccccc2F)c2ccccn2)c1 ZINC000090946608 337887220 /nfs/dbraw/zinc/88/72/20/337887220.db2.gz MEFSPXPRJHGXLI-HRAATJIYSA-N 1 2 320.411 4.969 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1cccc(F)c1)c1ccccn1)c1ccsc1 ZINC000090956410 337887491 /nfs/dbraw/zinc/88/74/91/337887491.db2.gz MAQYRGRTRZHCHT-ACJLOTCBSA-N 1 2 312.413 4.722 20 0 DJADLO Cc1ccc([C@@H](C)[NH2+][C@@H](c2cccc(F)c2)c2ccccn2)o1 ZINC000090955815 337887517 /nfs/dbraw/zinc/88/75/17/337887517.db2.gz ACISVRXJKFDLOP-KUHUBIRLSA-N 1 2 310.372 4.562 20 0 DJADLO Cc1c[nH+]ccc1NC(=O)N[C@@H](C)c1cccc(Cl)c1Cl ZINC000121536470 337895056 /nfs/dbraw/zinc/89/50/56/337895056.db2.gz WDXWARSNVXBHKG-JTQLQIEISA-N 1 2 324.211 4.580 20 0 DJADLO CC[C@@H]([NH2+]Cc1ncc(C)s1)c1ccc(Cl)cc1Cl ZINC000122976615 337934097 /nfs/dbraw/zinc/93/40/97/337934097.db2.gz HKWNPFKUYFZRBC-CYBMUJFWSA-N 1 2 315.269 4.999 20 0 DJADLO COc1cc(C)[nH+]c(CNc2ccc3oc4ccccc4c3c2)c1 ZINC000537652369 337953950 /nfs/dbraw/zinc/95/39/50/337953950.db2.gz PGRFXLWCPAIMLE-UHFFFAOYSA-N 1 2 318.376 4.910 20 0 DJADLO C[C@H]([NH2+]Cc1c(F)cccc1Cl)c1nc2c(s1)CCCC2 ZINC000537883155 337964267 /nfs/dbraw/zinc/96/42/67/337964267.db2.gz PZQLIGSCDGNWON-JTQLQIEISA-N 1 2 324.852 4.665 20 0 DJADLO Cc1cnc([C@H](C)[NH+]2Cc3ccccc3-c3ccccc3C2)o1 ZINC000537851479 337964861 /nfs/dbraw/zinc/96/48/61/337964861.db2.gz PCASPADSKVSWTK-HNNXBMFYSA-N 1 2 304.393 4.727 20 0 DJADLO CC[N@H+](Cc1nc(C(C)(C)C)no1)Cc1ccc2ccccc2c1 ZINC000516307952 338010199 /nfs/dbraw/zinc/01/01/99/338010199.db2.gz VLZCGPZJAKKFDU-UHFFFAOYSA-N 1 2 323.440 4.542 20 0 DJADLO CC[N@@H+](Cc1nc(C(C)(C)C)no1)Cc1ccc2ccccc2c1 ZINC000516307952 338010200 /nfs/dbraw/zinc/01/02/00/338010200.db2.gz VLZCGPZJAKKFDU-UHFFFAOYSA-N 1 2 323.440 4.542 20 0 DJADLO Cc1ccc2cc([C@@H](C)[NH2+]Cc3nnc(C(C)C)s3)oc2c1 ZINC000426020114 338019563 /nfs/dbraw/zinc/01/95/63/338019563.db2.gz HMDHPFKPXHVJQM-GFCCVEGCSA-N 1 2 315.442 4.567 20 0 DJADLO Fc1ccc2cc[nH+]c(NC[C@H]3CCO[C@@H]3c3ccccc3)c2c1 ZINC000428189664 338041984 /nfs/dbraw/zinc/04/19/84/338041984.db2.gz CLAHXWRNIBLBNP-VQIMIIECSA-N 1 2 322.383 4.564 20 0 DJADLO CCc1nc(C)c(C[N@H+]([C@H](C)c2ccccc2Cl)C2CC2)o1 ZINC000428216599 338042781 /nfs/dbraw/zinc/04/27/81/338042781.db2.gz DKJZIFFRYBPIOO-CYBMUJFWSA-N 1 2 318.848 4.924 20 0 DJADLO CCc1nc(C)c(C[N@@H+]([C@H](C)c2ccccc2Cl)C2CC2)o1 ZINC000428216599 338042782 /nfs/dbraw/zinc/04/27/82/338042782.db2.gz DKJZIFFRYBPIOO-CYBMUJFWSA-N 1 2 318.848 4.924 20 0 DJADLO Cc1nc(C(C)C)oc1C[NH2+][C@H](C)c1nc(C(C)(C)C)cs1 ZINC000428360412 338048653 /nfs/dbraw/zinc/04/86/53/338048653.db2.gz LBJXEJAGXGTGPX-GFCCVEGCSA-N 1 2 321.490 4.711 20 0 DJADLO C[C@@H]([NH2+]Cc1nc2ccc(F)cc2s1)c1cccc(F)c1F ZINC000428869487 338063560 /nfs/dbraw/zinc/06/35/60/338063560.db2.gz BBPZMBMHMOJMPZ-SECBINFHSA-N 1 2 322.355 4.564 20 0 DJADLO CC(C)([NH2+]Cc1ncc(Cl)cc1Cl)c1ccccc1F ZINC000429252637 338074881 /nfs/dbraw/zinc/07/48/81/338074881.db2.gz LXRFEKUKSJWDCH-UHFFFAOYSA-N 1 2 313.203 4.552 20 0 DJADLO Cc1ccoc1C[N@H+](C)Cc1csc(C2CCCCC2)n1 ZINC000429360273 338078582 /nfs/dbraw/zinc/07/85/82/338078582.db2.gz GGLXIAQDRVRKBM-UHFFFAOYSA-N 1 2 304.459 4.724 20 0 DJADLO Cc1ccoc1C[N@@H+](C)Cc1csc(C2CCCCC2)n1 ZINC000429360273 338078583 /nfs/dbraw/zinc/07/85/83/338078583.db2.gz GGLXIAQDRVRKBM-UHFFFAOYSA-N 1 2 304.459 4.724 20 0 DJADLO Cc1ccoc1C[N@@H+](C)[C@H](C)c1nc2ccccc2n1C(F)F ZINC000429370602 338078790 /nfs/dbraw/zinc/07/87/90/338078790.db2.gz WKEDXXAKQCWMRM-GFCCVEGCSA-N 1 2 319.355 4.526 20 0 DJADLO Cc1ccoc1C[N@H+](C)[C@H](C)c1nc2ccccc2n1C(F)F ZINC000429370602 338078791 /nfs/dbraw/zinc/07/87/91/338078791.db2.gz WKEDXXAKQCWMRM-GFCCVEGCSA-N 1 2 319.355 4.526 20 0 DJADLO C[C@H](c1cc2ccccc2o1)[N@H+](C)Cc1cc(C(C)(C)C)on1 ZINC000429707960 338087783 /nfs/dbraw/zinc/08/77/83/338087783.db2.gz KUNBCNZNTVJATH-CYBMUJFWSA-N 1 2 312.413 4.911 20 0 DJADLO C[C@H](c1cc2ccccc2o1)[N@@H+](C)Cc1cc(C(C)(C)C)on1 ZINC000429707960 338087784 /nfs/dbraw/zinc/08/77/84/338087784.db2.gz KUNBCNZNTVJATH-CYBMUJFWSA-N 1 2 312.413 4.911 20 0 DJADLO CC(C)(C)c1cc(C[N@H+](Cc2ccco2)C2CCCC2)no1 ZINC000429717356 338088154 /nfs/dbraw/zinc/08/81/54/338088154.db2.gz LPTJOHRQNHPVTL-UHFFFAOYSA-N 1 2 302.418 4.510 20 0 DJADLO CC(C)(C)c1cc(C[N@@H+](Cc2ccco2)C2CCCC2)no1 ZINC000429717356 338088155 /nfs/dbraw/zinc/08/81/55/338088155.db2.gz LPTJOHRQNHPVTL-UHFFFAOYSA-N 1 2 302.418 4.510 20 0 DJADLO C[C@H](c1cccc(Cl)c1)[N@H+](C)Cc1cc(C(C)(C)C)on1 ZINC000429726325 338088404 /nfs/dbraw/zinc/08/84/04/338088404.db2.gz PNMUGASTHVDMPT-GFCCVEGCSA-N 1 2 306.837 4.819 20 0 DJADLO C[C@H](c1cccc(Cl)c1)[N@@H+](C)Cc1cc(C(C)(C)C)on1 ZINC000429726325 338088405 /nfs/dbraw/zinc/08/84/05/338088405.db2.gz PNMUGASTHVDMPT-GFCCVEGCSA-N 1 2 306.837 4.819 20 0 DJADLO C[C@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1ccccc1Cl ZINC000429788541 338089948 /nfs/dbraw/zinc/08/99/48/338089948.db2.gz QSYSUWVNFZGSKJ-QMMMGPOBSA-N 1 2 317.713 4.747 20 0 DJADLO C[C@]12CC[N@H+](Cc3csc(Cl)c3Cl)C[C@H]1C2(F)F ZINC000430090829 338095804 /nfs/dbraw/zinc/09/58/04/338095804.db2.gz UEGCKGVSWPIHEU-KCJUWKMLSA-N 1 2 312.212 4.532 20 0 DJADLO C[C@]12CC[N@@H+](Cc3csc(Cl)c3Cl)C[C@H]1C2(F)F ZINC000430090829 338095805 /nfs/dbraw/zinc/09/58/05/338095805.db2.gz UEGCKGVSWPIHEU-KCJUWKMLSA-N 1 2 312.212 4.532 20 0 DJADLO CC1(C)C[N@H+](Cc2ccccc2C(F)(F)F)[C@H]1c1cccnc1 ZINC000430110325 338097437 /nfs/dbraw/zinc/09/74/37/338097437.db2.gz YKFBVHZXAQKQCM-INIZCTEOSA-N 1 2 320.358 4.684 20 0 DJADLO CC1(C)C[N@@H+](Cc2ccccc2C(F)(F)F)[C@H]1c1cccnc1 ZINC000430110325 338097438 /nfs/dbraw/zinc/09/74/38/338097438.db2.gz YKFBVHZXAQKQCM-INIZCTEOSA-N 1 2 320.358 4.684 20 0 DJADLO CC(C)c1cc(N2CC(C)(C)[C@@H]2c2ccncc2)nc(C(C)C)[nH+]1 ZINC000431486100 338132064 /nfs/dbraw/zinc/13/20/64/338132064.db2.gz PWANVRXWNWKYMT-SFHVURJKSA-N 1 2 324.472 4.706 20 0 DJADLO Fc1ccc(F)c(C[NH2+]Cc2csc(Cl)c2Cl)c1 ZINC000432233473 338149452 /nfs/dbraw/zinc/14/94/52/338149452.db2.gz RHNCYKNAYDHIGN-UHFFFAOYSA-N 1 2 308.180 4.623 20 0 DJADLO CC(C)([NH2+]Cc1ccc(F)c(Cl)c1Cl)c1nccs1 ZINC000432249967 338150831 /nfs/dbraw/zinc/15/08/31/338150831.db2.gz IBNOXVWOFBUHTQ-UHFFFAOYSA-N 1 2 319.232 4.614 20 0 DJADLO C[N@H+](Cc1ccc(C(F)(F)F)s1)Cc1ccccc1F ZINC000432741589 338165538 /nfs/dbraw/zinc/16/55/38/338165538.db2.gz MSOOUPJLXCPXML-UHFFFAOYSA-N 1 2 303.324 4.538 20 0 DJADLO C[N@@H+](Cc1ccc(C(F)(F)F)s1)Cc1ccccc1F ZINC000432741589 338165539 /nfs/dbraw/zinc/16/55/39/338165539.db2.gz MSOOUPJLXCPXML-UHFFFAOYSA-N 1 2 303.324 4.538 20 0 DJADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2csc(Cl)c2Cl)on1 ZINC000432744618 338165888 /nfs/dbraw/zinc/16/58/88/338165888.db2.gz LEGHOMOAJHTWEU-JTQLQIEISA-N 1 2 317.241 4.688 20 0 DJADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2csc(Cl)c2Cl)on1 ZINC000432744618 338165889 /nfs/dbraw/zinc/16/58/89/338165889.db2.gz LEGHOMOAJHTWEU-JTQLQIEISA-N 1 2 317.241 4.688 20 0 DJADLO Clc1scc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)c1Cl ZINC000432753641 338166519 /nfs/dbraw/zinc/16/65/19/338166519.db2.gz WEBXOMZRZZNNHE-LLVKDONJSA-N 1 2 301.242 4.720 20 0 DJADLO Clc1scc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)c1Cl ZINC000432753641 338166520 /nfs/dbraw/zinc/16/65/20/338166520.db2.gz WEBXOMZRZZNNHE-LLVKDONJSA-N 1 2 301.242 4.720 20 0 DJADLO Fc1ccc(C[NH+]2CCC(C(F)F)CC2)c(Cl)c1Cl ZINC000432754061 338166695 /nfs/dbraw/zinc/16/66/95/338166695.db2.gz IFICIJNOOKMMHP-UHFFFAOYSA-N 1 2 312.162 4.610 20 0 DJADLO C[C@@H](CC[NH2+][C@H](c1ccccc1)C(F)F)OCc1ccccc1 ZINC000433055712 338178968 /nfs/dbraw/zinc/17/89/68/338178968.db2.gz BKGXNJQQTNJUEU-MAUKXSAKSA-N 1 2 319.395 4.578 20 0 DJADLO CC(C)c1noc([C@@H](C)[NH2+][C@H](c2ccc(Cl)cc2)C(C)C)n1 ZINC000433781674 338201806 /nfs/dbraw/zinc/20/18/06/338201806.db2.gz FRKQCHGDXGLELD-DOMZBBRYSA-N 1 2 321.852 4.894 20 0 DJADLO c1c[nH]c([C@@H]2CCC[N@H+]2Cc2csc(Nc3ccccc3)n2)c1 ZINC000153579708 338226653 /nfs/dbraw/zinc/22/66/53/338226653.db2.gz NLWLNNACUUPYQO-KRWDZBQOSA-N 1 2 324.453 4.552 20 0 DJADLO c1c[nH]c([C@@H]2CCC[N@@H+]2Cc2csc(Nc3ccccc3)n2)c1 ZINC000153579708 338226654 /nfs/dbraw/zinc/22/66/54/338226654.db2.gz NLWLNNACUUPYQO-KRWDZBQOSA-N 1 2 324.453 4.552 20 0 DJADLO Fc1ccc(C(F)(F)F)cc1C[N@@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000435770297 338248493 /nfs/dbraw/zinc/24/84/93/338248493.db2.gz OKTADDFEIUJJDW-OAHLLOKOSA-N 1 2 312.310 4.510 20 0 DJADLO Fc1ccc(C(F)(F)F)cc1C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000435770297 338248494 /nfs/dbraw/zinc/24/84/94/338248494.db2.gz OKTADDFEIUJJDW-OAHLLOKOSA-N 1 2 312.310 4.510 20 0 DJADLO Cc1cc2[nH+]cn(Cc3nc(-c4ccccc4)cs3)c2cc1C ZINC000435793755 338249576 /nfs/dbraw/zinc/24/95/76/338249576.db2.gz DEFILIVRVLNULN-UHFFFAOYSA-N 1 2 319.433 4.825 20 0 DJADLO Cc1[nH]c2ccc(CSc3nc(-c4ccccc4)co3)cc2[nH+]1 ZINC000436247444 338263416 /nfs/dbraw/zinc/26/34/16/338263416.db2.gz UHYCLSCVLGZZRS-UHFFFAOYSA-N 1 2 321.405 4.819 20 0 DJADLO Cc1[nH]c2cc(CSc3nc(-c4ccccc4)co3)ccc2[nH+]1 ZINC000436247444 338263417 /nfs/dbraw/zinc/26/34/17/338263417.db2.gz UHYCLSCVLGZZRS-UHFFFAOYSA-N 1 2 321.405 4.819 20 0 DJADLO Cc1cc(C)c(NC(=O)N[C@H](C)c2cc3ccccc3o2)c(C)[nH+]1 ZINC000436495894 338274405 /nfs/dbraw/zinc/27/44/05/338274405.db2.gz PKCYTUOAHLRLLF-CYBMUJFWSA-N 1 2 323.396 4.636 20 0 DJADLO C[C@H](SCc1[nH+]ccn1CC(F)(F)F)c1cccc(F)c1 ZINC000437263841 338305221 /nfs/dbraw/zinc/30/52/21/338305221.db2.gz UTGNYSUGHHRLBQ-JTQLQIEISA-N 1 2 318.339 4.579 20 0 DJADLO CCC(CC)n1ccc(C[N@H+](CC)[C@H](C)c2cccc(O)c2)n1 ZINC000438132269 338333983 /nfs/dbraw/zinc/33/39/83/338333983.db2.gz YKMYGBCZWXJNPZ-OAHLLOKOSA-N 1 2 315.461 4.533 20 0 DJADLO CCC(CC)n1ccc(C[N@@H+](CC)[C@H](C)c2cccc(O)c2)n1 ZINC000438132269 338333984 /nfs/dbraw/zinc/33/39/84/338333984.db2.gz YKMYGBCZWXJNPZ-OAHLLOKOSA-N 1 2 315.461 4.533 20 0 DJADLO CC1(C)CCCCN(C(=O)c2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000438498795 338346060 /nfs/dbraw/zinc/34/60/60/338346060.db2.gz VOWGUHTZNLRMMM-UHFFFAOYSA-N 1 2 324.424 4.526 20 0 DJADLO CC(C)=CC[N@H+](Cc1nc(C)c(C)o1)Cc1ccc(Cl)cc1 ZINC000439487735 338371553 /nfs/dbraw/zinc/37/15/53/338371553.db2.gz VCYISIDBEXYTOX-UHFFFAOYSA-N 1 2 318.848 4.913 20 0 DJADLO CC(C)=CC[N@@H+](Cc1nc(C)c(C)o1)Cc1ccc(Cl)cc1 ZINC000439487735 338371554 /nfs/dbraw/zinc/37/15/54/338371554.db2.gz VCYISIDBEXYTOX-UHFFFAOYSA-N 1 2 318.848 4.913 20 0 DJADLO C[C@@H](SCc1c[nH+]cn1C)c1ccc(Cl)c(Cl)c1 ZINC000439541113 338372788 /nfs/dbraw/zinc/37/27/88/338372788.db2.gz KSDZYPWLONONEX-SECBINFHSA-N 1 2 301.242 4.721 20 0 DJADLO Cc1cccn2cc(CSCc3csc(C(C)C)n3)[nH+]c12 ZINC000439544463 338372814 /nfs/dbraw/zinc/37/28/14/338372814.db2.gz UFQJURMHEIQPEZ-UHFFFAOYSA-N 1 2 317.483 4.656 20 0 DJADLO Cc1ccc(-c2cnc(C[N@@H+]([C@H](C)c3ccco3)C3CC3)o2)cc1 ZINC000440903532 338399692 /nfs/dbraw/zinc/39/96/92/338399692.db2.gz SUMRDOJBYRONEI-OAHLLOKOSA-N 1 2 322.408 4.969 20 0 DJADLO Cc1ccc(-c2cnc(C[N@H+]([C@H](C)c3ccco3)C3CC3)o2)cc1 ZINC000440903532 338399693 /nfs/dbraw/zinc/39/96/93/338399693.db2.gz SUMRDOJBYRONEI-OAHLLOKOSA-N 1 2 322.408 4.969 20 0 DJADLO Clc1cc(Cl)cc(N[C@@H](c2[nH]cc[nH+]2)c2ccccc2)c1 ZINC000446890051 338539720 /nfs/dbraw/zinc/53/97/20/338539720.db2.gz GBVCKOWODJPPHF-OAHLLOKOSA-N 1 2 318.207 4.918 20 0 DJADLO CC[C@H]([NH2+]Cc1ncc(C(C)(C)C)s1)c1ccc(F)cc1F ZINC000447940142 338572388 /nfs/dbraw/zinc/57/23/88/338572388.db2.gz NKCQIZJXVRHIKV-AWEZNQCLSA-N 1 2 324.440 4.960 20 0 DJADLO CC(C)c1cnc(C[NH2+][C@@H](C)c2ccc(F)cc2Cl)s1 ZINC000449351173 338616450 /nfs/dbraw/zinc/61/64/50/338616450.db2.gz YYCRYSDDFRYIRK-JTQLQIEISA-N 1 2 312.841 4.910 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1csnn1)c1ccc(Cl)c2ccccc21 ZINC000450778306 338705064 /nfs/dbraw/zinc/70/50/64/338705064.db2.gz UDZRQZVMXPJLFH-MNOVXSKESA-N 1 2 317.845 4.757 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1ccc(Cl)c2ccccc21)c1csnn1 ZINC000450778307 338705096 /nfs/dbraw/zinc/70/50/96/338705096.db2.gz UDZRQZVMXPJLFH-QWRGUYRKSA-N 1 2 317.845 4.757 20 0 DJADLO CC(C)CCn1nc(C[NH2+][C@@H](C)c2ccco2)c2ccccc21 ZINC000453309560 338822253 /nfs/dbraw/zinc/82/22/53/338822253.db2.gz NLAZPHPSJHAGJE-HNNXBMFYSA-N 1 2 311.429 4.526 20 0 DJADLO CCCc1ncc(C[NH2+][C@H](C)c2cccc(Cl)c2Cl)o1 ZINC000453355309 338830501 /nfs/dbraw/zinc/83/05/01/338830501.db2.gz CXLZNAOPSNSTCV-SNVBAGLBSA-N 1 2 313.228 4.785 20 0 DJADLO C[C@@H]([NH2+]Cc1cnc(C2CC2)o1)c1cc(Cl)sc1Cl ZINC000453379556 338835044 /nfs/dbraw/zinc/83/50/44/338835044.db2.gz YVDZSCXSEBXZCB-SSDOTTSWSA-N 1 2 317.241 4.771 20 0 DJADLO Cc1cccnc1[C@H]1CCC[C@@H]([NH2+][C@@H](C(C)C)C(F)(F)F)C1 ZINC000467352308 338882677 /nfs/dbraw/zinc/88/26/77/338882677.db2.gz GDWBIKFOZPVITL-LZWOXQAQSA-N 1 2 314.395 4.593 20 0 DJADLO Cc1ccc([C@@H](NC(=O)Nc2c(C)cc(C)[nH+]c2C)C2CC2)cc1 ZINC000455481743 338895916 /nfs/dbraw/zinc/89/59/16/338895916.db2.gz OZWPLJUQEUEGPD-LJQANCHMSA-N 1 2 323.440 4.588 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC2(CCCCC2)[C@H]1C(C)C ZINC000459549612 339035145 /nfs/dbraw/zinc/03/51/45/339035145.db2.gz FHYNLJSTQWPZAE-QGZVFWFLSA-N 1 2 315.461 4.521 20 0 DJADLO c1nc(C[N@@H+]2CC3(CCCC3)[C@H]2c2ccccc2)oc1C1CC1 ZINC000459591035 339037659 /nfs/dbraw/zinc/03/76/59/339037659.db2.gz ZJDNUWLSNUKBND-LJQANCHMSA-N 1 2 308.425 4.669 20 0 DJADLO c1nc(C[N@H+]2CC3(CCCC3)[C@H]2c2ccccc2)oc1C1CC1 ZINC000459591035 339037660 /nfs/dbraw/zinc/03/76/60/339037660.db2.gz ZJDNUWLSNUKBND-LJQANCHMSA-N 1 2 308.425 4.669 20 0 DJADLO C[C@@H](c1csnn1)[N@@H+]1CC2(CCCCC2)[C@H]1c1ccccc1 ZINC000459752894 339046258 /nfs/dbraw/zinc/04/62/58/339046258.db2.gz RDYUCPFCSXSQIT-WMLDXEAASA-N 1 2 313.470 4.607 20 0 DJADLO C[C@@H](c1csnn1)[N@H+]1CC2(CCCCC2)[C@H]1c1ccccc1 ZINC000459752894 339046259 /nfs/dbraw/zinc/04/62/59/339046259.db2.gz RDYUCPFCSXSQIT-WMLDXEAASA-N 1 2 313.470 4.607 20 0 DJADLO Cc1[nH+]c2ccccc2n1CCCCCSCCCCF ZINC000461249083 339060851 /nfs/dbraw/zinc/06/08/51/339060851.db2.gz PRJKRCYJESGUBE-UHFFFAOYSA-N 1 2 308.466 4.998 20 0 DJADLO Cc1ccc(NC(=O)N2CC[C@H](C)C3(CCCCC3)C2)c(C)[nH+]1 ZINC000462282895 339075306 /nfs/dbraw/zinc/07/53/06/339075306.db2.gz XZCJVVAPMTYHOI-AWEZNQCLSA-N 1 2 315.461 4.523 20 0 DJADLO Cc1noc([C@H](C)[NH2+]Cc2ccc(-c3cc(C)cc(C)c3)cc2)n1 ZINC000462751450 339086920 /nfs/dbraw/zinc/08/69/20/339086920.db2.gz XRVYOTJWEPGPOH-HNNXBMFYSA-N 1 2 321.424 4.513 20 0 DJADLO CC[C@H](C)Oc1cc(C)ccc1C[NH2+][C@H](C)c1csc(C)n1 ZINC000462810351 339090818 /nfs/dbraw/zinc/09/08/18/339090818.db2.gz HXEQFIMFFNCOTM-UONOGXRCSA-N 1 2 318.486 4.788 20 0 DJADLO Cc1ccsc1[C@H](Cc1ccccc1)Nc1cc[nH+]c(C)n1 ZINC000462853861 339094367 /nfs/dbraw/zinc/09/43/67/339094367.db2.gz QRXWIPLSUAUILN-INIZCTEOSA-N 1 2 309.438 4.551 20 0 DJADLO C[C@@H]([NH2+][C@@H]1CCOc2c(F)ccc(F)c21)c1ccccc1Cl ZINC000462955260 339098964 /nfs/dbraw/zinc/09/89/64/339098964.db2.gz IMPBRHMANGSBSE-MEBBXXQBSA-N 1 2 323.770 4.793 20 0 DJADLO Cc1[nH+]cn(-c2ccc(N[C@@H](C)CCC(F)(F)F)cc2)c1C ZINC000463030771 339101860 /nfs/dbraw/zinc/10/18/60/339101860.db2.gz ADGGIUQAMMUOCI-NSHDSACASA-N 1 2 311.351 4.632 20 0 DJADLO Fc1cccc([C@@H]2CCC[N@@H+]2Cc2cncc(C(F)(F)F)c2)c1 ZINC000463074413 339104333 /nfs/dbraw/zinc/10/43/33/339104333.db2.gz RDWREMCJUBCAGU-INIZCTEOSA-N 1 2 324.321 4.577 20 0 DJADLO Fc1cccc([C@@H]2CCC[N@H+]2Cc2cncc(C(F)(F)F)c2)c1 ZINC000463074413 339104334 /nfs/dbraw/zinc/10/43/34/339104334.db2.gz RDWREMCJUBCAGU-INIZCTEOSA-N 1 2 324.321 4.577 20 0 DJADLO COc1ccccc1[C@H](C)SCc1[nH+]cc(C)c(OC)c1C ZINC000463190550 339108589 /nfs/dbraw/zinc/10/85/89/339108589.db2.gz DWEMJVJJPKMYCN-AWEZNQCLSA-N 1 2 317.454 4.710 20 0 DJADLO C[C@@H]1C[C@@H]1CC(=O)Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000463605013 339122673 /nfs/dbraw/zinc/12/26/73/339122673.db2.gz UVZTWWOAUQCJGG-VXGBXAGGSA-N 1 2 316.788 4.512 20 0 DJADLO CC(C)c1nc(C[N@@H+]2C[C@@H](C)C[C@@H]2c2ccccc2F)cs1 ZINC000464731971 339150376 /nfs/dbraw/zinc/15/03/76/339150376.db2.gz HRDZZARPJFGSCJ-SUMWQHHRSA-N 1 2 318.461 4.989 20 0 DJADLO CC(C)c1nc(C[N@H+]2C[C@@H](C)C[C@@H]2c2ccccc2F)cs1 ZINC000464731971 339150377 /nfs/dbraw/zinc/15/03/77/339150377.db2.gz HRDZZARPJFGSCJ-SUMWQHHRSA-N 1 2 318.461 4.989 20 0 DJADLO Cc1cnc(C[N@@H+](C)[C@@H](C)c2ccc(-c3ccccc3)cc2)o1 ZINC000464771912 339152415 /nfs/dbraw/zinc/15/24/15/339152415.db2.gz NJGKNHNWPBSGIC-INIZCTEOSA-N 1 2 306.409 4.843 20 0 DJADLO Cc1cnc(C[N@H+](C)[C@@H](C)c2ccc(-c3ccccc3)cc2)o1 ZINC000464771912 339152416 /nfs/dbraw/zinc/15/24/16/339152416.db2.gz NJGKNHNWPBSGIC-INIZCTEOSA-N 1 2 306.409 4.843 20 0 DJADLO CC(C)[N@H+](Cc1nc2cc(F)ccc2o1)Cc1ccccc1F ZINC000464865750 339159089 /nfs/dbraw/zinc/15/90/89/339159089.db2.gz LHSUBXGHLMZOKX-UHFFFAOYSA-N 1 2 316.351 4.517 20 0 DJADLO CC(C)[N@@H+](Cc1nc2cc(F)ccc2o1)Cc1ccccc1F ZINC000464865750 339159090 /nfs/dbraw/zinc/15/90/90/339159090.db2.gz LHSUBXGHLMZOKX-UHFFFAOYSA-N 1 2 316.351 4.517 20 0 DJADLO Cc1ccc([C@@H]2CCCC[N@@H+]2Cc2nc3ccc(F)cc3o2)o1 ZINC000466956936 339222693 /nfs/dbraw/zinc/22/26/93/339222693.db2.gz CQUKAZGWCWCGFZ-HNNXBMFYSA-N 1 2 314.360 4.596 20 0 DJADLO Cc1ccc([C@@H]2CCCC[N@H+]2Cc2nc3ccc(F)cc3o2)o1 ZINC000466956936 339222694 /nfs/dbraw/zinc/22/26/94/339222694.db2.gz CQUKAZGWCWCGFZ-HNNXBMFYSA-N 1 2 314.360 4.596 20 0 DJADLO COCc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(F)cc2Cl)o1 ZINC000467019418 339224861 /nfs/dbraw/zinc/22/48/61/339224861.db2.gz YDRXEFFMHJHXLN-MRXNPFEDSA-N 1 2 323.795 4.556 20 0 DJADLO COCc1ccc([C@H]2CCC[N@H+]2Cc2ccc(F)cc2Cl)o1 ZINC000467019418 339224862 /nfs/dbraw/zinc/22/48/62/339224862.db2.gz YDRXEFFMHJHXLN-MRXNPFEDSA-N 1 2 323.795 4.556 20 0 DJADLO O=C(Nc1cccc(-c2[nH]cc[nH+]2)c1)c1cccc(C2CCC2)c1 ZINC000467254651 339229007 /nfs/dbraw/zinc/22/90/07/339229007.db2.gz ROHYWYNEXJCPJT-UHFFFAOYSA-N 1 2 317.392 4.597 20 0 DJADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000470191422 339313516 /nfs/dbraw/zinc/31/35/16/339313516.db2.gz WHVRGXWSZYNVTO-BWACUDIHSA-N 1 2 323.408 4.549 20 0 DJADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000470191422 339313517 /nfs/dbraw/zinc/31/35/17/339313517.db2.gz WHVRGXWSZYNVTO-BWACUDIHSA-N 1 2 323.408 4.549 20 0 DJADLO C[C@@H](c1c(F)cccc1F)[N@@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000470191019 339313530 /nfs/dbraw/zinc/31/35/30/339313530.db2.gz RXDZTUFNNOBXQO-WQGACYEGSA-N 1 2 323.408 4.549 20 0 DJADLO C[C@@H](c1c(F)cccc1F)[N@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000470191019 339313531 /nfs/dbraw/zinc/31/35/31/339313531.db2.gz RXDZTUFNNOBXQO-WQGACYEGSA-N 1 2 323.408 4.549 20 0 DJADLO C[C@@H]1COC[C@H](c2ccccc2)[N@@H+]1Cc1cccc(C(F)F)c1 ZINC000470762093 339327139 /nfs/dbraw/zinc/32/71/39/339327139.db2.gz OPGFEDSJROAEJR-RDTXWAMCSA-N 1 2 317.379 4.586 20 0 DJADLO C[C@@H]1COC[C@H](c2ccccc2)[N@H+]1Cc1cccc(C(F)F)c1 ZINC000470762093 339327140 /nfs/dbraw/zinc/32/71/40/339327140.db2.gz OPGFEDSJROAEJR-RDTXWAMCSA-N 1 2 317.379 4.586 20 0 DJADLO FC(F)c1cccc(C[N@@H+]2CCc3[nH]c4ccccc4c3C2)c1 ZINC000470780931 339327998 /nfs/dbraw/zinc/32/79/98/339327998.db2.gz VNSVXDVBPYMJCR-UHFFFAOYSA-N 1 2 312.363 4.664 20 0 DJADLO FC(F)c1cccc(C[N@H+]2CCc3[nH]c4ccccc4c3C2)c1 ZINC000470780931 339327999 /nfs/dbraw/zinc/32/79/99/339327999.db2.gz VNSVXDVBPYMJCR-UHFFFAOYSA-N 1 2 312.363 4.664 20 0 DJADLO CC(C)CCc1nc(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@H]2C)cs1 ZINC000470960384 339333028 /nfs/dbraw/zinc/33/30/28/339333028.db2.gz RTKSSGAAEVVPGO-DGCLKSJQSA-N 1 2 320.424 4.504 20 0 DJADLO CC(C)CCc1nc(C[N@H+]2CC[C@@H](C(F)(F)F)[C@H]2C)cs1 ZINC000470960384 339333029 /nfs/dbraw/zinc/33/30/29/339333029.db2.gz RTKSSGAAEVVPGO-DGCLKSJQSA-N 1 2 320.424 4.504 20 0 DJADLO Cc1ccc([C@H]([NH2+]Cc2c(F)cccc2F)c2ccccn2)cc1 ZINC000471064275 339336205 /nfs/dbraw/zinc/33/62/05/339336205.db2.gz CGSPCCVLKPBKMZ-FQEVSTJZSA-N 1 2 324.374 4.547 20 0 DJADLO c1sc(-c2ccccc2)nc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000471181493 339339769 /nfs/dbraw/zinc/33/97/69/339339769.db2.gz MKNMNUQMJKGDMR-SFHVURJKSA-N 1 2 306.434 4.757 20 0 DJADLO c1sc(-c2ccccc2)nc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000471181493 339339770 /nfs/dbraw/zinc/33/97/70/339339770.db2.gz MKNMNUQMJKGDMR-SFHVURJKSA-N 1 2 306.434 4.757 20 0 DJADLO c1sc(-c2ccccc2)nc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000471181492 339339778 /nfs/dbraw/zinc/33/97/78/339339778.db2.gz MKNMNUQMJKGDMR-GOSISDBHSA-N 1 2 306.434 4.757 20 0 DJADLO c1sc(-c2ccccc2)nc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000471181492 339339779 /nfs/dbraw/zinc/33/97/79/339339779.db2.gz MKNMNUQMJKGDMR-GOSISDBHSA-N 1 2 306.434 4.757 20 0 DJADLO Clc1cccc([C@@H]2CCC[N@@H+]2Cc2ccncc2Cl)c1 ZINC000472435654 339371741 /nfs/dbraw/zinc/37/17/41/339371741.db2.gz YGNLRQNXCZIVCC-INIZCTEOSA-N 1 2 307.224 4.726 20 0 DJADLO Clc1cccc([C@@H]2CCC[N@H+]2Cc2ccncc2Cl)c1 ZINC000472435654 339371742 /nfs/dbraw/zinc/37/17/42/339371742.db2.gz YGNLRQNXCZIVCC-INIZCTEOSA-N 1 2 307.224 4.726 20 0 DJADLO COc1c2ccccc2oc1C[NH2+][C@@H](C)c1ccc(F)cc1F ZINC000473784500 339391888 /nfs/dbraw/zinc/39/18/88/339391888.db2.gz GUMHEYAQYDTVLL-NSHDSACASA-N 1 2 317.335 4.570 20 0 DJADLO COc1c2ccccc2oc1C[NH2+][C@@H](C)c1cccc(F)c1F ZINC000474048633 339399039 /nfs/dbraw/zinc/39/90/39/339399039.db2.gz SLCNYKMZGSDNCD-NSHDSACASA-N 1 2 317.335 4.570 20 0 DJADLO Cc1ccc(CCCNc2ccc(CC(F)(F)F)cc2)c[nH+]1 ZINC000474387166 339412013 /nfs/dbraw/zinc/41/20/13/339412013.db2.gz ZTWUVJGKCGEULV-UHFFFAOYSA-N 1 2 308.347 4.540 20 0 DJADLO CCc1cccc(F)c1C[NH2+]Cc1cc(C(CC)CC)no1 ZINC000474805653 339427203 /nfs/dbraw/zinc/42/72/03/339427203.db2.gz CDIMAKAXDJXYRW-UHFFFAOYSA-N 1 2 304.409 4.570 20 0 DJADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@H](C)CC1CCCC1 ZINC000477978966 339506591 /nfs/dbraw/zinc/50/65/91/339506591.db2.gz YCISEYWKTOUVGQ-CQSZACIVSA-N 1 2 311.429 4.540 20 0 DJADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)C1CCC(C)(C)CC1 ZINC000477979050 339506637 /nfs/dbraw/zinc/50/66/37/339506637.db2.gz APROAAPYMUOFOI-UHFFFAOYSA-N 1 2 311.429 4.540 20 0 DJADLO CC[C@H]1CCCC[C@@H]1C(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C ZINC000477996193 339506838 /nfs/dbraw/zinc/50/68/38/339506838.db2.gz CGBCRNHNEAPEOC-HOCLYGCPSA-N 1 2 311.429 4.540 20 0 DJADLO Cc1cc(NCc2cn3cc(Cl)ccc3[nH+]2)ccc1C1CC1 ZINC000478301131 339513029 /nfs/dbraw/zinc/51/30/29/339513029.db2.gz GWZJLXGLFBMCHI-UHFFFAOYSA-N 1 2 311.816 4.786 20 0 DJADLO Cc1ccc(CSc2nc3ccc(Cl)cc3o2)c(C)[nH+]1 ZINC000478943190 339525117 /nfs/dbraw/zinc/52/51/17/339525117.db2.gz HNFXJRZXJJJUQL-UHFFFAOYSA-N 1 2 304.802 4.785 20 0 DJADLO Cc1ccc(C2CCN(c3nc4cccc(C)c4s3)CC2)c[nH+]1 ZINC000480110071 339559417 /nfs/dbraw/zinc/55/94/17/339559417.db2.gz AAIPHPSJMGHEKI-UHFFFAOYSA-N 1 2 323.465 4.692 20 0 DJADLO C[C@H](CCCC(F)(F)F)Nc1ccc(N2CCCCC2)c[nH+]1 ZINC000480177048 339562254 /nfs/dbraw/zinc/56/22/54/339562254.db2.gz ZJEVOFOIUUSMAF-CYBMUJFWSA-N 1 2 315.383 4.605 20 0 DJADLO CC(C)c1cc(N2CC[C@@H](C(F)(F)F)[C@@H]2C)nc(C(C)C)[nH+]1 ZINC000480558410 339577407 /nfs/dbraw/zinc/57/74/07/339577407.db2.gz UFKMWKQDGKQGBY-NWDGAFQWSA-N 1 2 315.383 4.501 20 0 DJADLO Cc1ccc(NC(=O)CCc2cc(Cl)cc(Cl)c2)c(C)[nH+]1 ZINC000481872959 339615644 /nfs/dbraw/zinc/61/56/44/339615644.db2.gz JIJQPHVQLZUDJD-UHFFFAOYSA-N 1 2 323.223 4.577 20 0 DJADLO CC(C)c1ccc(NC(=O)c2ccc3[nH+]ccn3c2)c(C(C)C)c1 ZINC000483041320 339650357 /nfs/dbraw/zinc/65/03/57/339650357.db2.gz NVPNINLYFRYGNU-UHFFFAOYSA-N 1 2 321.424 4.833 20 0 DJADLO Cc1cc(C)c(NC(=O)c2ccc(F)c3ccccc23)c(C)[nH+]1 ZINC000483191223 339655868 /nfs/dbraw/zinc/65/58/68/339655868.db2.gz DLWRNYLLXAYLBS-UHFFFAOYSA-N 1 2 308.356 4.551 20 0 DJADLO CC[C@H]([NH2+][C@H](C)c1c(F)cccc1OC)c1cc(F)ccc1F ZINC000483728474 339673032 /nfs/dbraw/zinc/67/30/32/339673032.db2.gz PTJFDRGEDHRSDZ-BZNIZROVSA-N 1 2 323.358 4.914 20 0 DJADLO Cc1cc(NC(=O)[C@@H]2CC[C@@H](C)C2)ccc1Oc1cc[nH+]cc1 ZINC000487705414 339761405 /nfs/dbraw/zinc/76/14/05/339761405.db2.gz WTWRBQXLBUPXJM-UKRRQHHQSA-N 1 2 310.397 4.557 20 0 DJADLO Cc1cc(NC(=O)c2cccc(F)c2)ccc1Oc1cc[nH+]cc1 ZINC000487704146 339761434 /nfs/dbraw/zinc/76/14/34/339761434.db2.gz VMJOZILPEHNMRW-UHFFFAOYSA-N 1 2 322.339 4.574 20 0 DJADLO Fc1ccc(C2=CC[C@@H]([NH2+][C@H](C3CC3)C(F)(F)F)CC2)cc1 ZINC000489762281 339817850 /nfs/dbraw/zinc/81/78/50/339817850.db2.gz CPPUDFCEIYJMHE-HZPDHXFCSA-N 1 2 313.338 4.692 20 0 DJADLO CC[C@H]([NH2+][C@H](COCC(C)C)c1ccco1)c1ccccc1F ZINC000490190553 339828331 /nfs/dbraw/zinc/82/83/31/339828331.db2.gz JUHMEFKGOKDCHC-ZWKOTPCHSA-N 1 2 319.420 4.873 20 0 DJADLO CCc1cccc(NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)c1 ZINC000494678588 339957527 /nfs/dbraw/zinc/95/75/27/339957527.db2.gz FOFUXZRLAZJOTP-UHFFFAOYSA-N 1 2 318.376 4.689 20 0 DJADLO Cc1cc(N[C@@H](c2cccc(C(F)(F)F)c2)C(C)C)nc[nH+]1 ZINC000495314740 339980599 /nfs/dbraw/zinc/98/05/99/339980599.db2.gz NPEBDJAHWOMERV-OAHLLOKOSA-N 1 2 309.335 4.613 20 0 DJADLO CC(C)c1cc(Nc2cccc(Oc3cc[nH+]cc3)c2)ncn1 ZINC000495369997 339981798 /nfs/dbraw/zinc/98/17/98/339981798.db2.gz ZAJLTGMMCUXXEE-UHFFFAOYSA-N 1 2 306.369 4.531 20 0 DJADLO CC(C)c1nc(N(C)[C@@H](C)c2cccc(C(F)(F)F)c2)cc[nH+]1 ZINC000498961407 340027073 /nfs/dbraw/zinc/02/70/73/340027073.db2.gz WHSNJWBRMNBMPI-LBPRGKRZSA-N 1 2 323.362 4.816 20 0 DJADLO Oc1cccc(C[N@@H+](Cc2c(F)cccc2Cl)CC2CC2)c1 ZINC000499021249 340027839 /nfs/dbraw/zinc/02/78/39/340027839.db2.gz MBAOORRBWTWHHP-UHFFFAOYSA-N 1 2 319.807 4.597 20 0 DJADLO Oc1cccc(C[N@H+](Cc2c(F)cccc2Cl)CC2CC2)c1 ZINC000499021249 340027840 /nfs/dbraw/zinc/02/78/40/340027840.db2.gz MBAOORRBWTWHHP-UHFFFAOYSA-N 1 2 319.807 4.597 20 0 DJADLO CCCCn1cc[nH+]c1-c1cccc(N[C@@H](C)COC(C)C)c1 ZINC000500369180 340055758 /nfs/dbraw/zinc/05/57/58/340055758.db2.gz NLXPCVZIZYVNNB-INIZCTEOSA-N 1 2 315.461 4.576 20 0 DJADLO Cc1cnc([C@H](C)[NH2+]Cc2ccc(-c3ccccc3)cc2F)o1 ZINC000500400700 340056937 /nfs/dbraw/zinc/05/69/37/340056937.db2.gz HCYUEAUZRWPLGC-AWEZNQCLSA-N 1 2 310.372 4.640 20 0 DJADLO Cc1cc([C@H](C)[NH2+]Cc2cccc(Oc3ccccc3)c2)no1 ZINC000500508335 340061244 /nfs/dbraw/zinc/06/12/44/340061244.db2.gz NVRWAHJXXYNJTO-HNNXBMFYSA-N 1 2 308.381 4.626 20 0 DJADLO Cc1ccc([C@@H]([NH2+]Cc2nccn2C(C)C)c2ccccc2)cc1 ZINC000501327725 340078580 /nfs/dbraw/zinc/07/85/80/340078580.db2.gz BOZVIFSNGFCBSU-NRFANRHFSA-N 1 2 319.452 4.652 20 0 DJADLO CC(C)[C@H]([NH2+][C@H](C)c1nc(C(C)(C)C)no1)c1ccc(F)cc1 ZINC000502483947 340105631 /nfs/dbraw/zinc/10/56/31/340105631.db2.gz FDMFBKGZDQTQMZ-DOMZBBRYSA-N 1 2 319.424 4.554 20 0 DJADLO Cc1cc([C@H](C)[NH2+]Cc2ccccc2Oc2ccccc2)no1 ZINC000503262249 340124206 /nfs/dbraw/zinc/12/42/06/340124206.db2.gz QTKWKBIDUUHVJK-HNNXBMFYSA-N 1 2 308.381 4.626 20 0 DJADLO C[C@@H]1C[C@@]1([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccc(Cl)cc1 ZINC000503413025 340127626 /nfs/dbraw/zinc/12/76/26/340127626.db2.gz QYYWXJQWBPUISS-XIKOKIGWSA-N 1 2 318.848 4.650 20 0 DJADLO C[C@@H]([NH2+]C1(C(F)F)CC1)c1cccc(OCc2ccccc2)c1 ZINC000503919999 340136906 /nfs/dbraw/zinc/13/69/06/340136906.db2.gz JKTOTHAFGQLPFG-CQSZACIVSA-N 1 2 317.379 4.714 20 0 DJADLO C[C@H]([NH2+]C1(C(F)F)CC1)c1ccc(OCc2ccccc2)cc1 ZINC000503945491 340138085 /nfs/dbraw/zinc/13/80/85/340138085.db2.gz GZXVHCAYSZEJDO-AWEZNQCLSA-N 1 2 317.379 4.714 20 0 DJADLO CC(C)(C)Oc1cc[nH+]cc1NC(=O)CC/C=C/c1ccccc1 ZINC000504678879 340150902 /nfs/dbraw/zinc/15/09/02/340150902.db2.gz XSIIUCHGPLUREA-YRNVUSSQSA-N 1 2 324.424 4.691 20 0 DJADLO C[N@H+](Cc1nc(-c2ccccc2)cs1)Cc1ccccc1F ZINC000505642261 340174111 /nfs/dbraw/zinc/17/41/11/340174111.db2.gz WIMCSFSUKFRFHK-UHFFFAOYSA-N 1 2 312.413 4.581 20 0 DJADLO C[N@@H+](Cc1nc(-c2ccccc2)cs1)Cc1ccccc1F ZINC000505642261 340174112 /nfs/dbraw/zinc/17/41/12/340174112.db2.gz WIMCSFSUKFRFHK-UHFFFAOYSA-N 1 2 312.413 4.581 20 0 DJADLO C[C@@H]1C[C@@H]1c1ccc(C[NH+](Cc2ccco2)Cc2ccco2)o1 ZINC000506085937 340185138 /nfs/dbraw/zinc/18/51/38/340185138.db2.gz LFSRDQSAAPWLFF-KDOFPFPSSA-N 1 2 311.381 4.791 20 0 DJADLO CC(C)c1nc(C[N@@H+]2CCSC[C@H]2c2ccccc2)cs1 ZINC000506478204 340195479 /nfs/dbraw/zinc/19/54/79/340195479.db2.gz SKIIBMNEARVTHS-INIZCTEOSA-N 1 2 318.511 4.557 20 0 DJADLO CC(C)c1nc(C[N@H+]2CCSC[C@H]2c2ccccc2)cs1 ZINC000506478204 340195480 /nfs/dbraw/zinc/19/54/80/340195480.db2.gz SKIIBMNEARVTHS-INIZCTEOSA-N 1 2 318.511 4.557 20 0 DJADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2ncccc2C(F)(F)F)cc1 ZINC000506634375 340198215 /nfs/dbraw/zinc/19/82/15/340198215.db2.gz SBSSKYMZXNUFHX-MRXNPFEDSA-N 1 2 324.321 4.577 20 0 DJADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2ncccc2C(F)(F)F)cc1 ZINC000506634375 340198216 /nfs/dbraw/zinc/19/82/16/340198216.db2.gz SBSSKYMZXNUFHX-MRXNPFEDSA-N 1 2 324.321 4.577 20 0 DJADLO C[C@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000506673150 340199258 /nfs/dbraw/zinc/19/92/58/340199258.db2.gz FQFRLIWXBSVKBM-LLVKDONJSA-N 1 2 324.440 4.912 20 0 DJADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000506673150 340199259 /nfs/dbraw/zinc/19/92/59/340199259.db2.gz FQFRLIWXBSVKBM-LLVKDONJSA-N 1 2 324.440 4.912 20 0 DJADLO Cc1nn(C(C)(C)C)c(C)c1C[N@@H+](C)Cc1ccccc1Cl ZINC000506748000 340200813 /nfs/dbraw/zinc/20/08/13/340200813.db2.gz QBUCUVVLDBAROL-UHFFFAOYSA-N 1 2 319.880 4.540 20 0 DJADLO Cc1nn(C(C)(C)C)c(C)c1C[N@H+](C)Cc1ccccc1Cl ZINC000506748000 340200814 /nfs/dbraw/zinc/20/08/14/340200814.db2.gz QBUCUVVLDBAROL-UHFFFAOYSA-N 1 2 319.880 4.540 20 0 DJADLO CCc1cccc2c1OCC[C@@H]2Nc1ccc2ccccc2[nH+]1 ZINC000506754677 340200917 /nfs/dbraw/zinc/20/09/17/340200917.db2.gz QHNIFBNRRCUSSI-SFHVURJKSA-N 1 2 304.393 4.733 20 0 DJADLO CCc1ncc(C[N@H+](C)Cc2cccc(Cl)c2Cl)s1 ZINC000506806334 340202047 /nfs/dbraw/zinc/20/20/47/340202047.db2.gz MVTZCKIXAWGBHP-UHFFFAOYSA-N 1 2 315.269 4.644 20 0 DJADLO CCc1ncc(C[N@@H+](C)Cc2cccc(Cl)c2Cl)s1 ZINC000506806334 340202048 /nfs/dbraw/zinc/20/20/48/340202048.db2.gz MVTZCKIXAWGBHP-UHFFFAOYSA-N 1 2 315.269 4.644 20 0 DJADLO CSCc1cnc(C[N@H+]([C@H](C)c2ccccc2)C2CC2)s1 ZINC000507158771 340210031 /nfs/dbraw/zinc/21/00/31/340210031.db2.gz FNRYWIICYNRJBY-CYBMUJFWSA-N 1 2 318.511 4.732 20 0 DJADLO CSCc1cnc(C[N@@H+]([C@H](C)c2ccccc2)C2CC2)s1 ZINC000507158771 340210032 /nfs/dbraw/zinc/21/00/32/340210032.db2.gz FNRYWIICYNRJBY-CYBMUJFWSA-N 1 2 318.511 4.732 20 0 DJADLO Cc1ncsc1C[N@@H+](C)[C@@H](C)c1cc(Cl)ccc1Cl ZINC000507221186 340214302 /nfs/dbraw/zinc/21/43/02/340214302.db2.gz GLVAYANDLNDXFY-JTQLQIEISA-N 1 2 315.269 4.951 20 0 DJADLO Cc1ncsc1C[N@H+](C)[C@@H](C)c1cc(Cl)ccc1Cl ZINC000507221186 340214303 /nfs/dbraw/zinc/21/43/03/340214303.db2.gz GLVAYANDLNDXFY-JTQLQIEISA-N 1 2 315.269 4.951 20 0 DJADLO CCCCc1noc([C@@H](C)[NH2+][C@H](C)c2ccc(SC)cc2)n1 ZINC000507465440 340220882 /nfs/dbraw/zinc/22/08/82/340220882.db2.gz AUNQESOHHQSRMG-CHWSQXEVSA-N 1 2 319.474 4.546 20 0 DJADLO CSc1ccc([C@@H](C)[NH2+][C@H](C)c2nc(C(C)(C)C)no2)cc1 ZINC000507511724 340223522 /nfs/dbraw/zinc/22/35/22/340223522.db2.gz OLKAJJKQGADYCB-VXGBXAGGSA-N 1 2 319.474 4.501 20 0 DJADLO Cc1cc2[nH+]cn([C@H](C)c3nc(C(F)F)cs3)c2cc1C ZINC000507708530 340229122 /nfs/dbraw/zinc/22/91/22/340229122.db2.gz OETOKQLJCQTQFL-SNVBAGLBSA-N 1 2 307.369 4.657 20 0 DJADLO Cc1cc(C[N@@H+]2CCO[C@@H](c3ccccc3Cl)C2)c(C)s1 ZINC000507765756 340230499 /nfs/dbraw/zinc/23/04/99/340230499.db2.gz HBDRYXLZJSOZJS-QGZVFWFLSA-N 1 2 321.873 4.592 20 0 DJADLO Cc1cc(C[N@H+]2CCO[C@@H](c3ccccc3Cl)C2)c(C)s1 ZINC000507765756 340230500 /nfs/dbraw/zinc/23/05/00/340230500.db2.gz HBDRYXLZJSOZJS-QGZVFWFLSA-N 1 2 321.873 4.592 20 0 DJADLO Clc1cccc(C[N@@H+]2CCO[C@H](c3ccccc3Cl)C2)c1 ZINC000507803564 340232028 /nfs/dbraw/zinc/23/20/28/340232028.db2.gz ANMZVLCWMZKZKC-KRWDZBQOSA-N 1 2 322.235 4.567 20 0 DJADLO Clc1cccc(C[N@H+]2CCO[C@H](c3ccccc3Cl)C2)c1 ZINC000507803564 340232029 /nfs/dbraw/zinc/23/20/29/340232029.db2.gz ANMZVLCWMZKZKC-KRWDZBQOSA-N 1 2 322.235 4.567 20 0 DJADLO C[C@H]([NH2+][C@H]1CCc2c1c(F)ccc2F)c1c(F)cccc1F ZINC000507850442 340233961 /nfs/dbraw/zinc/23/39/61/340233961.db2.gz GYVKBGGOVPYKLG-VFZGTOFNSA-N 1 2 309.306 4.581 20 0 DJADLO C[C@H](c1ccccc1F)[N@@H+]1CCO[C@@H](c2ccccc2Cl)C1 ZINC000507860194 340234407 /nfs/dbraw/zinc/23/44/07/340234407.db2.gz ONEMIULQEMUXBJ-FZKQIMNGSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@H](c1ccccc1F)[N@H+]1CCO[C@@H](c2ccccc2Cl)C1 ZINC000507860194 340234408 /nfs/dbraw/zinc/23/44/08/340234408.db2.gz ONEMIULQEMUXBJ-FZKQIMNGSA-N 1 2 319.807 4.614 20 0 DJADLO CC(C)CCOc1ccccc1C[NH2+]Cc1c(F)cccc1F ZINC000508046983 340238194 /nfs/dbraw/zinc/23/81/94/340238194.db2.gz MAXVUCHABZVZBW-UHFFFAOYSA-N 1 2 319.395 4.680 20 0 DJADLO CCC[N@H+](Cc1csc(CC)n1)[C@H](C)c1ccccc1OC ZINC000508625243 340248602 /nfs/dbraw/zinc/24/86/02/340248602.db2.gz KHIAHOUBFYKWBK-CQSZACIVSA-N 1 2 318.486 4.687 20 0 DJADLO CCC[N@@H+](Cc1csc(CC)n1)[C@H](C)c1ccccc1OC ZINC000508625243 340248603 /nfs/dbraw/zinc/24/86/03/340248603.db2.gz KHIAHOUBFYKWBK-CQSZACIVSA-N 1 2 318.486 4.687 20 0 DJADLO CN(C(=O)c1ccccc1Oc1cc[nH+]cc1)C1CCCCCC1 ZINC000509131673 340261921 /nfs/dbraw/zinc/26/19/21/340261921.db2.gz IHNAIIYAOCRZDV-UHFFFAOYSA-N 1 2 324.424 4.669 20 0 DJADLO Cc1cc(NC(=O)C(C)(C)C2CC2)ccc1Oc1cc[nH+]cc1 ZINC000509251509 340264543 /nfs/dbraw/zinc/26/45/43/340264543.db2.gz PBQDGEDNXLDGHH-UHFFFAOYSA-N 1 2 310.397 4.557 20 0 DJADLO Cc1ccc(-c2csc(C[N@H+](C)Cc3cccs3)n2)cc1 ZINC000509292760 340265441 /nfs/dbraw/zinc/26/54/41/340265441.db2.gz BWEDFEWEWAMHRJ-UHFFFAOYSA-N 1 2 314.479 4.812 20 0 DJADLO Cc1ccc(-c2csc(C[N@@H+](C)Cc3cccs3)n2)cc1 ZINC000509292760 340265442 /nfs/dbraw/zinc/26/54/42/340265442.db2.gz BWEDFEWEWAMHRJ-UHFFFAOYSA-N 1 2 314.479 4.812 20 0 DJADLO C[C@H]1CCC[C@H](C)N(C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000509936036 340283228 /nfs/dbraw/zinc/28/32/28/340283228.db2.gz ZVYPKYSJIBFFKE-HOTGVXAUSA-N 1 2 324.424 4.525 20 0 DJADLO C[C@@H]1CCC[C@@H](C)N(C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000509936037 340283238 /nfs/dbraw/zinc/28/32/38/340283238.db2.gz ZVYPKYSJIBFFKE-HZPDHXFCSA-N 1 2 324.424 4.525 20 0 DJADLO CC[C@H]1CCC[C@H](NC(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000509949487 340283566 /nfs/dbraw/zinc/28/35/66/340283566.db2.gz QMOXCNXYSHHALV-HOTGVXAUSA-N 1 2 324.424 4.573 20 0 DJADLO COc1c(C)c[nH+]c(CSc2ccnc3ccccc32)c1C ZINC000509955564 340283862 /nfs/dbraw/zinc/28/38/62/340283862.db2.gz XCSFTALKHMATKF-UHFFFAOYSA-N 1 2 310.422 4.548 20 0 DJADLO Cc1c(F)cccc1NC(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000510111904 340289151 /nfs/dbraw/zinc/28/91/51/340289151.db2.gz GAADRIFLAYYLJR-UHFFFAOYSA-N 1 2 322.339 4.574 20 0 DJADLO CC(C)(C)c1ccc(C(=O)Nc2ccc(-c3[nH]cc[nH+]3)cc2)cc1 ZINC000303084095 340301004 /nfs/dbraw/zinc/30/10/04/340301004.db2.gz FUBGKYWGLOBRCI-UHFFFAOYSA-N 1 2 319.408 4.627 20 0 DJADLO Cc1cc([C@@H](C)[NH2+]Cc2ccsc2Br)oc1C ZINC000510926891 340315002 /nfs/dbraw/zinc/31/50/02/340315002.db2.gz FWNUOPADWGSYPX-SECBINFHSA-N 1 2 314.248 4.571 20 0 DJADLO C[C@H](c1nc2ccccc2o1)[N@@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000511546258 340330213 /nfs/dbraw/zinc/33/02/13/340330213.db2.gz PHYFUNDXMKIXFL-MLGOLLRUSA-N 1 2 312.800 4.989 20 0 DJADLO C[C@H](c1nc2ccccc2o1)[N@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000511546258 340330214 /nfs/dbraw/zinc/33/02/14/340330214.db2.gz PHYFUNDXMKIXFL-MLGOLLRUSA-N 1 2 312.800 4.989 20 0 DJADLO COc1c(C)c[nH+]c(COc2c(Cl)cccc2Cl)c1C ZINC000303608614 340337188 /nfs/dbraw/zinc/33/71/88/340337188.db2.gz YOOIUXCWQOQOPS-UHFFFAOYSA-N 1 2 312.196 4.593 20 0 DJADLO Cc1ccc(-c2nc(C[N@@H+]([C@H](C)c3ccco3)C3CC3)co2)cc1 ZINC000511780437 340338208 /nfs/dbraw/zinc/33/82/08/340338208.db2.gz HSACITLPPCQUCD-OAHLLOKOSA-N 1 2 322.408 4.969 20 0 DJADLO Cc1ccc(-c2nc(C[N@H+]([C@H](C)c3ccco3)C3CC3)co2)cc1 ZINC000511780437 340338209 /nfs/dbraw/zinc/33/82/09/340338209.db2.gz HSACITLPPCQUCD-OAHLLOKOSA-N 1 2 322.408 4.969 20 0 DJADLO Cc1[nH]ncc1C[N@@H+]([C@H](C)c1ccc2ccccc2c1)C1CC1 ZINC000511793817 340338532 /nfs/dbraw/zinc/33/85/32/340338532.db2.gz RGDWMCFDJYYONG-OAHLLOKOSA-N 1 2 305.425 4.597 20 0 DJADLO Cc1[nH]ncc1C[N@H+]([C@H](C)c1ccc2ccccc2c1)C1CC1 ZINC000511793817 340338533 /nfs/dbraw/zinc/33/85/33/340338533.db2.gz RGDWMCFDJYYONG-OAHLLOKOSA-N 1 2 305.425 4.597 20 0 DJADLO C[C@H]([NH2+]Cc1cc(Cl)ccc1Cl)c1c(F)cncc1F ZINC000513046147 340390472 /nfs/dbraw/zinc/39/04/72/340390472.db2.gz JPXZZDMEGNQXCV-QMMMGPOBSA-N 1 2 317.166 4.517 20 0 DJADLO CC(C)n1cc(C[NH+]2Cc3ccccc3-c3ccccc3C2)cn1 ZINC000513153088 340395289 /nfs/dbraw/zinc/39/52/89/340395289.db2.gz IAEXYGSIBWQKPE-UHFFFAOYSA-N 1 2 317.436 4.647 20 0 DJADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2c(Cl)cccc2Cl)o1 ZINC000517543189 340471576 /nfs/dbraw/zinc/47/15/76/340471576.db2.gz WMMXNESUWKBVFX-ZYHUDNBSSA-N 1 2 310.224 5.000 20 0 DJADLO Cc1cncc([C@@H](C)Nc2cccc([NH+]3CCCCCC3)c2)c1 ZINC000184475028 340493219 /nfs/dbraw/zinc/49/32/19/340493219.db2.gz ACUMCYSCMYSLRI-QGZVFWFLSA-N 1 2 309.457 4.944 20 0 DJADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1csc(C2CC2)n1 ZINC000191677448 340557437 /nfs/dbraw/zinc/55/74/37/340557437.db2.gz QQLWHJBYYFMAFN-GFCCVEGCSA-N 1 2 312.438 4.926 20 0 DJADLO COc1ccccc1[C@H]([NH2+]Cc1ccccc1F)c1ccccc1 ZINC000237285269 340669656 /nfs/dbraw/zinc/66/96/56/340669656.db2.gz AQQIFJJRYNOGTA-OAQYLSRUSA-N 1 2 321.395 4.714 20 0 DJADLO Clc1ccccc1C[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC000237883381 340674803 /nfs/dbraw/zinc/67/48/03/340674803.db2.gz HNVXNWLICNJLTC-LJQANCHMSA-N 1 2 308.812 4.614 20 0 DJADLO Cc1ncc(C[NH2+][C@H](C)c2ccc(Cl)c(Cl)c2Cl)o1 ZINC000397966418 340715145 /nfs/dbraw/zinc/71/51/45/340715145.db2.gz YAHWJIQFENUWNH-SSDOTTSWSA-N 1 2 319.619 4.794 20 0 DJADLO CCCc1nc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@H](C)CC)no1 ZINC000538188834 340812556 /nfs/dbraw/zinc/81/25/56/340812556.db2.gz ZSQXEHIICIJQOV-PXAZEXFGSA-N 1 2 321.852 4.553 20 0 DJADLO Cc1ccc([C@@H](C)Nc2ccc(N3CCCCC3)c[nH+]2)s1 ZINC000538526979 340831487 /nfs/dbraw/zinc/83/14/87/340831487.db2.gz LDIKRWZWGGKRGD-CQSZACIVSA-N 1 2 301.459 4.615 20 0 DJADLO CC(C)(C)C[C@H]([NH2+]Cc1noc(C(C)(C)C)n1)c1ccccc1 ZINC000539281726 340879253 /nfs/dbraw/zinc/87/92/53/340879253.db2.gz VBLBXRFEGXKRDU-HNNXBMFYSA-N 1 2 315.461 4.634 20 0 DJADLO CC[C@@H](Nc1cccc([NH+]2CCCCCC2)c1)C1CCOCC1 ZINC000539740427 340898402 /nfs/dbraw/zinc/89/84/02/340898402.db2.gz NBFFUWPQRHQJSU-HXUWFJFHSA-N 1 2 316.489 4.684 20 0 DJADLO C[C@@H](Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)c1ccco1 ZINC000539741652 340898468 /nfs/dbraw/zinc/89/84/68/340898468.db2.gz RRUQGIIGTIOAOW-CQSZACIVSA-N 1 2 307.397 4.653 20 0 DJADLO CC(C)COC[C@@H]([NH2+][C@H](C)c1c(F)cccc1F)c1ccco1 ZINC000152613751 340960125 /nfs/dbraw/zinc/96/01/25/340960125.db2.gz HMSOFSKPDSDDAG-CZUORRHYSA-N 1 2 323.383 4.622 20 0 DJADLO O=C(Nc1ccccc1)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000069913993 340986310 /nfs/dbraw/zinc/98/63/10/340986310.db2.gz GTVFVVREQIXFHE-UHFFFAOYSA-N 1 2 305.337 4.518 20 0 DJADLO CCc1cnc(C[NH2+]C2(c3ccc(F)cc3F)CCCC2)s1 ZINC000542310621 341003989 /nfs/dbraw/zinc/00/39/89/341003989.db2.gz LBUDWBSHWNQQCU-UHFFFAOYSA-N 1 2 322.424 4.543 20 0 DJADLO CC(C)c1cnc(C[N@H+](C)[C@@H](C)c2ccc(F)c(F)c2)s1 ZINC000542466605 341008365 /nfs/dbraw/zinc/00/83/65/341008365.db2.gz XGSNQMRLTKWAIK-NSHDSACASA-N 1 2 310.413 4.738 20 0 DJADLO CC(C)c1cnc(C[N@@H+](C)[C@@H](C)c2ccc(F)c(F)c2)s1 ZINC000542466605 341008366 /nfs/dbraw/zinc/00/83/66/341008366.db2.gz XGSNQMRLTKWAIK-NSHDSACASA-N 1 2 310.413 4.738 20 0 DJADLO Cc1ccc(-c2nnc([C@H](C)[N@@H+]3Cc4ccccc4[C@H]3C)o2)cc1 ZINC000543061268 341029925 /nfs/dbraw/zinc/02/99/25/341029925.db2.gz RWAODLNWRJPGIH-CABCVRRESA-N 1 2 319.408 4.683 20 0 DJADLO Cc1ccc(-c2nnc([C@H](C)[N@H+]3Cc4ccccc4[C@H]3C)o2)cc1 ZINC000543061268 341029926 /nfs/dbraw/zinc/02/99/26/341029926.db2.gz RWAODLNWRJPGIH-CABCVRRESA-N 1 2 319.408 4.683 20 0 DJADLO CCc1c[nH+]ccc1[C@@H](C)[C@H](c1ccc(F)cc1)c1cnccn1 ZINC000543403842 341042621 /nfs/dbraw/zinc/04/26/21/341042621.db2.gz WGSVATSVMKPZLD-JLTOFOAXSA-N 1 2 321.399 4.509 20 0 DJADLO COc1ccc(C)cc1C[NH2+][C@H](C)c1ncc(-c2ccccc2)o1 ZINC000543498116 341047669 /nfs/dbraw/zinc/04/76/69/341047669.db2.gz VVEVOMYOIYHPCE-OAHLLOKOSA-N 1 2 322.408 4.509 20 0 DJADLO Cc1cccc2[nH+]cc(CNc3cccc(C(F)F)c3Cl)n21 ZINC000544596177 341087736 /nfs/dbraw/zinc/08/77/36/341087736.db2.gz PLXZGYGDCIWAHO-UHFFFAOYSA-N 1 2 321.758 4.846 20 0 DJADLO Cc1cc(NC(=O)c2occc2CSc2ccccc2)cc[nH+]1 ZINC000073070528 341112657 /nfs/dbraw/zinc/11/26/57/341112657.db2.gz TZPPNXCFHCGVNA-UHFFFAOYSA-N 1 2 324.405 4.528 20 0 DJADLO Cc1ccc(C[N@@H+](C)[C@H](C)c2nc3ccccc3n2C(F)F)o1 ZINC000073605888 341118942 /nfs/dbraw/zinc/11/89/42/341118942.db2.gz FLLOXXWJUNJTDY-GFCCVEGCSA-N 1 2 319.355 4.526 20 0 DJADLO Cc1ccc(C[N@H+](C)[C@H](C)c2nc3ccccc3n2C(F)F)o1 ZINC000073605888 341118943 /nfs/dbraw/zinc/11/89/43/341118943.db2.gz FLLOXXWJUNJTDY-GFCCVEGCSA-N 1 2 319.355 4.526 20 0 DJADLO Cc1cc(C[N@@H+]2CCCC[C@H]2c2cccc(C(F)(F)F)c2)on1 ZINC000545974539 341149138 /nfs/dbraw/zinc/14/91/38/341149138.db2.gz AZEOVRRWDKCZBW-INIZCTEOSA-N 1 2 324.346 4.729 20 0 DJADLO Cc1cc(C[N@H+]2CCCC[C@H]2c2cccc(C(F)(F)F)c2)on1 ZINC000545974539 341149139 /nfs/dbraw/zinc/14/91/39/341149139.db2.gz AZEOVRRWDKCZBW-INIZCTEOSA-N 1 2 324.346 4.729 20 0 DJADLO CCc1ccc(C[NH2+][C@H](C)c2nc(-c3ccccc3)cs2)o1 ZINC000133232494 341165226 /nfs/dbraw/zinc/16/52/26/341165226.db2.gz NNKLDDBVHJMUDA-CYBMUJFWSA-N 1 2 312.438 4.816 20 0 DJADLO Cc1nc([C@H]([NH2+][C@@H](C)CCC(C)C)c2ccc(Cl)cc2)no1 ZINC000546655907 341177376 /nfs/dbraw/zinc/17/73/76/341177376.db2.gz DCTVJKPJGNIHPM-BLLLJJGKSA-N 1 2 321.852 4.535 20 0 DJADLO CCOc1cc(C)ccc1C[NH2+][C@@H](C)c1c(F)cccc1F ZINC000237045164 341206333 /nfs/dbraw/zinc/20/63/33/341206333.db2.gz ANTFZORWBXLNCH-ZDUSSCGKSA-N 1 2 305.368 4.523 20 0 DJADLO CC(C)c1nc([C@@H](C)[NH2+][C@H]2CSc3ccccc32)cs1 ZINC000547398946 341211023 /nfs/dbraw/zinc/21/10/23/341211023.db2.gz GNQCJTLAFMEDIE-RISCZKNCSA-N 1 2 304.484 4.764 20 0 DJADLO CCO[C@@H](C)c1nc(C[NH2+][C@H](C)c2ccc(Cl)cc2)cs1 ZINC000076716265 341212884 /nfs/dbraw/zinc/21/28/84/341212884.db2.gz MSPUJANBRNUCIH-NEPJUHHUSA-N 1 2 324.877 4.745 20 0 DJADLO CC[C@](C)([NH2+]CC1CCC(C(F)(F)F)CC1)C(F)(F)F ZINC000547442268 341213856 /nfs/dbraw/zinc/21/38/56/341213856.db2.gz MBJRBTPAHPFZPE-ILDUYXDCSA-N 1 2 305.306 4.676 20 0 DJADLO CC[C@@](C)([NH2+]CC1CCC(C(F)(F)F)CC1)C(F)(F)F ZINC000547442269 341213887 /nfs/dbraw/zinc/21/38/87/341213887.db2.gz MBJRBTPAHPFZPE-VQXHTEKXSA-N 1 2 305.306 4.676 20 0 DJADLO C[C@@H](c1cc2ccccc2o1)[N@H+](C)Cc1csc(C2CC2)n1 ZINC000134820161 341224708 /nfs/dbraw/zinc/22/47/08/341224708.db2.gz KLMVNLWTPCHVMD-LBPRGKRZSA-N 1 2 312.438 4.960 20 0 DJADLO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)Cc1csc(C2CC2)n1 ZINC000134820161 341224709 /nfs/dbraw/zinc/22/47/09/341224709.db2.gz KLMVNLWTPCHVMD-LBPRGKRZSA-N 1 2 312.438 4.960 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1Cl)c1nc2c(s1)CCC2 ZINC000134978912 341227710 /nfs/dbraw/zinc/22/77/10/341227710.db2.gz XQNKYEOHQUBQJP-NXEZZACHSA-N 1 2 324.852 4.836 20 0 DJADLO C[C@@H](C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1)c1cccs1 ZINC000078092761 341235656 /nfs/dbraw/zinc/23/56/56/341235656.db2.gz PLULNYINJFONFP-CYBMUJFWSA-N 1 2 324.405 4.678 20 0 DJADLO Cc1nc(-c2cc([C@@H](C)[NH2+][C@H](C)c3ccon3)cs2)cs1 ZINC000564354948 341271826 /nfs/dbraw/zinc/27/18/26/341271826.db2.gz HQDUYECFLOGMGE-NXEZZACHSA-N 1 2 319.455 4.580 20 0 DJADLO CC[C@@H](CSC)[NH2+][C@@H](c1cccc(OC(C)C)c1)C(F)F ZINC000564359556 341278406 /nfs/dbraw/zinc/27/84/06/341278406.db2.gz VRNCXMBXYGLYRS-ZFWWWQNUSA-N 1 2 317.445 4.511 20 0 DJADLO c1ccc(-c2nc(C3CCCC3)no2)c(Oc2cc[nH+]cc2)c1 ZINC000548881340 341279528 /nfs/dbraw/zinc/27/95/28/341279528.db2.gz KZXLXDPVGKKKHI-UHFFFAOYSA-N 1 2 307.353 4.582 20 0 DJADLO CCO[C@H](C)c1nc(C[N@H+](C)[C@H](C)c2cccc(C)c2)cs1 ZINC000245453256 341295027 /nfs/dbraw/zinc/29/50/27/341295027.db2.gz RATMBYFJVJSTSJ-HUUCEWRRSA-N 1 2 318.486 4.742 20 0 DJADLO CCO[C@H](C)c1nc(C[N@@H+](C)[C@H](C)c2cccc(C)c2)cs1 ZINC000245453256 341295028 /nfs/dbraw/zinc/29/50/28/341295028.db2.gz RATMBYFJVJSTSJ-HUUCEWRRSA-N 1 2 318.486 4.742 20 0 DJADLO CO[C@@H](C)c1nc(C[N@H+](C)[C@H](C)c2cccc(Cl)c2)cs1 ZINC000245470233 341295986 /nfs/dbraw/zinc/29/59/86/341295986.db2.gz MQACJLKYOUZXCR-NEPJUHHUSA-N 1 2 324.877 4.697 20 0 DJADLO CO[C@@H](C)c1nc(C[N@@H+](C)[C@H](C)c2cccc(Cl)c2)cs1 ZINC000245470233 341295987 /nfs/dbraw/zinc/29/59/87/341295987.db2.gz MQACJLKYOUZXCR-NEPJUHHUSA-N 1 2 324.877 4.697 20 0 DJADLO CCc1ccc(C[N@@H+]2CCCC[C@H]2c2nc3ccccc3o2)nc1 ZINC000549525515 341296256 /nfs/dbraw/zinc/29/62/56/341296256.db2.gz CTOVCGXZQAKTRH-SFHVURJKSA-N 1 2 321.424 4.512 20 0 DJADLO CCc1ccc(C[N@H+]2CCCC[C@H]2c2nc3ccccc3o2)nc1 ZINC000549525515 341296257 /nfs/dbraw/zinc/29/62/57/341296257.db2.gz CTOVCGXZQAKTRH-SFHVURJKSA-N 1 2 321.424 4.512 20 0 DJADLO C[C@@H]1CC[N@H+](Cc2csc(C3CC3)n2)[C@@H](c2ccco2)C1 ZINC000245699590 341310519 /nfs/dbraw/zinc/31/05/19/341310519.db2.gz YXYZLHCVZADKOM-IUODEOHRSA-N 1 2 302.443 4.587 20 0 DJADLO C[C@@H]1CC[N@@H+](Cc2csc(C3CC3)n2)[C@@H](c2ccco2)C1 ZINC000245699590 341310520 /nfs/dbraw/zinc/31/05/20/341310520.db2.gz YXYZLHCVZADKOM-IUODEOHRSA-N 1 2 302.443 4.587 20 0 DJADLO Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]CC(C)(F)F ZINC000550881679 341325301 /nfs/dbraw/zinc/32/53/01/341325301.db2.gz ASMNNVYBEPDOMW-NSHDSACASA-N 1 2 310.413 4.733 20 0 DJADLO C[C@H]([NH2+]CC(C)(F)F)c1ccc(SCC(F)(F)F)cc1 ZINC000551241413 341335231 /nfs/dbraw/zinc/33/52/31/341335231.db2.gz KXBQUCHBGXNJQS-VIFPVBQESA-N 1 2 313.335 4.647 20 0 DJADLO Cc1ccnc(C[N@@H+](CC(C)C)[C@H](C)c2ccccc2Cl)n1 ZINC000551421402 341341244 /nfs/dbraw/zinc/34/12/44/341341244.db2.gz BXFQPRSNEUBBOM-OAHLLOKOSA-N 1 2 317.864 4.658 20 0 DJADLO Cc1ccnc(C[N@H+](CC(C)C)[C@H](C)c2ccccc2Cl)n1 ZINC000551421402 341341245 /nfs/dbraw/zinc/34/12/45/341341245.db2.gz BXFQPRSNEUBBOM-OAHLLOKOSA-N 1 2 317.864 4.658 20 0 DJADLO CCOCc1ccc(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)cc1 ZINC000552068365 341367119 /nfs/dbraw/zinc/36/71/19/341367119.db2.gz UAFKJWDRDZYCMW-GOSISDBHSA-N 1 2 313.445 4.680 20 0 DJADLO CC[C@@H](C)[C@H]([NH2+]Cc1noc(C(C)C)n1)c1ccc(Cl)cc1 ZINC000553338117 341426406 /nfs/dbraw/zinc/42/64/06/341426406.db2.gz UJGMLSJJEJHBGD-WBMJQRKESA-N 1 2 321.852 4.723 20 0 DJADLO Cc1ccc(CNc2cnn(-c3ccccc3)c2C(C)C)c(C)[nH+]1 ZINC000565664205 341534444 /nfs/dbraw/zinc/53/44/44/341534444.db2.gz LVRCTUVUKPAPBD-UHFFFAOYSA-N 1 2 320.440 4.620 20 0 DJADLO CCC[C@@H]1CCCN(C(=O)c2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000155306628 341605953 /nfs/dbraw/zinc/60/59/53/341605953.db2.gz KTYGSFWXBDREIJ-MRXNPFEDSA-N 1 2 324.424 4.526 20 0 DJADLO Cc1ccc(F)c(C[NH2+]Cc2cc(Cl)sc2Cl)c1 ZINC000312756331 341628478 /nfs/dbraw/zinc/62/84/78/341628478.db2.gz CKFHISQRELQHRC-UHFFFAOYSA-N 1 2 304.217 4.792 20 0 DJADLO CC(C)n1ccc(C[NH2+][C@H](C)c2cc(Cl)sc2Cl)n1 ZINC000573656655 341735100 /nfs/dbraw/zinc/73/51/00/341735100.db2.gz YXNUCUGDMRDZJD-SECBINFHSA-N 1 2 318.273 4.683 20 0 DJADLO C[C@H]([NH2+][C@H]1C[C@@H](C)c2ccccc21)c1noc(-c2ccccc2)n1 ZINC000576664222 341857758 /nfs/dbraw/zinc/85/77/58/341857758.db2.gz CKKVWNMCMMKKSL-GLJUWKHASA-N 1 2 319.408 4.636 20 0 DJADLO CCc1ccc([C@H](COC)[NH2+][C@@H](C)c2ccccc2Cl)o1 ZINC000177372755 341919091 /nfs/dbraw/zinc/91/90/91/341919091.db2.gz JEEQZWJNDAXAPW-LRDDRELGSA-N 1 2 307.821 4.534 20 0 DJADLO COC[C@@H]([NH2+]Cc1sc2ccccc2c1Cl)c1ccco1 ZINC000177576568 341921359 /nfs/dbraw/zinc/92/13/59/341921359.db2.gz AEBBLWZBIZIAOF-GFCCVEGCSA-N 1 2 321.829 4.625 20 0 DJADLO CC(C)Oc1c(Cl)cccc1NCc1[nH+]ccn1C(C)C ZINC000124521382 519777625 /nfs/dbraw/zinc/77/76/25/519777625.db2.gz OXQRACTWBWMYPP-UHFFFAOYSA-N 1 2 307.825 4.517 20 0 DJADLO CC(C)n1cc[nH+]c1CN1Cc2ccccc2-c2ccccc2C1 ZINC000338422072 520029412 /nfs/dbraw/zinc/02/94/12/520029412.db2.gz IOMNFAYLEAWRKW-UHFFFAOYSA-N 1 2 317.436 4.647 20 0 DJADLO CCCCc1noc([C@H](C)[NH2+][C@@H](C)c2cc3ccccc3o2)n1 ZINC000182631888 521351445 /nfs/dbraw/zinc/35/14/45/521351445.db2.gz QHQGPTNASBSQFC-STQMWFEESA-N 1 2 313.401 4.570 20 0 DJADLO CC[N@H+](Cc1csc([C@@H](C)OC)n1)Cc1ccc(Cl)cc1 ZINC000267056407 521446839 /nfs/dbraw/zinc/44/68/39/521446839.db2.gz SCWHFMNUKKKBQD-GFCCVEGCSA-N 1 2 324.877 4.526 20 0 DJADLO CC[N@@H+](Cc1csc([C@@H](C)OC)n1)Cc1ccc(Cl)cc1 ZINC000267056407 521446846 /nfs/dbraw/zinc/44/68/46/521446846.db2.gz SCWHFMNUKKKBQD-GFCCVEGCSA-N 1 2 324.877 4.526 20 0 DJADLO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2cc3ccccc3o2)cs1 ZINC000162415459 522422518 /nfs/dbraw/zinc/42/25/18/522422518.db2.gz DAXSOGSPWSACRU-NEPJUHHUSA-N 1 2 300.427 4.864 20 0 DJADLO CCc1nc([C@H](C)[NH2+][C@@H](C)c2csc(Cl)c2)cs1 ZINC000191280742 522454935 /nfs/dbraw/zinc/45/49/35/522454935.db2.gz XRXYOYBPMZFSCU-IUCAKERBSA-N 1 2 300.880 4.832 20 0 DJADLO CC[C@H]([NH2+][C@@H](C)c1nc2ccccc2o1)c1cc(F)ccc1F ZINC000181230198 522700881 /nfs/dbraw/zinc/70/08/81/522700881.db2.gz IEZKIGSEEPUBGE-NHYWBVRUSA-N 1 2 316.351 4.908 20 0 DJADLO C[C@@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1cccc(F)c1F ZINC000181993973 525558810 /nfs/dbraw/zinc/55/88/10/525558810.db2.gz HASAGZZZWLQXNG-SNVBAGLBSA-N 1 2 310.413 4.570 20 0 DJADLO C[C@@H](Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1)c1nccs1 ZINC000182923331 525699080 /nfs/dbraw/zinc/69/90/80/525699080.db2.gz SEORYADVJAPPMF-CYBMUJFWSA-N 1 2 324.453 4.516 20 0 DJADLO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2csc(C(C)C)n2)s1 ZINC000106877175 526750022 /nfs/dbraw/zinc/75/00/22/526750022.db2.gz JJZMHFQDOOXEQR-NSHDSACASA-N 1 2 309.504 4.533 20 0 DJADLO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2csc(C(C)C)n2)s1 ZINC000106877175 526750027 /nfs/dbraw/zinc/75/00/27/526750027.db2.gz JJZMHFQDOOXEQR-NSHDSACASA-N 1 2 309.504 4.533 20 0 DJADLO Cn1c[nH+]cc1CS[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000338398311 527510385 /nfs/dbraw/zinc/51/03/85/527510385.db2.gz JOHDBTAZGBFYQO-GOSISDBHSA-N 1 2 312.413 4.582 20 0 DJADLO CC[C@@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccc(Cl)s1 ZINC000273503561 535806673 /nfs/dbraw/zinc/80/66/73/535806673.db2.gz MXZVAXXPFMFTKE-SNVBAGLBSA-N 1 2 312.866 4.928 20 0 DJADLO CC[C@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccc(Cl)s1 ZINC000273503558 535922366 /nfs/dbraw/zinc/92/23/66/535922366.db2.gz MXZVAXXPFMFTKE-JTQLQIEISA-N 1 2 312.866 4.928 20 0 DJADLO CC(C)c1noc([C@@H](C)[NH2+][C@@H](C)c2cccc3ccccc32)n1 ZINC000079287807 185163650 /nfs/dbraw/zinc/16/36/50/185163650.db2.gz JSYWHFIYVUBJST-UONOGXRCSA-N 1 2 309.413 4.758 20 0 DJADLO C[C@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1ccc(F)cc1Cl ZINC000090572195 185304325 /nfs/dbraw/zinc/30/43/25/185304325.db2.gz NESOMSKTUQNGAW-LBPRGKRZSA-N 1 2 321.827 4.642 20 0 DJADLO CC(C)n1ccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)n1 ZINC000083683248 192378536 /nfs/dbraw/zinc/37/85/36/192378536.db2.gz GBNIAXHLSKWRDN-NSHDSACASA-N 1 2 312.244 4.622 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1Cl)c1nccs1 ZINC000080266470 192019661 /nfs/dbraw/zinc/01/96/61/192019661.db2.gz SNPALJDCTMNOPT-RKDXNWHRSA-N 1 2 301.242 4.862 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1ccc(F)cc1F)C(C)(C)C)c1nccs1 ZINC000091736521 193099363 /nfs/dbraw/zinc/09/93/63/193099363.db2.gz OVFAPKCHWPZORE-YGRLFVJLSA-N 1 2 310.413 4.859 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1F)c1nc2c(s1)CCCC2 ZINC000093369060 193240142 /nfs/dbraw/zinc/24/01/42/193240142.db2.gz DIIXXZAAMGVLQU-GHMZBOCLSA-N 1 2 322.424 4.712 20 0 DJADLO CCCc1csc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)n1 ZINC000426036678 335042662 /nfs/dbraw/zinc/04/26/62/335042662.db2.gz OXEAAIRYJJNSNZ-MRXNPFEDSA-N 1 2 304.434 4.572 20 0 DJADLO CCCc1csc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)n1 ZINC000426036678 335042663 /nfs/dbraw/zinc/04/26/63/335042663.db2.gz OXEAAIRYJJNSNZ-MRXNPFEDSA-N 1 2 304.434 4.572 20 0 DJADLO Cc1cnc([C@H](C)[NH2+]Cc2csc(C3CCCCC3)n2)s1 ZINC000273270059 130102123 /nfs/dbraw/zinc/10/21/23/130102123.db2.gz GGDWBLYPQQGTLU-LBPRGKRZSA-N 1 2 321.515 4.807 20 0 DJADLO COc1cccc(C2([NH2+][C@H](C)c3csc(C(C)C)n3)CC2)c1 ZINC000274523855 130242985 /nfs/dbraw/zinc/24/29/85/130242985.db2.gz YUZABMSLKZVPCY-CYBMUJFWSA-N 1 2 316.470 4.615 20 0 DJADLO C[C@@H]([NH2+]Cc1ccccc1Cl)c1nc(C(F)(F)F)cs1 ZINC000274611405 130248834 /nfs/dbraw/zinc/24/88/34/130248834.db2.gz NNSBUDGLUVBHSF-MRVPVSSYSA-N 1 2 320.767 4.666 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1Cl)c1ccc(Cl)cn1 ZINC000274914358 130272693 /nfs/dbraw/zinc/27/26/93/130272693.db2.gz NVNUVEBDXJWTOZ-NXEZZACHSA-N 1 2 313.203 4.939 20 0 DJADLO Cc1nccnc1[C@H](C)[NH2+][C@@H](C)c1cc(Cl)ccc1Cl ZINC000275669912 130359619 /nfs/dbraw/zinc/35/96/19/130359619.db2.gz HCJVAQPBTGYJTL-ONGXEEELSA-N 1 2 310.228 4.504 20 0 DJADLO Cc1ccnc([C@H](C)[NH2+][C@H](C)c2nc(-c3ccccc3)cs2)c1 ZINC000286279437 131228184 /nfs/dbraw/zinc/22/81/84/131228184.db2.gz VQTQZLDLWNKOJD-LSDHHAIUSA-N 1 2 323.465 4.925 20 0 DJADLO Cc1ccnc([C@H](C)[NH2+][C@@H](C)c2nc(-c3ccccc3)cs2)c1 ZINC000286279421 131228228 /nfs/dbraw/zinc/22/82/28/131228228.db2.gz VQTQZLDLWNKOJD-GJZGRUSLSA-N 1 2 323.465 4.925 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCCCC[C@@H]1c1ccccc1 ZINC000287478101 131282235 /nfs/dbraw/zinc/28/22/35/131282235.db2.gz JZOKGGYFIXPULY-GOSISDBHSA-N 1 2 323.440 4.848 20 0 DJADLO COc1cccc(F)c1[C@@H](C)Nc1[nH+]ccc2ccc(F)cc21 ZINC000340260189 131297921 /nfs/dbraw/zinc/29/79/21/131297921.db2.gz PYPRGCZLZGNVKO-LLVKDONJSA-N 1 2 314.335 4.695 20 0 DJADLO CSc1ccccc1[C@@H](C)[NH2+]Cc1cc(C(C)(C)C)on1 ZINC000289440774 131386185 /nfs/dbraw/zinc/38/61/85/131386185.db2.gz TXEVVROSTBNONA-GFCCVEGCSA-N 1 2 304.459 4.545 20 0 DJADLO c1c[nH]c([C@@H]2CCC[N@H+]2Cc2csc(-c3cccs3)n2)c1 ZINC000298769678 132077024 /nfs/dbraw/zinc/07/70/24/132077024.db2.gz NXBFOJZPXVZBNQ-AWEZNQCLSA-N 1 2 315.467 4.537 20 0 DJADLO c1c[nH]c([C@@H]2CCC[N@@H+]2Cc2csc(-c3cccs3)n2)c1 ZINC000298769678 132077027 /nfs/dbraw/zinc/07/70/27/132077027.db2.gz NXBFOJZPXVZBNQ-AWEZNQCLSA-N 1 2 315.467 4.537 20 0 DJADLO Cc1nc(C[N@@H+](C)[C@H](C)c2cccc(C(F)(F)F)c2)cs1 ZINC000340671944 132140470 /nfs/dbraw/zinc/14/04/70/132140470.db2.gz FFTHNUSQZUOMDF-SNVBAGLBSA-N 1 2 314.376 4.663 20 0 DJADLO Cc1nc(C[N@H+](C)[C@H](C)c2cccc(C(F)(F)F)c2)cs1 ZINC000340671944 132140472 /nfs/dbraw/zinc/14/04/72/132140472.db2.gz FFTHNUSQZUOMDF-SNVBAGLBSA-N 1 2 314.376 4.663 20 0 DJADLO Cc1cnc(C[N@@H+](Cc2ccccc2)[C@H](C)c2cccs2)nc1 ZINC000340683479 132148117 /nfs/dbraw/zinc/14/81/17/132148117.db2.gz LCXLNQUZTZHLLO-MRXNPFEDSA-N 1 2 323.465 4.610 20 0 DJADLO Cc1cnc(C[N@H+](Cc2ccccc2)[C@H](C)c2cccs2)nc1 ZINC000340683479 132148118 /nfs/dbraw/zinc/14/81/18/132148118.db2.gz LCXLNQUZTZHLLO-MRXNPFEDSA-N 1 2 323.465 4.610 20 0 DJADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CC[C@@](F)(c2ccccc2)C1 ZINC000563861674 335068551 /nfs/dbraw/zinc/06/85/51/335068551.db2.gz PCOSRDTVEYPXMB-LIRRHRJNSA-N 1 2 316.420 4.604 20 0 DJADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+]1CC[C@@](F)(c2ccccc2)C1 ZINC000563861674 335068553 /nfs/dbraw/zinc/06/85/53/335068553.db2.gz PCOSRDTVEYPXMB-LIRRHRJNSA-N 1 2 316.420 4.604 20 0 DJADLO COc1cccc(F)c1[C@H](C)[NH2+][C@H](C)c1cc(F)ccc1F ZINC000174220917 332847301 /nfs/dbraw/zinc/84/73/01/332847301.db2.gz VQGLUMJEBVFYOR-MNOVXSKESA-N 1 2 309.331 4.524 20 0 DJADLO CC[C@H]([NH2+][C@@H](C)c1noc(-c2ccccc2)n1)c1ccc(C)cc1 ZINC000124276873 331557886 /nfs/dbraw/zinc/55/78/86/331557886.db2.gz YFRKGDGZWRGFPE-YJBOKZPZSA-N 1 2 321.424 4.847 20 0 DJADLO COc1cc[nH+]cc1CSCc1csc(CCC(C)C)n1 ZINC000584016257 331563277 /nfs/dbraw/zinc/56/32/77/331563277.db2.gz QCZMXIJWPSBCBZ-UHFFFAOYSA-N 1 2 322.499 4.569 20 0 DJADLO Cc1cccc([C@@H](C)[NH2+][C@H](C)c2noc(-c3ccccc3)n2)c1C ZINC000124291562 331576717 /nfs/dbraw/zinc/57/67/17/331576717.db2.gz YUEYEYKYLYHPKW-HZPDHXFCSA-N 1 2 321.424 4.765 20 0 DJADLO Cc1cccn2cc(COc3c(Cl)cccc3Cl)[nH+]c12 ZINC000025605983 331597082 /nfs/dbraw/zinc/59/70/82/331597082.db2.gz FCSZQTDZYFLZEL-UHFFFAOYSA-N 1 2 307.180 4.529 20 0 DJADLO Fc1c(Cl)cccc1C[NH+]1CCC(CC(F)(F)F)CC1 ZINC000556507758 331709883 /nfs/dbraw/zinc/70/98/83/331709883.db2.gz NLPJLESYUOSYLX-UHFFFAOYSA-N 1 2 309.734 4.644 20 0 DJADLO CO[C@@H](C)c1cccc(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)c1 ZINC000556890571 331749211 /nfs/dbraw/zinc/74/92/11/331749211.db2.gz RUYDGCYVMKGSEA-KBXCAEBGSA-N 1 2 313.445 4.851 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1cc2cc(Cl)ccc2o1)c1cscn1 ZINC000569338539 331889056 /nfs/dbraw/zinc/88/90/56/331889056.db2.gz DNJDJVRXXNLOGX-UWVGGRQHSA-N 1 2 306.818 4.955 20 0 DJADLO Cc1cccc([C@H]([NH2+]Cc2ncccc2F)c2cccc(F)c2)c1 ZINC000558699032 331936688 /nfs/dbraw/zinc/93/66/88/331936688.db2.gz UDDUCAIMJGGLFI-FQEVSTJZSA-N 1 2 324.374 4.547 20 0 DJADLO Clc1cccc(Cl)c1C[NH2+]Cc1ccc2ccccc2n1 ZINC000518276813 332004980 /nfs/dbraw/zinc/00/49/80/332004980.db2.gz SNZFAWIWPGIYLB-UHFFFAOYSA-N 1 2 317.219 4.831 20 0 DJADLO CCCc1occc1C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000409682383 332045319 /nfs/dbraw/zinc/04/53/19/332045319.db2.gz ASOWZMPWOZSUCS-UHFFFAOYSA-N 1 2 322.364 4.672 20 0 DJADLO CCCCc1[nH]c2ccc(NC(=O)c3sccc3C)cc2[nH+]1 ZINC000409717590 332049769 /nfs/dbraw/zinc/04/97/69/332049769.db2.gz BLMBVVVDVSOUPU-UHFFFAOYSA-N 1 2 313.426 4.528 20 0 DJADLO CSc1ccccc1[C@@H](C)[NH2+][C@H](C)c1nc(C(C)(C)C)no1 ZINC000409841450 332059549 /nfs/dbraw/zinc/05/95/49/332059549.db2.gz FRFDIIXEQSWEEO-VXGBXAGGSA-N 1 2 319.474 4.501 20 0 DJADLO Cc1c[nH]c(-c2ccccc2NC(=O)CC2CCC(C)CC2)[nH+]1 ZINC000427180475 332179231 /nfs/dbraw/zinc/17/92/31/332179231.db2.gz YTJPFISKMOVXMS-UHFFFAOYSA-N 1 2 311.429 4.540 20 0 DJADLO CCO[C@H](C)c1nc(C[NH2+][C@H](C)c2cccc(Cl)c2)cs1 ZINC000181417085 332194031 /nfs/dbraw/zinc/19/40/31/332194031.db2.gz MNMZSNJUGYOIEO-VXGBXAGGSA-N 1 2 324.877 4.745 20 0 DJADLO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@@H+]1Cc1csc(C(C)(C)C)n1 ZINC000449463307 332234750 /nfs/dbraw/zinc/23/47/50/332234750.db2.gz VVUDJWOHDLMTII-MNOVXSKESA-N 1 2 320.424 4.603 20 0 DJADLO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@H+]1Cc1csc(C(C)(C)C)n1 ZINC000449463307 332234752 /nfs/dbraw/zinc/23/47/52/332234752.db2.gz VVUDJWOHDLMTII-MNOVXSKESA-N 1 2 320.424 4.603 20 0 DJADLO Cc1cc(NC(=O)[C@@H]2CC=CC[C@H]2C)ccc1Oc1cc[nH+]cc1 ZINC000560120563 332312795 /nfs/dbraw/zinc/31/27/95/332312795.db2.gz IKQPZKTVKBGCST-RDTXWAMCSA-N 1 2 322.408 4.723 20 0 DJADLO CC(C)Oc1ccc([C@@H](C)[NH2+]C2(C(F)F)CC2)cc1Cl ZINC000560235027 332321108 /nfs/dbraw/zinc/32/11/08/332321108.db2.gz CWNLGIBURHVFCT-SNVBAGLBSA-N 1 2 303.780 4.576 20 0 DJADLO CC(C)Oc1ccc([C@H](C)[NH2+]C2(C(F)F)CC2)cc1Cl ZINC000560235025 332321123 /nfs/dbraw/zinc/32/11/23/332321123.db2.gz CWNLGIBURHVFCT-JTQLQIEISA-N 1 2 303.780 4.576 20 0 DJADLO CC(C)Oc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccon2)cc1Cl ZINC000560237176 332321405 /nfs/dbraw/zinc/32/14/05/332321405.db2.gz AYKLTILZIMLJKP-NEPJUHHUSA-N 1 2 308.809 4.527 20 0 DJADLO CSc1ccc(C[N@H+](C)Cc2nc3ccccc3s2)s1 ZINC000560364427 332334747 /nfs/dbraw/zinc/33/47/47/332334747.db2.gz FDWUBKFOWRZNHK-UHFFFAOYSA-N 1 2 320.508 4.712 20 0 DJADLO CSc1ccc(C[N@@H+](C)Cc2nc3ccccc3s2)s1 ZINC000560364427 332334749 /nfs/dbraw/zinc/33/47/49/332334749.db2.gz FDWUBKFOWRZNHK-UHFFFAOYSA-N 1 2 320.508 4.712 20 0 DJADLO CCc1ccc(N[C@H](c2[nH]cc[nH+]2)c2ccccc2)cc1Cl ZINC000560580598 332364202 /nfs/dbraw/zinc/36/42/02/332364202.db2.gz KZPIKGMEVMJPQZ-KRWDZBQOSA-N 1 2 311.816 4.827 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)c1cc(C(C)C)nc2ccccc21 ZINC000425587389 335107455 /nfs/dbraw/zinc/10/74/55/335107455.db2.gz NWFJUZMIBZIWIF-UHFFFAOYSA-N 1 2 319.408 4.622 20 0 DJADLO CC(C)Oc1ccccc1[C@H](C)[NH2+]Cc1c(F)cccc1F ZINC000387570458 332396302 /nfs/dbraw/zinc/39/63/02/332396302.db2.gz WRCGXBKYZCBEFB-ZDUSSCGKSA-N 1 2 305.368 4.603 20 0 DJADLO Cc1cnc(C[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)s1 ZINC000122948199 332416085 /nfs/dbraw/zinc/41/60/85/332416085.db2.gz AFXLCHFMLMCTTR-VIFPVBQESA-N 1 2 301.242 4.609 20 0 DJADLO Cc1cnc([C@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2Cl)cn1 ZINC000427818159 332526087 /nfs/dbraw/zinc/52/60/87/332526087.db2.gz NWYLALQBSGAJJX-QWRGUYRKSA-N 1 2 310.228 4.504 20 0 DJADLO COc1cccc(Cl)c1C[NH2+][C@@H](C)c1ccccc1Cl ZINC000169274669 332625732 /nfs/dbraw/zinc/62/57/32/332625732.db2.gz PRILZHCYJAVBSN-NSHDSACASA-N 1 2 310.224 4.853 20 0 DJADLO C[C@@H]([NH2+]Cc1ncc(Cl)cc1Cl)c1ccccc1Cl ZINC000182497066 335116482 /nfs/dbraw/zinc/11/64/82/335116482.db2.gz SJUBUGPHMWLLTM-SECBINFHSA-N 1 2 315.631 4.893 20 0 DJADLO C[C@@H]([NH2+]Cc1ncc(-c2ccccc2)o1)c1cc2ccccc2o1 ZINC000181763831 333032116 /nfs/dbraw/zinc/03/21/16/333032116.db2.gz PBLHMQARJAGTFZ-CQSZACIVSA-N 1 2 318.376 4.939 20 0 DJADLO COc1cccc(Cl)c1C[NH2+][C@H](C)c1csc(C(C)C)n1 ZINC000188463184 333046801 /nfs/dbraw/zinc/04/68/01/333046801.db2.gz IFSLXKKHDORVCJ-LLVKDONJSA-N 1 2 324.877 4.779 20 0 DJADLO Cc1ccc(NCc2cn3ccccc3[nH+]2)cc1OCCC(C)C ZINC000462731426 333098467 /nfs/dbraw/zinc/09/84/67/333098467.db2.gz NTKQEXPEEGAXHC-UHFFFAOYSA-N 1 2 323.440 4.680 20 0 DJADLO Cc1ccc(C[NH2+][C@H](C)c2cc(Cl)sc2Cl)nc1C ZINC000314343342 333103834 /nfs/dbraw/zinc/10/38/34/333103834.db2.gz VGXLOBFXYFLXSJ-SNVBAGLBSA-N 1 2 315.269 4.918 20 0 DJADLO Cc1cccc([C@@H](C)[NH2+][C@@H](C)c2nc(C3CCCCC3)no2)c1 ZINC000185266445 335124492 /nfs/dbraw/zinc/12/44/92/335124492.db2.gz BKHKYUBGSIXKDV-CABCVRRESA-N 1 2 313.445 4.838 20 0 DJADLO C[C@@H](C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1)c1ccccc1 ZINC000182506250 335128066 /nfs/dbraw/zinc/12/80/66/335128066.db2.gz XMMUFQRLHWAPNA-OAHLLOKOSA-N 1 2 318.376 4.616 20 0 DJADLO Cc1ccc(C)c(SCc2[nH+]ccn2Cc2ccccc2)c1 ZINC000497309292 333234684 /nfs/dbraw/zinc/23/46/84/333234684.db2.gz FAZJZZZKNFPAKZ-UHFFFAOYSA-N 1 2 308.450 4.841 20 0 DJADLO Fc1ccc(SCc2[nH+]ccn2Cc2ccccc2)cc1F ZINC000497321239 333236012 /nfs/dbraw/zinc/23/60/12/333236012.db2.gz VVTLPFFMZOABCB-UHFFFAOYSA-N 1 2 316.376 4.502 20 0 DJADLO COc1ccccc1[C@@H](C)[NH2+][C@H](c1ccco1)c1ccccc1 ZINC000120217338 333276252 /nfs/dbraw/zinc/27/62/52/333276252.db2.gz YMOUWFSKHHDDNF-QRWLVFNGSA-N 1 2 307.393 4.728 20 0 DJADLO CC(C)[C@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)no1)c1ccc(F)cc1 ZINC000502483956 333300291 /nfs/dbraw/zinc/30/02/91/333300291.db2.gz FDMFBKGZDQTQMZ-WFASDCNBSA-N 1 2 319.424 4.554 20 0 DJADLO CC(C)[C@@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)no1)c1ccc(F)cc1 ZINC000502483955 333300317 /nfs/dbraw/zinc/30/03/17/333300317.db2.gz FDMFBKGZDQTQMZ-SWLSCSKDSA-N 1 2 319.424 4.554 20 0 DJADLO CC(C)c1nc(C[N@@H+]2CC[C@H](C)C[C@@H]2c2ccco2)cs1 ZINC000525781994 333307329 /nfs/dbraw/zinc/30/73/29/333307329.db2.gz NMJDKSFIVMOVHK-DZGCQCFKSA-N 1 2 304.459 4.833 20 0 DJADLO CC(C)c1nc(C[N@H+]2CC[C@H](C)C[C@@H]2c2ccco2)cs1 ZINC000525781994 333307330 /nfs/dbraw/zinc/30/73/30/333307330.db2.gz NMJDKSFIVMOVHK-DZGCQCFKSA-N 1 2 304.459 4.833 20 0 DJADLO CCCCc1nc(C[N@H+](C)[C@@H](C)c2ccc(F)cc2)cs1 ZINC000497993773 333318385 /nfs/dbraw/zinc/31/83/85/333318385.db2.gz IQDCRAOJLVZDCH-ZDUSSCGKSA-N 1 2 306.450 4.818 20 0 DJADLO CCCCc1nc(C[N@@H+](C)[C@@H](C)c2ccc(F)cc2)cs1 ZINC000497993773 333318387 /nfs/dbraw/zinc/31/83/87/333318387.db2.gz IQDCRAOJLVZDCH-ZDUSSCGKSA-N 1 2 306.450 4.818 20 0 DJADLO CCOc1cccc(Cl)c1C[NH2+][C@](C)(CC)c1nccs1 ZINC000563348886 333593986 /nfs/dbraw/zinc/59/39/86/333593986.db2.gz CVNTYESOFFQKFW-MRXNPFEDSA-N 1 2 324.877 4.610 20 0 DJADLO CCCCCOc1ccc([C@@H](C)[NH2+][C@H](C)c2csnn2)cc1 ZINC000414290734 333934402 /nfs/dbraw/zinc/93/44/02/333934402.db2.gz ALPGHQSWYOWZHF-ZIAGYGMSSA-N 1 2 319.474 4.519 20 0 DJADLO Cc1cc(C)cc(-c2ccc(C[NH2+][C@H](C)c3csnn3)cc2)c1 ZINC000414553106 334016021 /nfs/dbraw/zinc/01/60/21/334016021.db2.gz SJCHJZRSLIILSO-OAHLLOKOSA-N 1 2 323.465 4.673 20 0 DJADLO C[C@H](c1nc2ccccc2n1C(F)F)[N@H+](C)Cc1cccs1 ZINC000298078115 334246250 /nfs/dbraw/zinc/24/62/50/334246250.db2.gz LGIOIYQKDPZGHF-LLVKDONJSA-N 1 2 321.396 4.686 20 0 DJADLO C[C@H](c1nc2ccccc2n1C(F)F)[N@@H+](C)Cc1cccs1 ZINC000298078115 334246252 /nfs/dbraw/zinc/24/62/52/334246252.db2.gz LGIOIYQKDPZGHF-LLVKDONJSA-N 1 2 321.396 4.686 20 0 DJADLO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1csc(C(C)C)n1 ZINC000303123918 334301053 /nfs/dbraw/zinc/30/10/53/334301053.db2.gz ASXHGPLGADTCTN-INIZCTEOSA-N 1 2 316.470 4.612 20 0 DJADLO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1csc(C(C)C)n1 ZINC000303123918 334301054 /nfs/dbraw/zinc/30/10/54/334301054.db2.gz ASXHGPLGADTCTN-INIZCTEOSA-N 1 2 316.470 4.612 20 0 DJADLO Fc1cc2[nH+]cn(Cc3ccc(Cl)cc3Cl)c2cc1F ZINC000049065777 334307108 /nfs/dbraw/zinc/30/71/08/334307108.db2.gz RMJFVIJZDMENGZ-UHFFFAOYSA-N 1 2 313.134 4.670 20 0 DJADLO Cc1cccc2[nH+]c(CNc3cccc(Cl)c3Cl)cn21 ZINC000303897445 334339938 /nfs/dbraw/zinc/33/99/38/334339938.db2.gz KZDQPQUEUBBNME-UHFFFAOYSA-N 1 2 306.196 4.562 20 0 DJADLO c1sc(-c2ccccc2)nc1C[N@@H+]1CCC[C@@H]1c1ccccn1 ZINC000535067613 334363297 /nfs/dbraw/zinc/36/32/97/334363297.db2.gz RSXLRJYEOZFMIY-GOSISDBHSA-N 1 2 321.449 4.542 20 0 DJADLO c1sc(-c2ccccc2)nc1C[N@H+]1CCC[C@@H]1c1ccccn1 ZINC000535067613 334363298 /nfs/dbraw/zinc/36/32/98/334363298.db2.gz RSXLRJYEOZFMIY-GOSISDBHSA-N 1 2 321.449 4.542 20 0 DJADLO C[C@H](c1cc2ccccc2o1)N(C)c1cc[nH+]c2ccncc21 ZINC000444110996 338468366 /nfs/dbraw/zinc/46/83/66/338468366.db2.gz LRORFSFIFBIDQO-CYBMUJFWSA-N 1 2 303.365 4.573 20 0 DJADLO CC(C)c1nnc(C[N@@H+](C)[C@@H](c2ccccc2Cl)C(C)C)o1 ZINC000113256340 335283620 /nfs/dbraw/zinc/28/36/20/335283620.db2.gz IKQQINBAROFBDK-MRXNPFEDSA-N 1 2 321.852 4.676 20 0 DJADLO CC(C)c1nnc(C[N@H+](C)[C@@H](c2ccccc2Cl)C(C)C)o1 ZINC000113256340 335283622 /nfs/dbraw/zinc/28/36/22/335283622.db2.gz IKQQINBAROFBDK-MRXNPFEDSA-N 1 2 321.852 4.676 20 0 DJADLO CCc1cnc(C[N@H+](C)[C@H](C)c2sc(C(C)C)nc2C)s1 ZINC000346173866 335377769 /nfs/dbraw/zinc/37/77/69/335377769.db2.gz QATBWYGDCAVMCQ-GFCCVEGCSA-N 1 2 323.531 4.787 20 0 DJADLO CCc1cnc(C[N@@H+](C)[C@H](C)c2sc(C(C)C)nc2C)s1 ZINC000346173866 335377770 /nfs/dbraw/zinc/37/77/70/335377770.db2.gz QATBWYGDCAVMCQ-GFCCVEGCSA-N 1 2 323.531 4.787 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1cc(F)c(F)c(F)c1)c1c(F)cccc1F ZINC000532194771 335913902 /nfs/dbraw/zinc/91/39/02/335913902.db2.gz YVIPMFXLXHERPI-DTWKUNHWSA-N 1 2 315.285 4.794 20 0 DJADLO FC(F)(F)C1=CCN(c2cc[nH+]c3c(Cl)cccc23)CC1 ZINC000520629699 335997348 /nfs/dbraw/zinc/99/73/48/335997348.db2.gz YELNFIQOPPYXKM-UHFFFAOYSA-N 1 2 312.722 4.587 20 0 DJADLO CC(C)[N@H+](Cc1nccs1)Cc1cccc(C(F)(F)F)c1 ZINC000351599893 336048500 /nfs/dbraw/zinc/04/85/00/336048500.db2.gz KUKKBJAQEKRGHZ-UHFFFAOYSA-N 1 2 314.376 4.573 20 0 DJADLO CC(C)[N@@H+](Cc1nccs1)Cc1cccc(C(F)(F)F)c1 ZINC000351599893 336048502 /nfs/dbraw/zinc/04/85/02/336048502.db2.gz KUKKBJAQEKRGHZ-UHFFFAOYSA-N 1 2 314.376 4.573 20 0 DJADLO Cc1c[nH]c(-c2ccccc2NC(=O)C[C@H]2CCC[C@@H](C)C2)[nH+]1 ZINC000331707884 336145204 /nfs/dbraw/zinc/14/52/04/336145204.db2.gz BRILVWMBKBPIIT-HIFRSBDPSA-N 1 2 311.429 4.540 20 0 DJADLO CCc1ccc(N[C@@H](c2[nH]cc[nH+]2)c2ccccc2)cc1CC ZINC000526118504 336203277 /nfs/dbraw/zinc/20/32/77/336203277.db2.gz ADYZMJIMOWQXMB-LJQANCHMSA-N 1 2 305.425 4.736 20 0 DJADLO O=C(Nc1cccc(-c2[nH]cc[nH+]2)c1)c1cc2ccccc2s1 ZINC000103965835 336244119 /nfs/dbraw/zinc/24/41/19/336244119.db2.gz RTVUJZINDFSYHI-UHFFFAOYSA-N 1 2 319.389 4.544 20 0 DJADLO Fc1cccc2c1CC[C@H]2[NH2+][C@H](c1nccs1)c1ccccc1 ZINC000532463786 336249138 /nfs/dbraw/zinc/24/91/38/336249138.db2.gz DUIBFRZXXSMMTN-MSOLQXFVSA-N 1 2 324.424 4.649 20 0 DJADLO Fc1cccc2c1CC[C@H]2[NH2+][C@@H](c1nccs1)c1ccccc1 ZINC000532463787 336249164 /nfs/dbraw/zinc/24/91/64/336249164.db2.gz DUIBFRZXXSMMTN-QZTJIDSGSA-N 1 2 324.424 4.649 20 0 DJADLO C[C@H](c1ccc(C(C)(C)C)cc1)[N@H+](C)Cc1nccn1C(F)F ZINC000532470174 336249558 /nfs/dbraw/zinc/24/95/58/336249558.db2.gz BKMUEIHFPKBURJ-CYBMUJFWSA-N 1 2 321.415 4.769 20 0 DJADLO C[C@H](c1ccc(C(C)(C)C)cc1)[N@@H+](C)Cc1nccn1C(F)F ZINC000532470174 336249559 /nfs/dbraw/zinc/24/95/59/336249559.db2.gz BKMUEIHFPKBURJ-CYBMUJFWSA-N 1 2 321.415 4.769 20 0 DJADLO CCc1ccc([C@H](COC)[NH2+][C@H](CC)c2ccc(F)cc2F)o1 ZINC000532524542 336254160 /nfs/dbraw/zinc/25/41/60/336254160.db2.gz DXRMYCLCJGFEEP-SJORKVTESA-N 1 2 323.383 4.549 20 0 DJADLO COc1ccccc1[C@@H]([NH2+]Cc1ccsc1C)c1ccco1 ZINC000580349831 336259355 /nfs/dbraw/zinc/25/93/55/336259355.db2.gz VBSWUYFEUTYBIO-GOSISDBHSA-N 1 2 313.422 4.537 20 0 DJADLO Cc1noc(C)c1C[N@H+](Cc1c(F)cccc1F)C1CCCC1 ZINC000104695988 336265800 /nfs/dbraw/zinc/26/58/00/336265800.db2.gz SULXVZBVYFCREB-UHFFFAOYSA-N 1 2 320.383 4.514 20 0 DJADLO Cc1noc(C)c1C[N@@H+](Cc1c(F)cccc1F)C1CCCC1 ZINC000104695988 336265801 /nfs/dbraw/zinc/26/58/01/336265801.db2.gz SULXVZBVYFCREB-UHFFFAOYSA-N 1 2 320.383 4.514 20 0 DJADLO Cc1cccc(C[N@H+](Cc2ccn(C(C)C)n2)Cc2ccco2)c1 ZINC000532656376 336266016 /nfs/dbraw/zinc/26/60/16/336266016.db2.gz YUBRWOSYCJXTQZ-UHFFFAOYSA-N 1 2 323.440 4.568 20 0 DJADLO Cc1cccc(C[N@@H+](Cc2ccn(C(C)C)n2)Cc2ccco2)c1 ZINC000532656376 336266017 /nfs/dbraw/zinc/26/60/17/336266017.db2.gz YUBRWOSYCJXTQZ-UHFFFAOYSA-N 1 2 323.440 4.568 20 0 DJADLO CC[C@@H](c1ccccc1)[N@@H+](Cc1nnsc1Cl)CC(C)C ZINC000532715550 336268104 /nfs/dbraw/zinc/26/81/04/336268104.db2.gz SQFILERDJJWEMC-HNNXBMFYSA-N 1 2 323.893 4.801 20 0 DJADLO CC[C@@H](c1ccccc1)[N@H+](Cc1nnsc1Cl)CC(C)C ZINC000532715550 336268105 /nfs/dbraw/zinc/26/81/05/336268105.db2.gz SQFILERDJJWEMC-HNNXBMFYSA-N 1 2 323.893 4.801 20 0 DJADLO c1cc2cccc(NCc3ccc(N4CCCC4)[nH+]c3)c2s1 ZINC000532784341 336271049 /nfs/dbraw/zinc/27/10/49/336271049.db2.gz AECVCXPAWYIZQE-UHFFFAOYSA-N 1 2 309.438 4.509 20 0 DJADLO COc1ccccc1[C@@H]([NH2+]Cc1ccc(C)cc1C)c1ccco1 ZINC000532866795 336273223 /nfs/dbraw/zinc/27/32/23/336273223.db2.gz XRDBCTDXIBOUST-OAQYLSRUSA-N 1 2 321.420 4.784 20 0 DJADLO COc1ccccc1[C@@H]([NH2+]Cc1cccc(C)c1C)c1ccco1 ZINC000532866211 336273528 /nfs/dbraw/zinc/27/35/28/336273528.db2.gz RKKIFKOZDZIIDO-OAQYLSRUSA-N 1 2 321.420 4.784 20 0 DJADLO COc1cc([C@H](C)Nc2cccc[nH+]2)ccc1OC1CCCC1 ZINC000301117035 336290827 /nfs/dbraw/zinc/29/08/27/336290827.db2.gz UXSAGIQRODEGMX-AWEZNQCLSA-N 1 2 312.413 4.585 20 0 DJADLO COc1cc([C@@H](C)Nc2cccc[nH+]2)ccc1OC1CCCC1 ZINC000301117036 336290854 /nfs/dbraw/zinc/29/08/54/336290854.db2.gz UXSAGIQRODEGMX-CQSZACIVSA-N 1 2 312.413 4.585 20 0 DJADLO O[C@@H](CNc1ccc2ccccc2[nH+]1)c1ccc2ccccc2c1 ZINC000301163155 336292801 /nfs/dbraw/zinc/29/28/01/336292801.db2.gz GGKQCTVTXHOVNI-FQEVSTJZSA-N 1 2 314.388 4.534 20 0 DJADLO C[C@@H](Nc1cc[nH+]c(C2CC2)n1)c1ccc(C(F)(F)F)cc1 ZINC000301240446 336296292 /nfs/dbraw/zinc/29/62/92/336296292.db2.gz MCSZSLZMEJUVLJ-SNVBAGLBSA-N 1 2 307.319 4.546 20 0 DJADLO c1ccc2c(c1)CN(c1cc[nH+]c(C3CC3)n1)Cc1ccccc1-2 ZINC000301247185 336296600 /nfs/dbraw/zinc/29/66/00/336296600.db2.gz ONDCWBDUCLBASO-UHFFFAOYSA-N 1 2 313.404 4.541 20 0 DJADLO c1ccc2oc(Nc3cccc(Oc4cc[nH+]cc4)c3)nc2c1 ZINC000301253893 336297045 /nfs/dbraw/zinc/29/70/45/336297045.db2.gz SNGQJJMCTRXONQ-UHFFFAOYSA-N 1 2 303.321 4.759 20 0 DJADLO Cc1ccc([C@H]2CCCN2c2cc(C)[nH+]c(C(C)C)n2)s1 ZINC000301261443 336297384 /nfs/dbraw/zinc/29/73/84/336297384.db2.gz FJRCEMOTCYOTNV-CQSZACIVSA-N 1 2 301.459 4.620 20 0 DJADLO Cc1cc(N[C@@H](c2cccs2)c2ccc(Cl)cc2)nc[nH+]1 ZINC000301292299 336299151 /nfs/dbraw/zinc/29/91/51/336299151.db2.gz ULAMIKPMUSRZND-MRXNPFEDSA-N 1 2 315.829 4.701 20 0 DJADLO CC(C)(C)c1nc(NCc2csc(-c3ccccc3)n2)cc[nH+]1 ZINC000301520745 336312096 /nfs/dbraw/zinc/31/20/96/336312096.db2.gz LGURJCBXXTVPDA-UHFFFAOYSA-N 1 2 324.453 4.510 20 0 DJADLO CCc1cc(N[C@@H](CC)c2cccs2)nc(-c2ccncc2)[nH+]1 ZINC000301558185 336314826 /nfs/dbraw/zinc/31/48/26/336314826.db2.gz OBDDZTCPUZJEAN-HNNXBMFYSA-N 1 2 324.453 4.726 20 0 DJADLO Cc1cnc([C@@H](C)Nc2cc(C)[nH+]c3c(F)cccc23)s1 ZINC000301662559 336321571 /nfs/dbraw/zinc/32/15/71/336321571.db2.gz JZTRDVGILSZJOG-LLVKDONJSA-N 1 2 301.390 4.620 20 0 DJADLO Cc1cc(N[C@@H](C)c2nc3ccccc3[nH]2)c2cccc(F)c2[nH+]1 ZINC000301688785 336323652 /nfs/dbraw/zinc/32/36/52/336323652.db2.gz VQNDCHFTOUVKFM-LBPRGKRZSA-N 1 2 320.371 4.732 20 0 DJADLO Cc1noc(C)c1[C@H](C)CNc1cc(C(C)C)[nH+]c(C(C)C)n1 ZINC000301847338 336333847 /nfs/dbraw/zinc/33/38/47/336333847.db2.gz BLLJCOKQXOFAPS-GFCCVEGCSA-N 1 2 316.449 4.544 20 0 DJADLO Cc1nc2c(s1)[C@@H](Nc1[nH+]c3ccccc3cc1C)CCC2 ZINC000302029347 336344057 /nfs/dbraw/zinc/34/40/57/336344057.db2.gz MLJSJGFSBHGINJ-INIZCTEOSA-N 1 2 309.438 4.798 20 0 DJADLO CCc1cc(N2CCCC[C@H]2c2cc3ccccc3[nH]2)nc(C)[nH+]1 ZINC000302067284 336346723 /nfs/dbraw/zinc/34/67/23/336346723.db2.gz DBKXZRNUCGEHFE-IBGZPJMESA-N 1 2 320.440 4.560 20 0 DJADLO Cc1cc(NCc2ccc(C(C)(C)O)cc2)c2cccc(F)c2[nH+]1 ZINC000302420602 336358479 /nfs/dbraw/zinc/35/84/79/336358479.db2.gz NWZKNLCICCELRM-UHFFFAOYSA-N 1 2 324.399 4.522 20 0 DJADLO C[C@H](Nc1cc[nH+]c(C2CC2)n1)c1nc(-c2ccccc2)cs1 ZINC000110586869 336396921 /nfs/dbraw/zinc/39/69/21/336396921.db2.gz YVSSAFPVSZJTLX-LBPRGKRZSA-N 1 2 322.437 4.651 20 0 DJADLO Fc1ccc2cc[nH+]c(NC3CCC4(CCOCC4)CC3)c2c1 ZINC000354558672 336474744 /nfs/dbraw/zinc/47/47/44/336474744.db2.gz KFXJKNOZSIGDDA-UHFFFAOYSA-N 1 2 314.404 4.525 20 0 DJADLO Clc1cc(C[NH2+]Cc2csc(C3CC3)n2)c(Cl)s1 ZINC000356273925 336543720 /nfs/dbraw/zinc/54/37/20/336543720.db2.gz RDNNQWSMHWENTL-UHFFFAOYSA-N 1 2 319.282 4.679 20 0 DJADLO Cc1[nH]c(-c2cccc(NC(=O)c3occc3C(C)C)c2)[nH+]c1C ZINC000367352251 336680581 /nfs/dbraw/zinc/68/05/81/336680581.db2.gz AFGYNYJWYSSJAM-UHFFFAOYSA-N 1 2 323.396 4.662 20 0 DJADLO Cc1ccc(C[NH+]2Cc3ccccc3-c3ccccc3C2)cn1 ZINC000360963452 336729760 /nfs/dbraw/zinc/72/97/60/336729760.db2.gz BZIWXTUHILQOEL-UHFFFAOYSA-N 1 2 300.405 4.573 20 0 DJADLO Cc1ccc([C@@H]([NH2+][C@H](C)c2cc(C)ccn2)c2ccccn2)cc1 ZINC000367600161 336826145 /nfs/dbraw/zinc/82/61/45/336826145.db2.gz ZMUYZNYUOWTKCT-DYESRHJHSA-N 1 2 317.436 4.534 20 0 DJADLO C[C@H]([NH2+][C@@H](c1cccs1)c1ccc(Cl)cc1)c1ncc[nH]1 ZINC000375898427 337022527 /nfs/dbraw/zinc/02/25/27/337022527.db2.gz SKFINIVAHKEYBD-XHDPSFHLSA-N 1 2 317.845 4.565 20 0 DJADLO Cc1ccc([C@H](C)[NH2+][C@@H](c2nccs2)c2ccccc2)s1 ZINC000123070810 337035103 /nfs/dbraw/zinc/03/51/03/337035103.db2.gz VXTWELNTRMJWMZ-XJKSGUPXSA-N 1 2 314.479 4.953 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1cc(Cl)cc(Cl)c1)c1cscn1 ZINC000582736559 337127821 /nfs/dbraw/zinc/12/78/21/337127821.db2.gz ANOHVTCLOIWHQE-IUCAKERBSA-N 1 2 301.242 4.862 20 0 DJADLO CCO[C@H](C)c1nc(C[N@H+](C)Cc2cc(C)sc2C)cs1 ZINC000174006688 337140633 /nfs/dbraw/zinc/14/06/33/337140633.db2.gz DZQKUBLQBLIVKU-GFCCVEGCSA-N 1 2 324.515 4.551 20 0 DJADLO CCO[C@H](C)c1nc(C[N@@H+](C)Cc2cc(C)sc2C)cs1 ZINC000174006688 337140634 /nfs/dbraw/zinc/14/06/34/337140634.db2.gz DZQKUBLQBLIVKU-GFCCVEGCSA-N 1 2 324.515 4.551 20 0 DJADLO Fc1ccc2c(c1)[C@@H]([NH2+][C@H](c1nccs1)c1ccccc1)CC2 ZINC000177695551 337158483 /nfs/dbraw/zinc/15/84/83/337158483.db2.gz CYESRUYMIAPDPM-ROUUACIJSA-N 1 2 324.424 4.649 20 0 DJADLO Cc1cnc(C[NH+](Cc2cccs2)Cc2cccs2)s1 ZINC000180405994 337174164 /nfs/dbraw/zinc/17/41/64/337174164.db2.gz KZOHKYPBCNZUKG-UHFFFAOYSA-N 1 2 320.508 4.777 20 0 DJADLO CCc1cnc(C[N@H+](C)C(c2ccccc2)c2ccccc2)s1 ZINC000582892700 337211890 /nfs/dbraw/zinc/21/18/90/337211890.db2.gz DEJGPBACPDCCNV-UHFFFAOYSA-N 1 2 322.477 4.927 20 0 DJADLO CCc1cnc(C[N@@H+](C)C(c2ccccc2)c2ccccc2)s1 ZINC000582892700 337211891 /nfs/dbraw/zinc/21/18/91/337211891.db2.gz DEJGPBACPDCCNV-UHFFFAOYSA-N 1 2 322.477 4.927 20 0 DJADLO Cc1noc(C)c1[C@@H](C)CNc1cc[nH+]c2c(Cl)cccc12 ZINC000583207560 337271417 /nfs/dbraw/zinc/27/14/17/337271417.db2.gz LAOQSFIAJKDDQV-JTQLQIEISA-N 1 2 315.804 4.709 20 0 DJADLO Cc1c([C@@H](C)[NH2+][C@H](c2ccco2)c2ccccc2)cnn1C(C)C ZINC000191134057 337294321 /nfs/dbraw/zinc/29/43/21/337294321.db2.gz QYGRSYFUZINNKC-QRWLVFNGSA-N 1 2 323.440 4.806 20 0 DJADLO C[C@H]([NH2+][C@H](c1nccs1)c1ccccc1)c1cccs1 ZINC000123143476 337397884 /nfs/dbraw/zinc/39/78/84/337397884.db2.gz KXYOITISSQAVBT-WFASDCNBSA-N 1 2 300.452 4.645 20 0 DJADLO CC(C)c1nc(C[NH+]2CCC(OC3CCCCC3)CC2)cs1 ZINC000125455523 337411969 /nfs/dbraw/zinc/41/19/69/337411969.db2.gz UULBVGIAKKOWOF-UHFFFAOYSA-N 1 2 322.518 4.580 20 0 DJADLO CC(C)(C)c1nc(C[NH2+][C@H](CC(F)F)c2ccccc2)cs1 ZINC000420983797 337517475 /nfs/dbraw/zinc/51/74/75/337517475.db2.gz CVSAEIQJLSVHTE-CQSZACIVSA-N 1 2 324.440 4.927 20 0 DJADLO CCCc1csc(C[NH2+]Cc2cccc(Cl)c2Cl)n1 ZINC000571856148 337579949 /nfs/dbraw/zinc/57/99/49/337579949.db2.gz LYBROGSMCKCSKX-UHFFFAOYSA-N 1 2 315.269 4.692 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1csc(-c2ccccc2)n1)c1cscn1 ZINC000572017015 337586821 /nfs/dbraw/zinc/58/68/21/337586821.db2.gz QEFTUPJNKFYKHT-NEPJUHHUSA-N 1 2 315.467 4.678 20 0 DJADLO Cc1cc(C)c(NC(=O)N[C@@H](C)c2cccc(C3CC3)c2)c(C)[nH+]1 ZINC000572241234 337599976 /nfs/dbraw/zinc/59/99/76/337599976.db2.gz MDKUMLVZXIYKQB-AWEZNQCLSA-N 1 2 323.440 4.767 20 0 DJADLO COc1ccc(Cl)cc1[C@H](C)[NH2+][C@H](C)c1nc(C)cs1 ZINC000162404915 337618197 /nfs/dbraw/zinc/61/81/97/337618197.db2.gz OKHXNNDIYKYATJ-WDEREUQCSA-N 1 2 310.850 4.525 20 0 DJADLO C[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc(F)cc1OC(F)F ZINC000423214655 337704706 /nfs/dbraw/zinc/70/47/06/337704706.db2.gz LPULKKYVHBCMQU-JTQLQIEISA-N 1 2 322.330 4.568 20 0 DJADLO CC(C)n1c[nH+]cc1CNc1ccc(CCC(F)(F)F)cc1 ZINC000424145664 337771394 /nfs/dbraw/zinc/77/13/94/337771394.db2.gz NZPQLDPGSJDOHS-UHFFFAOYSA-N 1 2 311.351 4.571 20 0 DJADLO CCc1nc(C[NH2+][C@@H](c2ccc([C@@H](C)CC)cc2)C(C)C)no1 ZINC000533334315 337842720 /nfs/dbraw/zinc/84/27/20/337842720.db2.gz UYJMJSUNJVSIBJ-IFXJQAMLSA-N 1 2 315.461 4.632 20 0 DJADLO Cc1ccc(NC(=O)c2sccc2-c2ccccc2)c(C)[nH+]1 ZINC000119389128 337859021 /nfs/dbraw/zinc/85/90/21/337859021.db2.gz DCZFTHQXLOWULS-UHFFFAOYSA-N 1 2 308.406 4.679 20 0 DJADLO Cc1c[nH+]ccc1NC(=O)C[C@H](C)c1ccccc1C(F)(F)F ZINC000119484248 337861045 /nfs/dbraw/zinc/86/10/45/337861045.db2.gz BTDWORJJJKNBTC-NSHDSACASA-N 1 2 322.330 4.541 20 0 DJADLO Cc1nc(C[NH2+][C@H](C)c2ccccc2Oc2ccccc2)oc1C ZINC000537053489 337884547 /nfs/dbraw/zinc/88/45/47/337884547.db2.gz RXJQQFAZBWVJCH-OAHLLOKOSA-N 1 2 322.408 4.935 20 0 DJADLO CCC(CC)[C@@H]([NH2+]Cc1nnsc1Cl)c1cccs1 ZINC000537074175 337886472 /nfs/dbraw/zinc/88/64/72/337886472.db2.gz XTPLLKNVGZIIDU-GFCCVEGCSA-N 1 2 315.895 4.520 20 0 DJADLO COc1ccccc1[C@H]([NH2+][C@@H](C)c1ccsc1)c1ccccn1 ZINC000090913628 337887116 /nfs/dbraw/zinc/88/71/16/337887116.db2.gz ZGGWICYPOPPBLJ-LIRRHRJNSA-N 1 2 324.449 4.592 20 0 DJADLO C[C@@H]([NH2+]Cc1ncc(Cl)cc1Cl)c1c(F)cccc1F ZINC000537524806 337940044 /nfs/dbraw/zinc/94/00/44/337940044.db2.gz IFAVFERIFPOVEW-MRVPVSSYSA-N 1 2 317.166 4.517 20 0 DJADLO CCc1cc(C[NH2+][C@H](c2cccc(C)c2)c2cccc(F)c2)on1 ZINC000515001603 337976352 /nfs/dbraw/zinc/97/63/52/337976352.db2.gz QPUUSOPKEHVZNA-HXUWFJFHSA-N 1 2 324.399 4.564 20 0 DJADLO Cc1ccc2oc(C[NH2+]Cc3ncc(C(C)C)s3)cc2c1 ZINC000516194807 338006535 /nfs/dbraw/zinc/00/65/35/338006535.db2.gz WWXYDOHGCRIMGC-UHFFFAOYSA-N 1 2 300.427 4.611 20 0 DJADLO Cc1cccc2c1[C@H](C)C[C@H]2CC(=O)Nc1c(C)cc[nH+]c1C ZINC000425596723 338015823 /nfs/dbraw/zinc/01/58/23/338015823.db2.gz OSAJNQLXDPCJBE-ZBFHGGJFSA-N 1 2 308.425 4.626 20 0 DJADLO CCCc1nc(C)c(C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)o1 ZINC000428216909 338042771 /nfs/dbraw/zinc/04/27/71/338042771.db2.gz FJNZOYOISGXSAR-OAHLLOKOSA-N 1 2 304.821 4.536 20 0 DJADLO CCCc1nc(C)c(C[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)o1 ZINC000428216909 338042772 /nfs/dbraw/zinc/04/27/72/338042772.db2.gz FJNZOYOISGXSAR-OAHLLOKOSA-N 1 2 304.821 4.536 20 0 DJADLO Cc1nc(C(C)C)oc1C[N@H+](C)Cc1ccc(F)cc1Cl ZINC000428222174 338042908 /nfs/dbraw/zinc/04/29/08/338042908.db2.gz MKLLRCXJLUVZTD-UHFFFAOYSA-N 1 2 310.800 4.531 20 0 DJADLO Cc1nc(C(C)C)oc1C[N@@H+](C)Cc1ccc(F)cc1Cl ZINC000428222174 338042909 /nfs/dbraw/zinc/04/29/09/338042909.db2.gz MKLLRCXJLUVZTD-UHFFFAOYSA-N 1 2 310.800 4.531 20 0 DJADLO CCc1nc(C)c(C[NH+]2Cc3ccccc3-c3ccccc3C2)o1 ZINC000428235022 338043521 /nfs/dbraw/zinc/04/35/21/338043521.db2.gz BGMVEQYTMPHVGD-UHFFFAOYSA-N 1 2 318.420 4.728 20 0 DJADLO CCCc1nc(C)c(C[NH2+][C@@H](C)c2nc(C(C)(C)C)cs2)o1 ZINC000428360398 338048669 /nfs/dbraw/zinc/04/86/69/338048669.db2.gz KYYOEJNMQDNKOV-LBPRGKRZSA-N 1 2 321.490 4.540 20 0 DJADLO Cc1cc(F)ccc1C1CC[NH+](Cc2ncc(Cl)s2)CC1 ZINC000428738948 338060147 /nfs/dbraw/zinc/06/01/47/338060147.db2.gz PVIQHPDDSHEMQL-UHFFFAOYSA-N 1 2 324.852 4.624 20 0 DJADLO C[C@@H]1CC[N@H+](Cc2cc(C(C)(C)C)on2)[C@H](c2ccco2)C1 ZINC000429700215 338087715 /nfs/dbraw/zinc/08/77/15/338087715.db2.gz ZBYJLJOQHFLNBT-HIFRSBDPSA-N 1 2 302.418 4.538 20 0 DJADLO C[C@@H]1CC[N@@H+](Cc2cc(C(C)(C)C)on2)[C@H](c2ccco2)C1 ZINC000429700215 338087716 /nfs/dbraw/zinc/08/77/16/338087716.db2.gz ZBYJLJOQHFLNBT-HIFRSBDPSA-N 1 2 302.418 4.538 20 0 DJADLO Clc1c2ccccc2sc1C[N@@H+]1CCC[C@@H]1c1cc[nH]n1 ZINC000429723826 338088388 /nfs/dbraw/zinc/08/83/88/338088388.db2.gz VSRAFWJEMGMELG-CYBMUJFWSA-N 1 2 317.845 4.615 20 0 DJADLO Clc1c2ccccc2sc1C[N@H+]1CCC[C@@H]1c1cc[nH]n1 ZINC000429723826 338088389 /nfs/dbraw/zinc/08/83/89/338088389.db2.gz VSRAFWJEMGMELG-CYBMUJFWSA-N 1 2 317.845 4.615 20 0 DJADLO Cc1ccc2[nH]c(C[N@@H+]3CC(C)(C)[C@@H]3c3cccnc3)cc2c1C ZINC000430094105 338096190 /nfs/dbraw/zinc/09/61/90/338096190.db2.gz IPGFRYZQEBUAAD-FQEVSTJZSA-N 1 2 319.452 4.763 20 0 DJADLO Cc1ccc2[nH]c(C[N@H+]3CC(C)(C)[C@@H]3c3cccnc3)cc2c1C ZINC000430094105 338096191 /nfs/dbraw/zinc/09/61/91/338096191.db2.gz IPGFRYZQEBUAAD-FQEVSTJZSA-N 1 2 319.452 4.763 20 0 DJADLO CC(C)c1cc(N2CC(C)(C)[C@H]2c2ccncc2)nc(C(C)C)[nH+]1 ZINC000431486097 338131993 /nfs/dbraw/zinc/13/19/93/338131993.db2.gz PWANVRXWNWKYMT-GOSISDBHSA-N 1 2 324.472 4.706 20 0 DJADLO C[C@H](c1ccccc1F)[N@H+](C)Cc1nc2ccc(F)cc2s1 ZINC000432738649 338165199 /nfs/dbraw/zinc/16/51/99/338165199.db2.gz LOCHMXZSDISMGN-LLVKDONJSA-N 1 2 318.392 4.768 20 0 DJADLO C[C@H](c1ccccc1F)[N@@H+](C)Cc1nc2ccc(F)cc2s1 ZINC000432738649 338165200 /nfs/dbraw/zinc/16/52/00/338165200.db2.gz LOCHMXZSDISMGN-LLVKDONJSA-N 1 2 318.392 4.768 20 0 DJADLO Cc1cc(F)cc(NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)c1 ZINC000432769901 338166898 /nfs/dbraw/zinc/16/68/98/338166898.db2.gz DVUGJDIMHXMURA-UHFFFAOYSA-N 1 2 322.339 4.574 20 0 DJADLO C[C@H](c1cccnc1)[N@H+](C)Cc1ccc(F)c(Cl)c1Cl ZINC000432915649 338172815 /nfs/dbraw/zinc/17/28/15/338172815.db2.gz FZTNHQGYVGHBEZ-SNVBAGLBSA-N 1 2 313.203 4.721 20 0 DJADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1ccc(F)c(Cl)c1Cl ZINC000432915649 338172816 /nfs/dbraw/zinc/17/28/16/338172816.db2.gz FZTNHQGYVGHBEZ-SNVBAGLBSA-N 1 2 313.203 4.721 20 0 DJADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1csc(Cl)c1Cl ZINC000432916985 338172984 /nfs/dbraw/zinc/17/29/84/338172984.db2.gz KHGBLUFSQRDEHL-VIFPVBQESA-N 1 2 301.242 4.643 20 0 DJADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1csc(Cl)c1Cl ZINC000432916985 338172985 /nfs/dbraw/zinc/17/29/85/338172985.db2.gz KHGBLUFSQRDEHL-VIFPVBQESA-N 1 2 301.242 4.643 20 0 DJADLO CC(C)n1cc[nH+]c1CN1CC[C@H](C(F)(F)F)c2ccccc21 ZINC000433023561 338176867 /nfs/dbraw/zinc/17/68/67/338176867.db2.gz RDBJKNVPCDOLLZ-AWEZNQCLSA-N 1 2 323.362 4.520 20 0 DJADLO C[C@H](CC[NH2+][C@@H](c1ccccc1)C(F)F)OCc1ccccc1 ZINC000433055713 338178948 /nfs/dbraw/zinc/17/89/48/338178948.db2.gz BKGXNJQQTNJUEU-QAPCUYQASA-N 1 2 319.395 4.578 20 0 DJADLO Cc1ccc(C)c([C@@H]([NH2+]Cc2nccs2)c2ccccc2)c1 ZINC000194293727 338190650 /nfs/dbraw/zinc/19/06/50/338190650.db2.gz XTCIPPZDCAOKOR-IBGZPJMESA-N 1 2 308.450 4.639 20 0 DJADLO CC(C)c1cccc(C[NH2+]Cc2ncc(C(F)(F)F)s2)c1 ZINC000433338380 338193330 /nfs/dbraw/zinc/19/33/30/338193330.db2.gz VKTWITRSGPDWPS-UHFFFAOYSA-N 1 2 314.376 4.575 20 0 DJADLO CC(C)[C@H]([NH2+][C@@H](C)c1nc(C2CC2)no1)c1ccc(Cl)cc1 ZINC000433782601 338201715 /nfs/dbraw/zinc/20/17/15/338201715.db2.gz JRVOOSAUDDFRCB-NHYWBVRUSA-N 1 2 319.836 4.648 20 0 DJADLO Fc1ccc(C[N@@H+]2CCCC[C@@H]2c2cccc(Cl)c2)nc1 ZINC000434513087 338219032 /nfs/dbraw/zinc/21/90/32/338219032.db2.gz YSDWIKKHSUMOMZ-QGZVFWFLSA-N 1 2 304.796 4.601 20 0 DJADLO Fc1ccc(C[N@H+]2CCCC[C@@H]2c2cccc(Cl)c2)nc1 ZINC000434513087 338219033 /nfs/dbraw/zinc/21/90/33/338219033.db2.gz YSDWIKKHSUMOMZ-QGZVFWFLSA-N 1 2 304.796 4.601 20 0 DJADLO C[C@H](Nc1[nH+]cccc1OCc1ccccc1)c1cccc(O)c1 ZINC000436433470 338272265 /nfs/dbraw/zinc/27/22/65/338272265.db2.gz PAJSNUDYVQOJTO-HNNXBMFYSA-N 1 2 320.392 4.539 20 0 DJADLO Clc1ccc2[nH]c([C@H]3CCC[N@@H+]3Cc3ccsc3)nc2c1 ZINC000438256254 338338002 /nfs/dbraw/zinc/33/80/02/338338002.db2.gz IHFZXYLJGJPXBE-OAHLLOKOSA-N 1 2 317.845 4.615 20 0 DJADLO Clc1ccc2[nH]c([C@H]3CCC[N@H+]3Cc3ccsc3)nc2c1 ZINC000438256254 338338003 /nfs/dbraw/zinc/33/80/03/338338003.db2.gz IHFZXYLJGJPXBE-OAHLLOKOSA-N 1 2 317.845 4.615 20 0 DJADLO Clc1ccc2nc([C@H]3CCC[N@@H+]3Cc3ccsc3)[nH]c2c1 ZINC000438256254 338338004 /nfs/dbraw/zinc/33/80/04/338338004.db2.gz IHFZXYLJGJPXBE-OAHLLOKOSA-N 1 2 317.845 4.615 20 0 DJADLO Clc1ccc2nc([C@H]3CCC[N@H+]3Cc3ccsc3)[nH]c2c1 ZINC000438256254 338338005 /nfs/dbraw/zinc/33/80/05/338338005.db2.gz IHFZXYLJGJPXBE-OAHLLOKOSA-N 1 2 317.845 4.615 20 0 DJADLO Clc1ccc2[nH]c([C@@H]3CCC[N@@H+]3Cc3ccsc3)nc2c1 ZINC000438256251 338338049 /nfs/dbraw/zinc/33/80/49/338338049.db2.gz IHFZXYLJGJPXBE-HNNXBMFYSA-N 1 2 317.845 4.615 20 0 DJADLO Clc1ccc2[nH]c([C@@H]3CCC[N@H+]3Cc3ccsc3)nc2c1 ZINC000438256251 338338050 /nfs/dbraw/zinc/33/80/50/338338050.db2.gz IHFZXYLJGJPXBE-HNNXBMFYSA-N 1 2 317.845 4.615 20 0 DJADLO Clc1ccc2nc([C@@H]3CCC[N@@H+]3Cc3ccsc3)[nH]c2c1 ZINC000438256251 338338051 /nfs/dbraw/zinc/33/80/51/338338051.db2.gz IHFZXYLJGJPXBE-HNNXBMFYSA-N 1 2 317.845 4.615 20 0 DJADLO Clc1ccc2nc([C@@H]3CCC[N@H+]3Cc3ccsc3)[nH]c2c1 ZINC000438256251 338338052 /nfs/dbraw/zinc/33/80/52/338338052.db2.gz IHFZXYLJGJPXBE-HNNXBMFYSA-N 1 2 317.845 4.615 20 0 DJADLO Cc1ccc(NCc2c[nH+]cn2Cc2ccccc2)c(Cl)c1 ZINC000438316367 338339493 /nfs/dbraw/zinc/33/94/93/338339493.db2.gz PAIXETXWAWMMGT-UHFFFAOYSA-N 1 2 311.816 4.505 20 0 DJADLO CCc1nc(C[NH2+][C@H](C)c2cc(Cl)sc2Cl)cs1 ZINC000156432081 338360077 /nfs/dbraw/zinc/36/00/77/338360077.db2.gz ARCUUXYPFFBLMI-SSDOTTSWSA-N 1 2 321.298 4.925 20 0 DJADLO CCCCc1nc(C[N@H+]([C@H](C)c2ccco2)C2CC2)cs1 ZINC000440888269 338399358 /nfs/dbraw/zinc/39/93/58/338399358.db2.gz FPLROWZZRUXHMN-CYBMUJFWSA-N 1 2 304.459 4.804 20 0 DJADLO CCCCc1nc(C[N@@H+]([C@H](C)c2ccco2)C2CC2)cs1 ZINC000440888269 338399359 /nfs/dbraw/zinc/39/93/59/338399359.db2.gz FPLROWZZRUXHMN-CYBMUJFWSA-N 1 2 304.459 4.804 20 0 DJADLO Cc1ccc(NC(=O)c2cn(CC(C)C)c3ccccc23)c(C)[nH+]1 ZINC000446592273 338531162 /nfs/dbraw/zinc/53/11/62/338531162.db2.gz KRIOMKPLOGEQMS-UHFFFAOYSA-N 1 2 321.424 4.561 20 0 DJADLO Cc1ccc(NC(=O)NC2CCC(c3ccccc3)CC2)c(C)[nH+]1 ZINC000447166524 338546616 /nfs/dbraw/zinc/54/66/16/338546616.db2.gz FIDFJRSEMZWIPH-UHFFFAOYSA-N 1 2 323.440 4.546 20 0 DJADLO Cc1c2ccccc2oc1[C@@H](C)NC(=O)Nc1ccc(C)[nH+]c1C ZINC000447166521 338546647 /nfs/dbraw/zinc/54/66/47/338546647.db2.gz LBYJUXIDIFWQBF-CQSZACIVSA-N 1 2 323.396 4.636 20 0 DJADLO Cc1cccc(C[NH2+][C@H](C)c2nc(C(C)(C)C)cs2)c1F ZINC000449129309 338595803 /nfs/dbraw/zinc/59/58/03/338595803.db2.gz VAGXTWQRZYMMMY-GFCCVEGCSA-N 1 2 306.450 4.739 20 0 DJADLO CCC(CC)n1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2Cl)n1 ZINC000451105939 338721186 /nfs/dbraw/zinc/72/11/86/338721186.db2.gz KCHGTGWMNCWJFI-LBPRGKRZSA-N 1 2 323.843 4.888 20 0 DJADLO CCO[C@H](C)c1nc(C[NH2+][C@H](C)c2ccc(F)c(C)c2)cs1 ZINC000451161925 338723689 /nfs/dbraw/zinc/72/36/89/338723689.db2.gz MCBLJWPJHVUVRD-CHWSQXEVSA-N 1 2 322.449 4.539 20 0 DJADLO CCn1cc[nH+]c1[C@@H](C)Nc1cccc(OCCC(C)C)c1 ZINC000453162283 338801239 /nfs/dbraw/zinc/80/12/39/338801239.db2.gz KRDLFCGAJGWWOR-OAHLLOKOSA-N 1 2 301.434 4.501 20 0 DJADLO CCCc1ncc(C[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)o1 ZINC000453365573 338832375 /nfs/dbraw/zinc/83/23/75/338832375.db2.gz GVHAESLXIMICPI-JTQLQIEISA-N 1 2 313.228 4.785 20 0 DJADLO CCCc1ncc(C[NH2+][C@H](C)c2cc(Cl)ccc2OCC)o1 ZINC000453388124 338836287 /nfs/dbraw/zinc/83/62/87/338836287.db2.gz OYIQIVQRBNLHAN-GFCCVEGCSA-N 1 2 322.836 4.530 20 0 DJADLO Cc1cc(C)c(NC(=O)N([C@H](C)c2ccccc2)C2CC2)c(C)[nH+]1 ZINC000455520974 338897527 /nfs/dbraw/zinc/89/75/27/338897527.db2.gz MPXRSWCNSGKCSZ-MRXNPFEDSA-N 1 2 323.440 4.764 20 0 DJADLO COc1ccc(-c2ccccc2C)cc1C[NH2+][C@H](C)c1ccon1 ZINC000459494007 339032443 /nfs/dbraw/zinc/03/24/43/339032443.db2.gz ZUOIKWJMXQNUIV-OAHLLOKOSA-N 1 2 322.408 4.509 20 0 DJADLO Cc1nnc([C@H](C)[N@@H+]2CC3(CCCC3)[C@H]2c2ccccc2)s1 ZINC000459575942 339036965 /nfs/dbraw/zinc/03/69/65/339036965.db2.gz LDDZNUXAWPOQFE-XJKSGUPXSA-N 1 2 313.470 4.525 20 0 DJADLO Cc1nnc([C@H](C)[N@H+]2CC3(CCCC3)[C@H]2c2ccccc2)s1 ZINC000459575942 339036966 /nfs/dbraw/zinc/03/69/66/339036966.db2.gz LDDZNUXAWPOQFE-XJKSGUPXSA-N 1 2 313.470 4.525 20 0 DJADLO CC1(CC(F)(F)F)C[NH+](Cc2cscc2C(F)(F)F)C1 ZINC000459631507 339039430 /nfs/dbraw/zinc/03/94/30/339039430.db2.gz CMFJDYYQTDWOKS-UHFFFAOYSA-N 1 2 317.298 4.541 20 0 DJADLO C[C@@H](c1csnn1)[N@@H+]1CC2(CCCCC2)[C@@H]1c1ccccc1 ZINC000459752896 339046273 /nfs/dbraw/zinc/04/62/73/339046273.db2.gz RDYUCPFCSXSQIT-YOEHRIQHSA-N 1 2 313.470 4.607 20 0 DJADLO C[C@@H](c1csnn1)[N@H+]1CC2(CCCCC2)[C@@H]1c1ccccc1 ZINC000459752896 339046274 /nfs/dbraw/zinc/04/62/74/339046274.db2.gz RDYUCPFCSXSQIT-YOEHRIQHSA-N 1 2 313.470 4.607 20 0 DJADLO CC[C@@H]([NH2+][C@H](C)c1ccn(C)n1)c1ccc(Cl)cc1Cl ZINC000459778475 339047987 /nfs/dbraw/zinc/04/79/87/339047987.db2.gz FLHOMWJIZJYGTB-QMTHXVAHSA-N 1 2 312.244 4.529 20 0 DJADLO Cc1nc([C@@H](C)[NH2+][C@H](c2ccc(F)cc2F)C(C)C)cs1 ZINC000462806432 339090282 /nfs/dbraw/zinc/09/02/82/339090282.db2.gz PJUOZGCRQYZBEE-HWPZZCPQSA-N 1 2 310.413 4.778 20 0 DJADLO Cc1nc([C@H](C)[NH2+][C@@H](C)c2nc(C(C)(C)C)cs2)cs1 ZINC000462823057 339092306 /nfs/dbraw/zinc/09/23/06/339092306.db2.gz YDWARRVCHDARDJ-UWVGGRQHSA-N 1 2 309.504 4.617 20 0 DJADLO Cc1cc(N2CCC[C@@H]2c2cccc(C)c2C)nc(C2CC2)[nH+]1 ZINC000462866515 339094980 /nfs/dbraw/zinc/09/49/80/339094980.db2.gz NGRQFKSUVCQDON-GOSISDBHSA-N 1 2 307.441 4.621 20 0 DJADLO c1cc(NCc2ccc(N3CCCC3)[nH+]c2)cc(C2CCC2)c1 ZINC000462869749 339095264 /nfs/dbraw/zinc/09/52/64/339095264.db2.gz HWDNQFWFYYHRLM-UHFFFAOYSA-N 1 2 307.441 4.561 20 0 DJADLO Clc1ccccc1OCc1ccccc1CNc1cccc[nH+]1 ZINC000462871374 339095380 /nfs/dbraw/zinc/09/53/80/339095380.db2.gz OWOFRPASDIFPDR-UHFFFAOYSA-N 1 2 324.811 4.926 20 0 DJADLO COc1ccccc1-c1ccc([C@H](C)Nc2cc(C)[nH+]cn2)cc1 ZINC000462889241 339096265 /nfs/dbraw/zinc/09/62/65/339096265.db2.gz RSTFWNZFVYXURC-HNNXBMFYSA-N 1 2 319.408 4.634 20 0 DJADLO C[C@H](c1ccccc1)[N@H+](Cc1cscn1)Cc1ccccc1 ZINC000462905133 339097181 /nfs/dbraw/zinc/09/71/81/339097181.db2.gz CMSYOZAQXGTTOV-MRXNPFEDSA-N 1 2 308.450 4.907 20 0 DJADLO C[C@H](c1ccccc1)[N@@H+](Cc1cscn1)Cc1ccccc1 ZINC000462905133 339097182 /nfs/dbraw/zinc/09/71/82/339097182.db2.gz CMSYOZAQXGTTOV-MRXNPFEDSA-N 1 2 308.450 4.907 20 0 DJADLO c1c[nH+]c([C@H](Nc2cccc(C3CCC3)c2)c2ccccc2)[nH]1 ZINC000462943732 339098632 /nfs/dbraw/zinc/09/86/32/339098632.db2.gz WYHNGYRZOMCXIP-LJQANCHMSA-N 1 2 303.409 4.879 20 0 DJADLO Fc1ccccc1C1C[NH+](Cc2cscc2C(F)(F)F)C1 ZINC000463026821 339101282 /nfs/dbraw/zinc/10/12/82/339101282.db2.gz AOVODYQKWQJKCT-UHFFFAOYSA-N 1 2 315.335 4.505 20 0 DJADLO Fc1cccc([C@H]2CCC[N@@H+]2Cc2cncc(C(F)(F)F)c2)c1 ZINC000463074414 339104360 /nfs/dbraw/zinc/10/43/60/339104360.db2.gz RDWREMCJUBCAGU-MRXNPFEDSA-N 1 2 324.321 4.577 20 0 DJADLO Fc1cccc([C@H]2CCC[N@H+]2Cc2cncc(C(F)(F)F)c2)c1 ZINC000463074414 339104361 /nfs/dbraw/zinc/10/43/61/339104361.db2.gz RDWREMCJUBCAGU-MRXNPFEDSA-N 1 2 324.321 4.577 20 0 DJADLO Cc1cc(F)cc(C(=O)Nc2ccc3[nH]c(C4CCC4)[nH+]c3c2)c1 ZINC000463625453 339122914 /nfs/dbraw/zinc/12/29/14/339122914.db2.gz RHCRVMQYDGNQIR-UHFFFAOYSA-N 1 2 323.371 4.530 20 0 DJADLO CCCc1nc(C[N@@H+]2C[C@@H](C)C[C@@H]2c2ccccc2F)cs1 ZINC000464725096 339150044 /nfs/dbraw/zinc/15/00/44/339150044.db2.gz LVTYMBCUKQOMDT-SUMWQHHRSA-N 1 2 318.461 4.818 20 0 DJADLO CCCc1nc(C[N@H+]2C[C@@H](C)C[C@@H]2c2ccccc2F)cs1 ZINC000464725096 339150045 /nfs/dbraw/zinc/15/00/45/339150045.db2.gz LVTYMBCUKQOMDT-SUMWQHHRSA-N 1 2 318.461 4.818 20 0 DJADLO Cc1cc(C[N@@H+](C)[C@@H](C)c2ccc(-c3ccccc3)cc2)no1 ZINC000464765480 339151830 /nfs/dbraw/zinc/15/18/30/339151830.db2.gz MPTKPUHMNADHRV-INIZCTEOSA-N 1 2 306.409 4.843 20 0 DJADLO Cc1cc(C[N@H+](C)[C@@H](C)c2ccc(-c3ccccc3)cc2)no1 ZINC000464765480 339151831 /nfs/dbraw/zinc/15/18/31/339151831.db2.gz MPTKPUHMNADHRV-INIZCTEOSA-N 1 2 306.409 4.843 20 0 DJADLO FC(F)(F)C1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000464776302 339152931 /nfs/dbraw/zinc/15/29/31/339152931.db2.gz MYURDRNFCSFRAJ-UHFFFAOYSA-N 1 2 312.162 4.768 20 0 DJADLO C[C@H]1CC[N@H+](Cc2ncc(C(C)(C)C)o2)[C@@H](c2ccco2)C1 ZINC000464851371 339157970 /nfs/dbraw/zinc/15/79/70/339157970.db2.gz GKCGDTJKUOHDMD-UONOGXRCSA-N 1 2 302.418 4.538 20 0 DJADLO C[C@H]1CC[N@@H+](Cc2ncc(C(C)(C)C)o2)[C@@H](c2ccco2)C1 ZINC000464851371 339157971 /nfs/dbraw/zinc/15/79/71/339157971.db2.gz GKCGDTJKUOHDMD-UONOGXRCSA-N 1 2 302.418 4.538 20 0 DJADLO CC[C@@H]1c2ccsc2CC[N@H+]1Cc1nc2ccc(F)cc2o1 ZINC000466805673 339217448 /nfs/dbraw/zinc/21/74/48/339217448.db2.gz XZKDUUBBTHUXDP-CQSZACIVSA-N 1 2 316.401 4.538 20 0 DJADLO CC[C@@H]1c2ccsc2CC[N@@H+]1Cc1nc2ccc(F)cc2o1 ZINC000466805673 339217449 /nfs/dbraw/zinc/21/74/49/339217449.db2.gz XZKDUUBBTHUXDP-CQSZACIVSA-N 1 2 316.401 4.538 20 0 DJADLO C[C@H](c1ccccc1Cl)[N@H+](C)Cc1nc2ccc(F)cc2o1 ZINC000466811814 339217655 /nfs/dbraw/zinc/21/76/55/339217655.db2.gz JQYVCTGSWKYBOV-LLVKDONJSA-N 1 2 318.779 4.813 20 0 DJADLO C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1nc2ccc(F)cc2o1 ZINC000466811814 339217656 /nfs/dbraw/zinc/21/76/56/339217656.db2.gz JQYVCTGSWKYBOV-LLVKDONJSA-N 1 2 318.779 4.813 20 0 DJADLO Fc1cccc(CSCc2[nH+]ccn2Cc2ccccc2)c1 ZINC000467225152 339228701 /nfs/dbraw/zinc/22/87/01/339228701.db2.gz NUKUSRVVWQVYBC-UHFFFAOYSA-N 1 2 312.413 4.504 20 0 DJADLO Cc1cccc(CSCc2[nH+]ccn2Cc2ccccc2)c1 ZINC000467224754 339228773 /nfs/dbraw/zinc/22/87/73/339228773.db2.gz LMXCQOPXTQMQMJ-UHFFFAOYSA-N 1 2 308.450 4.673 20 0 DJADLO CC(C)(C)C[C@H]([NH2+][C@@H]1CCC[C@@H]([C@H]2CCOC2)C1)C(F)(F)F ZINC000467346842 339232945 /nfs/dbraw/zinc/23/29/45/339232945.db2.gz QQRVUJKUGYJZLP-BARDWOONSA-N 1 2 321.427 4.538 20 0 DJADLO C[C@H]1C[C@H](c2ccccc2)CC[N@@H+]1Cc1ncc(Cl)s1 ZINC000467549820 339241878 /nfs/dbraw/zinc/24/18/78/339241878.db2.gz CWPQKXWIYVXJKM-GXTWGEPZSA-N 1 2 306.862 4.565 20 0 DJADLO C[C@H]1C[C@H](c2ccccc2)CC[N@H+]1Cc1ncc(Cl)s1 ZINC000467549820 339241879 /nfs/dbraw/zinc/24/18/79/339241879.db2.gz CWPQKXWIYVXJKM-GXTWGEPZSA-N 1 2 306.862 4.565 20 0 DJADLO Cc1cc(SC2CCCCC2)ccc1NCc1[nH+]ccn1C ZINC000467760802 339245982 /nfs/dbraw/zinc/24/59/82/339245982.db2.gz WBMCHPSEBAAVNK-UHFFFAOYSA-N 1 2 315.486 4.765 20 0 DJADLO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(Cl)c(F)c2)o1 ZINC000468695576 339268947 /nfs/dbraw/zinc/26/89/47/339268947.db2.gz GFVZRUCDBJSKRJ-INIZCTEOSA-N 1 2 323.795 4.556 20 0 DJADLO COCc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(Cl)c(F)c2)o1 ZINC000468695576 339268948 /nfs/dbraw/zinc/26/89/48/339268948.db2.gz GFVZRUCDBJSKRJ-INIZCTEOSA-N 1 2 323.795 4.556 20 0 DJADLO C[C@@H]1CCC[C@@H]1CC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000469508642 339292088 /nfs/dbraw/zinc/29/20/88/339292088.db2.gz NTMWMGYQILKTDY-HUUCEWRRSA-N 1 2 310.397 4.639 20 0 DJADLO Cc1nc(N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)cc[nH+]1 ZINC000469560356 339293368 /nfs/dbraw/zinc/29/33/68/339293368.db2.gz LOPNIZYPKRQVHG-HNNXBMFYSA-N 1 2 321.346 4.535 20 0 DJADLO C[C@@H](c1ccccc1Cl)[N@H+](Cc1ccc(F)cn1)C1CC1 ZINC000469579083 339293564 /nfs/dbraw/zinc/29/35/64/339293564.db2.gz RWOUXZVUMFCTDU-LBPRGKRZSA-N 1 2 304.796 4.600 20 0 DJADLO C[C@@H](c1ccccc1Cl)[N@@H+](Cc1ccc(F)cn1)C1CC1 ZINC000469579083 339293565 /nfs/dbraw/zinc/29/35/65/339293565.db2.gz RWOUXZVUMFCTDU-LBPRGKRZSA-N 1 2 304.796 4.600 20 0 DJADLO C[C@H]1C[N@H+](Cc2cccc(C(F)F)c2)[C@@H](c2ccccc2)CO1 ZINC000470762032 339326937 /nfs/dbraw/zinc/32/69/37/339326937.db2.gz OCYIDHRSXPSQJC-KBXCAEBGSA-N 1 2 317.379 4.586 20 0 DJADLO C[C@H]1C[N@@H+](Cc2cccc(C(F)F)c2)[C@@H](c2ccccc2)CO1 ZINC000470762032 339326938 /nfs/dbraw/zinc/32/69/38/339326938.db2.gz OCYIDHRSXPSQJC-KBXCAEBGSA-N 1 2 317.379 4.586 20 0 DJADLO CCCn1c(C(=O)Nc2c(C)cc(C)[nH+]c2C)cc2ccccc21 ZINC000470907524 339330806 /nfs/dbraw/zinc/33/08/06/339330806.db2.gz SKDHCJFSZHCFNN-UHFFFAOYSA-N 1 2 321.424 4.624 20 0 DJADLO CC(C)CCc1nc(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)cs1 ZINC000470960385 339333076 /nfs/dbraw/zinc/33/30/76/339333076.db2.gz RTKSSGAAEVVPGO-WCQYABFASA-N 1 2 320.424 4.504 20 0 DJADLO CC(C)CCc1nc(C[N@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)cs1 ZINC000470960385 339333077 /nfs/dbraw/zinc/33/30/77/339333077.db2.gz RTKSSGAAEVVPGO-WCQYABFASA-N 1 2 320.424 4.504 20 0 DJADLO Cc1ccc([C@H]([NH2+]Cc2ccccc2Cl)c2ccccn2)cc1 ZINC000471080084 339336677 /nfs/dbraw/zinc/33/66/77/339336677.db2.gz URALWGDEAPCDHD-FQEVSTJZSA-N 1 2 322.839 4.923 20 0 DJADLO CC(C)c1nc(N2CCCC[C@H]2c2cc3ccccc3[nH]2)cc[nH+]1 ZINC000471746330 339352965 /nfs/dbraw/zinc/35/29/65/339352965.db2.gz KNMWQKYJLLYRSL-SFHVURJKSA-N 1 2 320.440 4.813 20 0 DJADLO Fc1cc2[nH+]cn(CC3CCC(C(F)(F)F)CC3)c2cc1F ZINC000471856662 339356241 /nfs/dbraw/zinc/35/62/41/339356241.db2.gz MFMSAQCJSYFACZ-UHFFFAOYSA-N 1 2 318.289 4.683 20 0 DJADLO Cc1ccc(C[NH2+]Cc2ncc(Cl)s2)c(OC(C)(C)C)c1 ZINC000472073426 339362582 /nfs/dbraw/zinc/36/25/82/339362582.db2.gz JZHKHBGYGNGPKS-UHFFFAOYSA-N 1 2 324.877 4.572 20 0 DJADLO C[C@H]1CC[N@@H+](Cc2ncc(C(C)(C)C)o2)[C@@H]1c1cccc(F)c1 ZINC000472317776 339369693 /nfs/dbraw/zinc/36/96/93/339369693.db2.gz JQYHUALCUFXRIM-UGSOOPFHSA-N 1 2 316.420 4.694 20 0 DJADLO C[C@H]1CC[N@H+](Cc2ncc(C(C)(C)C)o2)[C@@H]1c1cccc(F)c1 ZINC000472317776 339369692 /nfs/dbraw/zinc/36/96/92/339369692.db2.gz JQYHUALCUFXRIM-UGSOOPFHSA-N 1 2 316.420 4.694 20 0 DJADLO C[C@H](c1ccccc1Cl)[N@@H+]1CCO[C@@H](c2cccs2)C1 ZINC000472806757 339377811 /nfs/dbraw/zinc/37/78/11/339377811.db2.gz CDVILCLZHSWBKM-IUODEOHRSA-N 1 2 307.846 4.536 20 0 DJADLO C[C@H](c1ccccc1Cl)[N@H+]1CCO[C@@H](c2cccs2)C1 ZINC000472806757 339377812 /nfs/dbraw/zinc/37/78/12/339377812.db2.gz CDVILCLZHSWBKM-IUODEOHRSA-N 1 2 307.846 4.536 20 0 DJADLO Fc1ccc([C@H]2CCCC[N@@H+]2Cc2ccncc2Cl)cc1 ZINC000473034438 339380473 /nfs/dbraw/zinc/38/04/73/339380473.db2.gz JDCVNBZKUZGYIO-QGZVFWFLSA-N 1 2 304.796 4.601 20 0 DJADLO Fc1ccc([C@H]2CCCC[N@H+]2Cc2ccncc2Cl)cc1 ZINC000473034438 339380474 /nfs/dbraw/zinc/38/04/74/339380474.db2.gz JDCVNBZKUZGYIO-QGZVFWFLSA-N 1 2 304.796 4.601 20 0 DJADLO CC(C)c1ccc(C[N@@H+]2CCSC[C@H]2c2nccs2)cc1 ZINC000473070195 339380925 /nfs/dbraw/zinc/38/09/25/339380925.db2.gz CZZJLOJKUASVSA-INIZCTEOSA-N 1 2 318.511 4.557 20 0 DJADLO CC(C)c1ccc(C[N@H+]2CCSC[C@H]2c2nccs2)cc1 ZINC000473070195 339380926 /nfs/dbraw/zinc/38/09/26/339380926.db2.gz CZZJLOJKUASVSA-INIZCTEOSA-N 1 2 318.511 4.557 20 0 DJADLO Cc1ccc([C@H]2CCCCC[N@@H+]2Cc2ncc(Cl)s2)o1 ZINC000473140196 339382283 /nfs/dbraw/zinc/38/22/83/339382283.db2.gz DOFWLPSBNQZPKE-GFCCVEGCSA-N 1 2 310.850 4.815 20 0 DJADLO Cc1ccc([C@H]2CCCCC[N@H+]2Cc2ncc(Cl)s2)o1 ZINC000473140196 339382284 /nfs/dbraw/zinc/38/22/84/339382284.db2.gz DOFWLPSBNQZPKE-GFCCVEGCSA-N 1 2 310.850 4.815 20 0 DJADLO CCOc1ccc(C[N@H+](Cc2ncc(Cl)s2)C(C)C)cc1 ZINC000473141171 339382350 /nfs/dbraw/zinc/38/23/50/339382350.db2.gz FUQZYAHVDZBHJD-UHFFFAOYSA-N 1 2 324.877 4.606 20 0 DJADLO CCOc1ccc(C[N@@H+](Cc2ncc(Cl)s2)C(C)C)cc1 ZINC000473141171 339382351 /nfs/dbraw/zinc/38/23/51/339382351.db2.gz FUQZYAHVDZBHJD-UHFFFAOYSA-N 1 2 324.877 4.606 20 0 DJADLO COc1c2ccccc2oc1C[NH2+]Cc1ccc(Cl)cc1F ZINC000473992470 339396554 /nfs/dbraw/zinc/39/65/54/339396554.db2.gz DKJJIDRHMMACAS-UHFFFAOYSA-N 1 2 319.763 4.524 20 0 DJADLO C[C@@H]([NH2+]Cc1ncc(Cl)s1)c1cc2cccc(F)c2o1 ZINC000474010786 339396924 /nfs/dbraw/zinc/39/69/24/339396924.db2.gz QDTMGFCUXPWLDN-MRVPVSSYSA-N 1 2 310.781 4.533 20 0 DJADLO Cc1ccc([C@H]([NH2+]Cc2cc(C)ccc2F)c2ccccn2)cc1 ZINC000475344706 339448239 /nfs/dbraw/zinc/44/82/39/339448239.db2.gz ZLHRZVHDPJCIPP-NRFANRHFSA-N 1 2 320.411 4.717 20 0 DJADLO CC1(C)CCC[C@@H]1C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000475913410 339464838 /nfs/dbraw/zinc/46/48/38/339464838.db2.gz XYOXULXQBWPEOJ-QGZVFWFLSA-N 1 2 310.397 4.639 20 0 DJADLO CC[C@@H]1CCCC[C@@H]1C(=O)Nc1ccccc1-c1[nH]cc(C)[nH+]1 ZINC000476391244 339475911 /nfs/dbraw/zinc/47/59/11/339475911.db2.gz UOLSODGVJZOQKC-CABCVRRESA-N 1 2 311.429 4.540 20 0 DJADLO Cc1ccc(CNc2ccccc2COc2ccccc2)c(C)[nH+]1 ZINC000478373850 339514317 /nfs/dbraw/zinc/51/43/17/339514317.db2.gz UPXZHOQTNFFMGE-UHFFFAOYSA-N 1 2 318.420 4.890 20 0 DJADLO CCCCn1cc[nH+]c1-c1cccc(NC(=O)c2ccccc2)c1 ZINC000478632393 339519667 /nfs/dbraw/zinc/51/96/67/339519667.db2.gz JWENNHBJEZFWPU-UHFFFAOYSA-N 1 2 319.408 4.603 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1ccc(Cl)cn1 ZINC000480187076 339562570 /nfs/dbraw/zinc/56/25/70/339562570.db2.gz ZHAZLDMSPYEXIJ-KUHUBIRLSA-N 1 2 323.827 4.570 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1ccc2ccccc2n1)c1c(F)cccc1F ZINC000480915122 339590683 /nfs/dbraw/zinc/59/06/83/339590683.db2.gz SBSDRIQFOOGBOS-QWHCGFSZSA-N 1 2 312.363 4.925 20 0 DJADLO CCC[C@@H](CC)NC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000485354460 339701866 /nfs/dbraw/zinc/70/18/66/339701866.db2.gz GHTBYOUJLXKABN-CQSZACIVSA-N 1 2 313.401 4.574 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H](CC(C)C)c1cccs1 ZINC000485452466 339703494 /nfs/dbraw/zinc/70/34/94/339703494.db2.gz PHQIXNMWXBEZOX-CQSZACIVSA-N 1 2 317.458 4.669 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1C[C@H](C(C)C)c2ccccc21 ZINC000485530067 339705133 /nfs/dbraw/zinc/70/51/33/339705133.db2.gz SZRXASNALFLVNZ-QZTJIDSGSA-N 1 2 323.440 4.705 20 0 DJADLO Cc1ccc(CN(C(=O)Nc2c(C)cc[nH+]c2C)C2CC2)cc1C ZINC000485530941 339705135 /nfs/dbraw/zinc/70/51/35/339705135.db2.gz WYFHDKZIEJEYHM-UHFFFAOYSA-N 1 2 323.440 4.512 20 0 DJADLO Cc1ccc(NC(=O)N[C@H]2CCC[C@@H](c3ccccc3)C2)c(C)[nH+]1 ZINC000486912110 339737944 /nfs/dbraw/zinc/73/79/44/339737944.db2.gz IXYFTVSQSPGMFZ-MSOLQXFVSA-N 1 2 323.440 4.546 20 0 DJADLO CC(C)c1cc(N2CC(C)(C)[C@@H]2c2cccnc2)nc(C(C)C)[nH+]1 ZINC000488508779 339786011 /nfs/dbraw/zinc/78/60/11/339786011.db2.gz UDXGCUXDLXTVEA-SFHVURJKSA-N 1 2 324.472 4.706 20 0 DJADLO Cc1ccc([C@H]([NH2+]Cc2ccn(C(C)C)n2)c2ccccc2)cc1 ZINC000493278749 339921853 /nfs/dbraw/zinc/92/18/53/339921853.db2.gz VRSQRCIPFQZMHQ-OAQYLSRUSA-N 1 2 319.452 4.652 20 0 DJADLO CCCc1csc(C[NH2+][C@H](C)c2nc(C(C)(C)C)cs2)n1 ZINC000494076771 339940582 /nfs/dbraw/zinc/94/05/82/339940582.db2.gz DSPLLCCDKBNAKY-LLVKDONJSA-N 1 2 323.531 4.700 20 0 DJADLO CCCc1csc(C[NH2+]C(c2ccccc2)c2ccccc2)n1 ZINC000494329202 339946822 /nfs/dbraw/zinc/94/68/22/339946822.db2.gz MWNYEVMQPCPGDC-UHFFFAOYSA-N 1 2 322.477 4.975 20 0 DJADLO O=C(Nc1ccc(Cl)cc1)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000496067940 339997664 /nfs/dbraw/zinc/99/76/64/339997664.db2.gz FCRYGZAPKHDQNN-UHFFFAOYSA-N 1 2 324.767 4.780 20 0 DJADLO C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)c1cc[nH+]c(C2CC2)n1 ZINC000498974852 340027388 /nfs/dbraw/zinc/02/73/88/340027388.db2.gz CNECBOGBDKJLHO-JTQLQIEISA-N 1 2 322.239 4.858 20 0 DJADLO C[C@H]1C[C@@]1([NH2+]Cc1csc(C2CC2)n1)c1ccc(Cl)cc1 ZINC000500414218 340057420 /nfs/dbraw/zinc/05/74/20/340057420.db2.gz GLTQZDJRRUJVMY-GTNSWQLSSA-N 1 2 318.873 4.699 20 0 DJADLO Cc1ncc(C[N@@H+](C)[C@H](C)c2ccc(Cl)cc2Cl)s1 ZINC000501267209 340077648 /nfs/dbraw/zinc/07/76/48/340077648.db2.gz RNVJEEDRYYZVEO-SECBINFHSA-N 1 2 315.269 4.951 20 0 DJADLO Cc1ncc(C[N@H+](C)[C@H](C)c2ccc(Cl)cc2Cl)s1 ZINC000501267209 340077649 /nfs/dbraw/zinc/07/76/49/340077649.db2.gz RNVJEEDRYYZVEO-SECBINFHSA-N 1 2 315.269 4.951 20 0 DJADLO Cc1ccc([C@H]([NH2+]Cc2nccn2C(C)C)c2ccccc2)cc1 ZINC000501327730 340078641 /nfs/dbraw/zinc/07/86/41/340078641.db2.gz BOZVIFSNGFCBSU-OAQYLSRUSA-N 1 2 319.452 4.652 20 0 DJADLO CCCN(Cc1[nH+]ccn1C(C)C)Cc1c(F)cccc1Cl ZINC000501329625 340078761 /nfs/dbraw/zinc/07/87/61/340078761.db2.gz ZCDSYGFTFDSRFS-UHFFFAOYSA-N 1 2 323.843 4.669 20 0 DJADLO C[C@@H]([NH2+]Cc1ccc(Cl)o1)c1nc(-c2ccccc2)cs1 ZINC000501351913 340078968 /nfs/dbraw/zinc/07/89/68/340078968.db2.gz QIEQIUPBWDZUNA-LLVKDONJSA-N 1 2 318.829 4.907 20 0 DJADLO CC(C)c1nc([C@@H](C)[NH2+][C@H](C)c2nc3c(s2)CCC3)cs1 ZINC000502042061 340093782 /nfs/dbraw/zinc/09/37/82/340093782.db2.gz JSBXELUNVWQPLY-GHMZBOCLSA-N 1 2 321.515 4.624 20 0 DJADLO CCC[C@@H](C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccccc1 ZINC000502539742 340107149 /nfs/dbraw/zinc/10/71/49/340107149.db2.gz KCDZLIOHKPUSTN-GOSISDBHSA-N 1 2 319.408 4.599 20 0 DJADLO Cc1cc(F)cc2c1C[N@H+]([C@@H](C)c1ncc(C(C)(C)C)o1)CC2 ZINC000502874345 340115267 /nfs/dbraw/zinc/11/52/67/340115267.db2.gz FQZZCXILKGOVCD-ZDUSSCGKSA-N 1 2 316.420 4.539 20 0 DJADLO Cc1cc(F)cc2c1C[N@@H+]([C@@H](C)c1ncc(C(C)(C)C)o1)CC2 ZINC000502874345 340115268 /nfs/dbraw/zinc/11/52/68/340115268.db2.gz FQZZCXILKGOVCD-ZDUSSCGKSA-N 1 2 316.420 4.539 20 0 DJADLO CCCc1nc(C[NH2+][C@@]2(c3ccc(Cl)cc3)C[C@H]2C)cs1 ZINC000503412441 340127634 /nfs/dbraw/zinc/12/76/34/340127634.db2.gz URRDTOYQKREUBR-PXAZEXFGSA-N 1 2 320.889 4.774 20 0 DJADLO C[C@@H]([NH2+]C1(C(F)F)CC1)c1ccc(OCc2ccccc2)cc1 ZINC000503945492 340138048 /nfs/dbraw/zinc/13/80/48/340138048.db2.gz GZXVHCAYSZEJDO-CQSZACIVSA-N 1 2 317.379 4.714 20 0 DJADLO Cc1cc(C(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)ccc1F ZINC000504686973 340151184 /nfs/dbraw/zinc/15/11/84/340151184.db2.gz MECKJULNSRMONE-UHFFFAOYSA-N 1 2 322.339 4.574 20 0 DJADLO CC(C)(C)CC(=O)Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000504724136 340151751 /nfs/dbraw/zinc/15/17/51/340151751.db2.gz DIRLGHHMIJSESX-UHFFFAOYSA-N 1 2 318.804 4.902 20 0 DJADLO CC[C@H](C)C(=O)Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000504744922 340151942 /nfs/dbraw/zinc/15/19/42/340151942.db2.gz HNEWZXFNYNDCCS-NSHDSACASA-N 1 2 304.777 4.512 20 0 DJADLO c1ccc([C@@H](Nc2ccc3ccccc3[nH+]2)[C@@H]2CCCO2)cc1 ZINC000505779582 340177786 /nfs/dbraw/zinc/17/77/86/340177786.db2.gz YHEJKNIZAVSGCS-AZUAARDMSA-N 1 2 304.393 4.567 20 0 DJADLO CC(C)c1[nH]ccc1C(=O)Nc1ccc2[nH]c(C(C)(C)C)[nH+]c2c1 ZINC000505887219 340180821 /nfs/dbraw/zinc/18/08/21/340180821.db2.gz UQVWBGSBLCPRBN-UHFFFAOYSA-N 1 2 324.428 4.564 20 0 DJADLO Cc1nc(C)c(C[N@@H+](C)Cc2cccc(Cl)c2Cl)s1 ZINC000506756546 340201015 /nfs/dbraw/zinc/20/10/15/340201015.db2.gz AAIGGSCIBDWPTR-UHFFFAOYSA-N 1 2 315.269 4.699 20 0 DJADLO Cc1nc(C)c(C[N@H+](C)Cc2cccc(Cl)c2Cl)s1 ZINC000506756546 340201016 /nfs/dbraw/zinc/20/10/16/340201016.db2.gz AAIGGSCIBDWPTR-UHFFFAOYSA-N 1 2 315.269 4.699 20 0 DJADLO CC(C)c1nc(C[N@H+]([C@@H](C)c2ccccc2)C2CC2)cs1 ZINC000506546592 340196456 /nfs/dbraw/zinc/19/64/56/340196456.db2.gz MVYXDYCNJJOULD-AWEZNQCLSA-N 1 2 300.471 4.992 20 0 DJADLO CC(C)c1nc(C[N@@H+]([C@@H](C)c2ccccc2)C2CC2)cs1 ZINC000506546592 340196457 /nfs/dbraw/zinc/19/64/57/340196457.db2.gz MVYXDYCNJJOULD-AWEZNQCLSA-N 1 2 300.471 4.992 20 0 DJADLO Fc1cc2[nH+]cn(CCOc3ccc4ccccc4c3)c2cc1F ZINC000506935274 340203919 /nfs/dbraw/zinc/20/39/19/340203919.db2.gz VYFXHWWWIRRYHH-UHFFFAOYSA-N 1 2 324.330 4.547 20 0 DJADLO CCCCc1nc(C[N@@H+]2CCCCC[C@H]2c2ccccc2)no1 ZINC000506943925 340204070 /nfs/dbraw/zinc/20/40/70/340204070.db2.gz JIWCAQXZTMAPMD-KRWDZBQOSA-N 1 2 313.445 4.530 20 0 DJADLO CCCCc1nc(C[N@H+]2CCCCC[C@H]2c2ccccc2)no1 ZINC000506943925 340204071 /nfs/dbraw/zinc/20/40/71/340204071.db2.gz JIWCAQXZTMAPMD-KRWDZBQOSA-N 1 2 313.445 4.530 20 0 DJADLO Fc1ccc2c(c1)[C@H](Nc1ccc3ccccc3[nH+]1)CCCO2 ZINC000506961622 340204458 /nfs/dbraw/zinc/20/44/58/340204458.db2.gz JDZRZWQUWIATLZ-QGZVFWFLSA-N 1 2 308.356 4.700 20 0 DJADLO Cc1csc(C[N@@H+](C)[C@H](C)c2cccc(C(F)(F)F)c2)n1 ZINC000507196636 340212538 /nfs/dbraw/zinc/21/25/38/340212538.db2.gz YKKAFLFSKBIASH-LLVKDONJSA-N 1 2 314.376 4.663 20 0 DJADLO Cc1csc(C[N@H+](C)[C@H](C)c2cccc(C(F)(F)F)c2)n1 ZINC000507196636 340212539 /nfs/dbraw/zinc/21/25/39/340212539.db2.gz YKKAFLFSKBIASH-LLVKDONJSA-N 1 2 314.376 4.663 20 0 DJADLO CCc1cccnc1[C@H](C)[NH2+][C@@H](c1ccco1)c1ccccc1 ZINC000507520809 340224131 /nfs/dbraw/zinc/22/41/31/340224131.db2.gz UBBCWJGDEIXGIC-MGPUTAFESA-N 1 2 306.409 4.677 20 0 DJADLO FC(F)(F)CCCCSCc1cn2cc(Cl)ccc2[nH+]1 ZINC000507626263 340226936 /nfs/dbraw/zinc/22/69/36/340226936.db2.gz MFCXPSPAXSEVAJ-UHFFFAOYSA-N 1 2 322.783 4.954 20 0 DJADLO CCCc1nc(C[N@H+](CC)[C@H](C)c2ccc(F)cc2)cs1 ZINC000507723159 340229604 /nfs/dbraw/zinc/22/96/04/340229604.db2.gz FXOBPHDIFOFRPY-CYBMUJFWSA-N 1 2 306.450 4.818 20 0 DJADLO CCCc1nc(C[N@@H+](CC)[C@H](C)c2ccc(F)cc2)cs1 ZINC000507723159 340229605 /nfs/dbraw/zinc/22/96/05/340229605.db2.gz FXOBPHDIFOFRPY-CYBMUJFWSA-N 1 2 306.450 4.818 20 0 DJADLO C[C@@H](c1cccc(F)c1)[N@@H+]1CCO[C@H](c2ccccc2Cl)C1 ZINC000507786807 340231462 /nfs/dbraw/zinc/23/14/62/340231462.db2.gz BLNFRURUNVLQOZ-UGSOOPFHSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@@H](c1cccc(F)c1)[N@H+]1CCO[C@H](c2ccccc2Cl)C1 ZINC000507786807 340231463 /nfs/dbraw/zinc/23/14/63/340231463.db2.gz BLNFRURUNVLQOZ-UGSOOPFHSA-N 1 2 319.807 4.614 20 0 DJADLO Cc1c2cccc(Cl)c2sc1C[N@H+](C)Cc1cscn1 ZINC000507811635 340232658 /nfs/dbraw/zinc/23/26/58/340232658.db2.gz ZRDURIREDFHSBE-UHFFFAOYSA-N 1 2 322.886 4.952 20 0 DJADLO Cc1c2cccc(Cl)c2sc1C[N@@H+](C)Cc1cscn1 ZINC000507811635 340232659 /nfs/dbraw/zinc/23/26/59/340232659.db2.gz ZRDURIREDFHSBE-UHFFFAOYSA-N 1 2 322.886 4.952 20 0 DJADLO C[C@@H]([NH2+][C@@H]1CCc2c1c(F)ccc2F)c1c(F)cccc1F ZINC000507850440 340233998 /nfs/dbraw/zinc/23/39/98/340233998.db2.gz GYVKBGGOVPYKLG-RFAUZJTJSA-N 1 2 309.306 4.581 20 0 DJADLO CCCCc1[nH]c2ccc(NC(=O)c3cc[nH]c3C(C)C)cc2[nH+]1 ZINC000508708310 340251090 /nfs/dbraw/zinc/25/10/90/340251090.db2.gz ZNWUVTLWGHHXLM-UHFFFAOYSA-N 1 2 324.428 4.609 20 0 DJADLO CCc1ccc(NC(=O)c2ccccc2Oc2cc[nH+]cc2)cc1 ZINC000509028656 340258778 /nfs/dbraw/zinc/25/87/78/340258778.db2.gz FMGPUNCHRVOZQL-UHFFFAOYSA-N 1 2 318.376 4.689 20 0 DJADLO CC(C)(C)c1nc(C[N@H+](Cc2ccc(F)cc2)C2CC2)cs1 ZINC000509052023 340259569 /nfs/dbraw/zinc/25/95/69/340259569.db2.gz HZPGYLPGXZKRID-UHFFFAOYSA-N 1 2 318.461 4.744 20 0 DJADLO CC(C)(C)c1nc(C[N@@H+](Cc2ccc(F)cc2)C2CC2)cs1 ZINC000509052023 340259570 /nfs/dbraw/zinc/25/95/70/340259570.db2.gz HZPGYLPGXZKRID-UHFFFAOYSA-N 1 2 318.461 4.744 20 0 DJADLO CC[C@@H]1CCCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)CC1 ZINC000509399170 340268262 /nfs/dbraw/zinc/26/82/62/340268262.db2.gz FXTTXEAIHATGIB-MRXNPFEDSA-N 1 2 324.424 4.526 20 0 DJADLO C[N@H+](Cc1coc(-c2ccccc2)n1)Cc1ccccc1Cl ZINC000302764827 340281750 /nfs/dbraw/zinc/28/17/50/340281750.db2.gz ZMXDVVMASNZFLV-UHFFFAOYSA-N 1 2 312.800 4.627 20 0 DJADLO C[N@@H+](Cc1coc(-c2ccccc2)n1)Cc1ccccc1Cl ZINC000302764827 340281751 /nfs/dbraw/zinc/28/17/51/340281751.db2.gz ZMXDVVMASNZFLV-UHFFFAOYSA-N 1 2 312.800 4.627 20 0 DJADLO C[C@@H]1CCC[C@H](C)N(C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000509936035 340283190 /nfs/dbraw/zinc/28/31/90/340283190.db2.gz ZVYPKYSJIBFFKE-CVEARBPZSA-N 1 2 324.424 4.525 20 0 DJADLO Cc1cc2[nH+]cn(Cc3csc(CCC(C)C)n3)c2cc1C ZINC000303098595 340301871 /nfs/dbraw/zinc/30/18/71/340301871.db2.gz GRJHMXZYIVFFCN-UHFFFAOYSA-N 1 2 313.470 4.747 20 0 DJADLO Cc1cc2[nH+]cn(Cc3c(Cl)ccc4cccnc43)c2cc1C ZINC000510865337 340313338 /nfs/dbraw/zinc/31/33/38/340313338.db2.gz WPRGJCRZEUHZPU-UHFFFAOYSA-N 1 2 321.811 4.903 20 0 DJADLO CC[C@H](CC1CCCC1)C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000511549643 340330182 /nfs/dbraw/zinc/33/01/82/340330182.db2.gz DWVJNORRPIOLJS-OAHLLOKOSA-N 1 2 311.429 4.622 20 0 DJADLO Clc1ccc([C@H]2CC[N@@H+]2Cc2coc(-c3ccccc3)n2)cc1 ZINC000511575407 340331025 /nfs/dbraw/zinc/33/10/25/340331025.db2.gz MVQIHPHWXAQHBX-GOSISDBHSA-N 1 2 324.811 4.942 20 0 DJADLO Clc1ccc([C@H]2CC[N@H+]2Cc2coc(-c3ccccc3)n2)cc1 ZINC000511575407 340331026 /nfs/dbraw/zinc/33/10/26/340331026.db2.gz MVQIHPHWXAQHBX-GOSISDBHSA-N 1 2 324.811 4.942 20 0 DJADLO Cc1cc([C@H](C)Nc2ccc(C)[nH+]c2)sc1Br ZINC000512068331 340347565 /nfs/dbraw/zinc/34/75/65/340347565.db2.gz QTMBXQWKBHYSJE-JTQLQIEISA-N 1 2 311.248 4.696 20 0 DJADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1csc(Cl)c1Cl ZINC000513042136 340390463 /nfs/dbraw/zinc/39/04/63/340390463.db2.gz VOCSSQALKGPAGQ-UHFFFAOYSA-N 1 2 319.257 4.685 20 0 DJADLO Cc1cnc([C@@H](C)[NH2+][C@@H](C)c2cc(F)c(Cl)cc2Cl)o1 ZINC000220890053 340519768 /nfs/dbraw/zinc/51/97/68/340519768.db2.gz OBYUYPFCJQCGJU-DTWKUNHWSA-N 1 2 317.191 4.841 20 0 DJADLO Cc1cc(NC(=O)c2ccccc2F)ccc1Oc1cc[nH+]cc1 ZINC000193186989 340573782 /nfs/dbraw/zinc/57/37/82/340573782.db2.gz OHEXJUAPSAIZST-UHFFFAOYSA-N 1 2 322.339 4.574 20 0 DJADLO Cc1cc(C)c(NC(=O)CCc2ccc3ccccc3c2)c(C)[nH+]1 ZINC000193785387 340583088 /nfs/dbraw/zinc/58/30/88/340583088.db2.gz NVGFBKSZRBXVTP-UHFFFAOYSA-N 1 2 318.420 4.731 20 0 DJADLO Clc1ccc2[nH+]cc(/C=C/c3ccc4ccccc4n3)n2c1 ZINC000523103888 340615579 /nfs/dbraw/zinc/61/55/79/340615579.db2.gz MVMOQJAXYRULST-CMDGGOBGSA-N 1 2 305.768 4.706 20 0 DJADLO CC(C)([NH2+]Cc1c(Cl)oc2ccccc21)c1nccs1 ZINC000230347222 340619778 /nfs/dbraw/zinc/61/97/78/340619778.db2.gz HSRFNJWUJYEOCH-UHFFFAOYSA-N 1 2 306.818 4.568 20 0 DJADLO C[C@H](Nc1ccc(N2CCCC2)[nH+]c1)c1ccc(Cl)s1 ZINC000036982177 340726118 /nfs/dbraw/zinc/72/61/18/340726118.db2.gz NFLFMKRYHFBCBR-NSHDSACASA-N 1 2 307.850 4.570 20 0 DJADLO Cc1cccc([C@@H]([NH2+]Cc2nc(C3CCCC3)no2)C(C)C)c1 ZINC000528766218 340733116 /nfs/dbraw/zinc/73/31/16/340733116.db2.gz HIMQHTANYYPGLK-SFHVURJKSA-N 1 2 313.445 4.523 20 0 DJADLO CC[C@H]([NH2+][C@H](C)c1nc(C(C)C)no1)c1cc(C)ccc1C ZINC000528802010 340735053 /nfs/dbraw/zinc/73/50/53/340735053.db2.gz PWJWYAFJUFIJPN-ZBFHGGJFSA-N 1 2 301.434 4.612 20 0 DJADLO Cc1cccc([C@H](C)[NH2+][C@@H](C)c2noc(-c3ccccc3)n2)c1C ZINC000124291253 340798220 /nfs/dbraw/zinc/79/82/20/340798220.db2.gz YUEYEYKYLYHPKW-HOTGVXAUSA-N 1 2 321.424 4.765 20 0 DJADLO C[C@@H]([NH2+]Cc1csc(-c2ccco2)n1)c1ccc(F)cc1F ZINC000067966829 340874932 /nfs/dbraw/zinc/87/49/32/340874932.db2.gz DKGQVIHOOXIBGU-SNVBAGLBSA-N 1 2 320.364 4.532 20 0 DJADLO CCCCc1nc(C[NH2+][C@@H](CC(C)C)c2ccccc2C)no1 ZINC000539261630 340878747 /nfs/dbraw/zinc/87/87/47/340878747.db2.gz UBWRUAHRDKBXRG-KRWDZBQOSA-N 1 2 315.461 4.598 20 0 DJADLO CCOc1ccccc1[C@H](CC(C)C)[NH2+]Cc1ncc(CC)o1 ZINC000539331455 340881479 /nfs/dbraw/zinc/88/14/79/340881479.db2.gz MQUSBWUJSFZBTH-KRWDZBQOSA-N 1 2 316.445 4.513 20 0 DJADLO Cc1csc(C2([NH2+][C@@H](C)c3ccc(F)cc3Cl)CCC2)n1 ZINC000539633447 340893840 /nfs/dbraw/zinc/89/38/40/340893840.db2.gz UCBZYINMLKIAPL-NSHDSACASA-N 1 2 324.852 4.974 20 0 DJADLO CSCc1ccc(N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000539734288 340897862 /nfs/dbraw/zinc/89/78/62/340897862.db2.gz ISEXWDHNFVKFBM-HNNXBMFYSA-N 1 2 323.465 4.908 20 0 DJADLO CC(C)CCc1nc(C[NH2+]C2(c3cccc(F)c3)CC2)cs1 ZINC000540389551 340929223 /nfs/dbraw/zinc/92/92/23/340929223.db2.gz NZOXVWCCTGWQCP-UHFFFAOYSA-N 1 2 318.461 4.650 20 0 DJADLO CC(C)(C)c1cnc(C[NH2+][C@H](c2ccc(Cl)cc2)C2CC2)o1 ZINC000540468537 340932610 /nfs/dbraw/zinc/93/26/10/340932610.db2.gz XOMFFKSVMLHKMT-KRWDZBQOSA-N 1 2 318.848 4.866 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1cc(F)c(Cl)cc1Cl)c1ccon1 ZINC000542699561 341017444 /nfs/dbraw/zinc/01/74/44/341017444.db2.gz JHIHQUCFSWAXII-YUMQZZPRSA-N 1 2 303.164 4.532 20 0 DJADLO CCc1cnc(C[NH2+][C@H](C)c2ccc(Cl)cc2Cl)s1 ZINC000130541431 341027183 /nfs/dbraw/zinc/02/71/83/341027183.db2.gz DOKBWXCWJHJZHA-SECBINFHSA-N 1 2 315.269 4.863 20 0 DJADLO CC(C)c1ccccc1NC(=O)[C@H](C)[N@@H+]1Cc2ccccc2[C@H]1C ZINC000543059708 341029618 /nfs/dbraw/zinc/02/96/18/341029618.db2.gz CIBMUMPVTFLQPA-CVEARBPZSA-N 1 2 322.452 4.714 20 0 DJADLO CC(C)c1ccccc1NC(=O)[C@H](C)[N@H+]1Cc2ccccc2[C@H]1C ZINC000543059708 341029619 /nfs/dbraw/zinc/02/96/19/341029619.db2.gz CIBMUMPVTFLQPA-CVEARBPZSA-N 1 2 322.452 4.714 20 0 DJADLO C[N@H+](Cc1nc(C2CC2)cs1)Cc1ccc2ccccc2c1 ZINC000543138650 341033737 /nfs/dbraw/zinc/03/37/37/341033737.db2.gz HLMMDDBFLKLCGL-UHFFFAOYSA-N 1 2 308.450 4.806 20 0 DJADLO C[N@@H+](Cc1nc(C2CC2)cs1)Cc1ccc2ccccc2c1 ZINC000543138650 341033738 /nfs/dbraw/zinc/03/37/38/341033738.db2.gz HLMMDDBFLKLCGL-UHFFFAOYSA-N 1 2 308.450 4.806 20 0 DJADLO COc1c(C)cc(C[N@H+](C)Cc2ncc(C(C)C)s2)cc1C ZINC000543395223 341042174 /nfs/dbraw/zinc/04/21/74/341042174.db2.gz VWZPBJFWNQIOLQ-UHFFFAOYSA-N 1 2 318.486 4.524 20 0 DJADLO COc1c(C)cc(C[N@@H+](C)Cc2ncc(C(C)C)s2)cc1C ZINC000543395223 341042175 /nfs/dbraw/zinc/04/21/75/341042175.db2.gz VWZPBJFWNQIOLQ-UHFFFAOYSA-N 1 2 318.486 4.524 20 0 DJADLO Cc1cccc(C[NH2+][C@@H](c2cccnc2)c2ccc(F)cc2F)c1 ZINC000543407651 341042684 /nfs/dbraw/zinc/04/26/84/341042684.db2.gz WOPMVUGFVRZLNO-FQEVSTJZSA-N 1 2 324.374 4.547 20 0 DJADLO Cc1ccc(C[NH2+][C@@H](c2cccnc2)c2ccc(F)cc2F)cc1 ZINC000543406271 341042711 /nfs/dbraw/zinc/04/27/11/341042711.db2.gz JOGRMKFJJUJJAX-FQEVSTJZSA-N 1 2 324.374 4.547 20 0 DJADLO COCc1ccc([C@H]2CCC[N@@H+]2[C@H](C)c2c(F)cccc2F)o1 ZINC000131000886 341056139 /nfs/dbraw/zinc/05/61/39/341056139.db2.gz RLCHTGYFKZBIIF-MLGOLLRUSA-N 1 2 321.367 4.602 20 0 DJADLO COCc1ccc([C@H]2CCC[N@H+]2[C@H](C)c2c(F)cccc2F)o1 ZINC000131000886 341056140 /nfs/dbraw/zinc/05/61/40/341056140.db2.gz RLCHTGYFKZBIIF-MLGOLLRUSA-N 1 2 321.367 4.602 20 0 DJADLO Cc1cnc([C@H](C)[NH2+][C@@H](c2ccc(Cl)cc2F)C(C)C)o1 ZINC000543847667 341061438 /nfs/dbraw/zinc/06/14/38/341061438.db2.gz YGYQKXUKNOHCBQ-XHDPSFHLSA-N 1 2 310.800 4.823 20 0 DJADLO Cc1cccc(C(C)C)c1NC(=O)C[N@@H+]1Cc2ccccc2[C@H]1C ZINC000543987576 341065099 /nfs/dbraw/zinc/06/50/99/341065099.db2.gz CZJJAERJRIYCMQ-MRXNPFEDSA-N 1 2 322.452 4.634 20 0 DJADLO Cc1cccc(C(C)C)c1NC(=O)C[N@H+]1Cc2ccccc2[C@H]1C ZINC000543987576 341065100 /nfs/dbraw/zinc/06/51/00/341065100.db2.gz CZJJAERJRIYCMQ-MRXNPFEDSA-N 1 2 322.452 4.634 20 0 DJADLO c1cn(-c2csc(CNc3cccc4ccsc43)c2)c[nH+]1 ZINC000544179299 341073024 /nfs/dbraw/zinc/07/30/24/341073024.db2.gz AWFMZSDBGZITJY-UHFFFAOYSA-N 1 2 311.435 4.761 20 0 DJADLO CCc1cnc(C[N@H+](Cc2ccc(Cl)cc2)C2CC2)s1 ZINC000544347265 341077268 /nfs/dbraw/zinc/07/72/68/341077268.db2.gz POBDMAGMTGTAPQ-UHFFFAOYSA-N 1 2 306.862 4.524 20 0 DJADLO CCc1cnc(C[N@@H+](Cc2ccc(Cl)cc2)C2CC2)s1 ZINC000544347265 341077269 /nfs/dbraw/zinc/07/72/69/341077269.db2.gz POBDMAGMTGTAPQ-UHFFFAOYSA-N 1 2 306.862 4.524 20 0 DJADLO Cc1ccc2ccccc2c1C[NH2+][C@H](C)c1nc(C(C)(C)C)no1 ZINC000544517733 341084768 /nfs/dbraw/zinc/08/47/68/341084768.db2.gz GAOKIPDLFRWZML-CQSZACIVSA-N 1 2 323.440 4.680 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1ccon1)c1cccc(OCc2ccccc2)c1 ZINC000544606702 341088514 /nfs/dbraw/zinc/08/85/14/341088514.db2.gz VPKSOGIXSSHYHH-CVEARBPZSA-N 1 2 322.408 4.665 20 0 DJADLO CC[C@H](CC(F)(F)F)[NH2+][C@H](CCc1ccccc1)C(F)F ZINC000544943830 341100490 /nfs/dbraw/zinc/10/04/90/341100490.db2.gz UTYMOWOPUMHBMW-CHWSQXEVSA-N 1 2 309.322 4.574 20 0 DJADLO CC[C@@H](CC(F)(F)F)[NH2+][C@H](CCc1ccccc1)C(F)F ZINC000544943832 341100504 /nfs/dbraw/zinc/10/05/04/341100504.db2.gz UTYMOWOPUMHBMW-QWHCGFSZSA-N 1 2 309.322 4.574 20 0 DJADLO c1coc(C[N@H+](Cc2cccs2)Cc2nc3ccccc3o2)c1 ZINC000072802679 341107121 /nfs/dbraw/zinc/10/71/21/341107121.db2.gz GSAMYOVMKLOFGM-UHFFFAOYSA-N 1 2 324.405 4.685 20 0 DJADLO c1coc(C[N@@H+](Cc2cccs2)Cc2nc3ccccc3o2)c1 ZINC000072802679 341107122 /nfs/dbraw/zinc/10/71/22/341107122.db2.gz GSAMYOVMKLOFGM-UHFFFAOYSA-N 1 2 324.405 4.685 20 0 DJADLO Cc1nc(C(C)(C)[NH2+]Cc2ccc(F)cc2Cl)sc1C ZINC000072865639 341109452 /nfs/dbraw/zinc/10/94/52/341109452.db2.gz DGRLSFNAWQEWLP-UHFFFAOYSA-N 1 2 312.841 4.577 20 0 DJADLO CCCCc1nc(C[NH2+]C(C)(C)c2nc(C)c(C)s2)cs1 ZINC000072865718 341109555 /nfs/dbraw/zinc/10/95/55/341109555.db2.gz AFWKGZACIRHXJQ-UHFFFAOYSA-N 1 2 323.531 4.584 20 0 DJADLO Cc1ccc([C@@H](C)[N@H+](C)Cc2nc(C(F)(F)F)cs2)cc1 ZINC000132361450 341121370 /nfs/dbraw/zinc/12/13/70/341121370.db2.gz XPLFNEFHBMZLPS-LLVKDONJSA-N 1 2 314.376 4.663 20 0 DJADLO Cc1ccc([C@@H](C)[N@@H+](C)Cc2nc(C(F)(F)F)cs2)cc1 ZINC000132361450 341121371 /nfs/dbraw/zinc/12/13/71/341121371.db2.gz XPLFNEFHBMZLPS-LLVKDONJSA-N 1 2 314.376 4.663 20 0 DJADLO CCCc1nc(C[NH2+]C(c2ccccc2)c2ccccc2)cs1 ZINC000073879732 341122673 /nfs/dbraw/zinc/12/26/73/341122673.db2.gz PNRDBXMWCZAXBN-UHFFFAOYSA-N 1 2 322.477 4.975 20 0 DJADLO CCCC[C@@H](CC)[NH2+][C@@H](c1noc(C)n1)c1ccc(Cl)cc1 ZINC000547312724 341204908 /nfs/dbraw/zinc/20/49/08/341204908.db2.gz QTUATZOAPOZBRB-HZPDHXFCSA-N 1 2 321.852 4.679 20 0 DJADLO CCO[C@@H](C)c1nc(C[N@H+](C)[C@@H](C)c2ccc(C)cc2)cs1 ZINC000076720197 341212823 /nfs/dbraw/zinc/21/28/23/341212823.db2.gz SXVLWCPTSCUOSI-GJZGRUSLSA-N 1 2 318.486 4.742 20 0 DJADLO CCO[C@@H](C)c1nc(C[N@@H+](C)[C@@H](C)c2ccc(C)cc2)cs1 ZINC000076720197 341212824 /nfs/dbraw/zinc/21/28/24/341212824.db2.gz SXVLWCPTSCUOSI-GJZGRUSLSA-N 1 2 318.486 4.742 20 0 DJADLO CCO[C@H](C)c1nc(C[NH2+][C@@H](C)c2ccc(Cl)cc2)cs1 ZINC000076716262 341212901 /nfs/dbraw/zinc/21/29/01/341212901.db2.gz MSPUJANBRNUCIH-NWDGAFQWSA-N 1 2 324.877 4.745 20 0 DJADLO C[C@H]([NH2+][C@H]1CCc2cc(Cl)cc(Cl)c21)c1nccs1 ZINC000134387157 341214545 /nfs/dbraw/zinc/21/45/45/341214545.db2.gz GLCVHJDYWUPZKA-UFBFGSQYSA-N 1 2 313.253 4.788 20 0 DJADLO Cc1nc(C(C)(C)[NH2+]Cc2csc(C(C)(C)C)n2)sc1C ZINC000076904181 341215366 /nfs/dbraw/zinc/21/53/66/341215366.db2.gz GBUKTRGSGBJNSF-UHFFFAOYSA-N 1 2 323.531 4.539 20 0 DJADLO C[C@H]([NH2+]Cc1ccc(Cl)s1)c1ncc(-c2ccccc2)o1 ZINC000547469584 341215525 /nfs/dbraw/zinc/21/55/25/341215525.db2.gz YKCFQCXXDBSLRY-NSHDSACASA-N 1 2 318.829 4.907 20 0 DJADLO Fc1ccccc1C1([NH2+]Cc2cccc(Cl)c2Cl)CC1 ZINC000237809695 341221175 /nfs/dbraw/zinc/22/11/75/341221175.db2.gz VAWOQAAPLCAOKC-UHFFFAOYSA-N 1 2 310.199 4.911 20 0 DJADLO Cc1nc(C[NH2+][C@H](C)c2cc(Cl)ccc2Cl)c(C)s1 ZINC000135132547 341231939 /nfs/dbraw/zinc/23/19/39/341231939.db2.gz UHHOMKCLVPJAGS-MRVPVSSYSA-N 1 2 315.269 4.918 20 0 DJADLO c1coc([C@H]2CCCCC[N@H+]2Cc2csc(C3CC3)n2)c1 ZINC000135581682 341242369 /nfs/dbraw/zinc/24/23/69/341242369.db2.gz TWIRISFZXYPZQJ-OAHLLOKOSA-N 1 2 302.443 4.731 20 0 DJADLO c1coc([C@H]2CCCCC[N@@H+]2Cc2csc(C3CC3)n2)c1 ZINC000135581682 341242370 /nfs/dbraw/zinc/24/23/70/341242370.db2.gz TWIRISFZXYPZQJ-OAHLLOKOSA-N 1 2 302.443 4.731 20 0 DJADLO c1cc(-c2noc(-c3cccc(Oc4cc[nH+]cc4)c3)n2)cs1 ZINC000136270354 341256115 /nfs/dbraw/zinc/25/61/15/341256115.db2.gz JBGLRNJDZNMUPM-UHFFFAOYSA-N 1 2 321.361 4.652 20 0 DJADLO Cc1ccccc1[C@H]1C[N@H+](Cc2cccc(C(F)F)c2)CCO1 ZINC000548423925 341259843 /nfs/dbraw/zinc/25/98/43/341259843.db2.gz WPRMQVSOPXJBCY-GOSISDBHSA-N 1 2 317.379 4.506 20 0 DJADLO Cc1ccccc1[C@H]1C[N@@H+](Cc2cccc(C(F)F)c2)CCO1 ZINC000548423925 341259844 /nfs/dbraw/zinc/25/98/44/341259844.db2.gz WPRMQVSOPXJBCY-GOSISDBHSA-N 1 2 317.379 4.506 20 0 DJADLO C[C@H]([NH2+]Cc1c(Cl)cccc1Cl)c1ccc(Cl)cn1 ZINC000548483671 341263125 /nfs/dbraw/zinc/26/31/25/341263125.db2.gz HSHBFKUICFOTEE-VIFPVBQESA-N 1 2 315.631 4.893 20 0 DJADLO CC[C@H]([NH2+]Cc1c(Cl)cccc1Cl)c1nccs1 ZINC000080261561 341271625 /nfs/dbraw/zinc/27/16/25/341271625.db2.gz RNQMWCKCQPEDJR-LBPRGKRZSA-N 1 2 301.242 4.691 20 0 DJADLO CC[C@@H]([NH2+]Cc1cccc(Cl)c1Cl)c1nccs1 ZINC000080262540 341271781 /nfs/dbraw/zinc/27/17/81/341271781.db2.gz HAZMJRXZQBMLNW-LLVKDONJSA-N 1 2 301.242 4.691 20 0 DJADLO Cc1nc(-c2cc([C@H](C)[NH2+][C@@H](C)c3ccon3)cs2)cs1 ZINC000564354954 341271819 /nfs/dbraw/zinc/27/18/19/341271819.db2.gz HQDUYECFLOGMGE-UWVGGRQHSA-N 1 2 319.455 4.580 20 0 DJADLO CC(=O)c1c(F)cc(F)cc1OCc1ccc(C(C)C)[nH+]c1C ZINC000549370370 341292467 /nfs/dbraw/zinc/29/24/67/341292467.db2.gz XJQUKULQJKTCSF-UHFFFAOYSA-N 1 2 319.351 4.573 20 0 DJADLO Cc1nc(C[N@H+](Cc2ccco2)Cc2ccccc2)sc1C ZINC000081645067 341300565 /nfs/dbraw/zinc/30/05/65/341300565.db2.gz GDSFWCRUZRHTPT-UHFFFAOYSA-N 1 2 312.438 4.555 20 0 DJADLO Cc1nc(C[N@@H+](Cc2ccco2)Cc2ccccc2)sc1C ZINC000081645067 341300566 /nfs/dbraw/zinc/30/05/66/341300566.db2.gz GDSFWCRUZRHTPT-UHFFFAOYSA-N 1 2 312.438 4.555 20 0 DJADLO CCc1nocc1C[N@H+](C)[C@H](C)c1ccc(Cl)cc1Cl ZINC000549951282 341307754 /nfs/dbraw/zinc/30/77/54/341307754.db2.gz HKAGLNILHDMEMA-SNVBAGLBSA-N 1 2 313.228 4.737 20 0 DJADLO CCc1nocc1C[N@@H+](C)[C@H](C)c1ccc(Cl)cc1Cl ZINC000549951282 341307755 /nfs/dbraw/zinc/30/77/55/341307755.db2.gz HKAGLNILHDMEMA-SNVBAGLBSA-N 1 2 313.228 4.737 20 0 DJADLO C[C@@H](Nc1ccc2nc(C3CC3)oc2c1)c1cn2ccccc2[nH+]1 ZINC000550919211 341326715 /nfs/dbraw/zinc/32/67/15/341326715.db2.gz HFBZPZYSFMULSN-GFCCVEGCSA-N 1 2 318.380 4.526 20 0 DJADLO Cc1cc([C@H](C)[NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)no1 ZINC000550932907 341327166 /nfs/dbraw/zinc/32/71/66/341327166.db2.gz XOEKJHFDEHYQAH-LIRRHRJNSA-N 1 2 310.372 4.562 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1nccn1C)C1CC1)c1ccc(Cl)cc1Cl ZINC000552088239 341368877 /nfs/dbraw/zinc/36/88/77/341368877.db2.gz DVFLFPOKICSPQP-MEBBXXQBSA-N 1 2 324.255 4.529 20 0 DJADLO C[N@H+](Cc1cccc2cccnc21)Cc1c(F)cccc1Cl ZINC000248075851 341373054 /nfs/dbraw/zinc/37/30/54/341373054.db2.gz UFAJSBCROIGEPM-UHFFFAOYSA-N 1 2 314.791 4.659 20 0 DJADLO C[N@@H+](Cc1cccc2cccnc21)Cc1c(F)cccc1Cl ZINC000248075851 341373055 /nfs/dbraw/zinc/37/30/55/341373055.db2.gz UFAJSBCROIGEPM-UHFFFAOYSA-N 1 2 314.791 4.659 20 0 DJADLO CC(C)(C)c1cc(C[NH2+]C(C)(C)c2cccc(Cl)c2F)no1 ZINC000564389517 341380462 /nfs/dbraw/zinc/38/04/62/341380462.db2.gz HCCTZXIEROETEW-UHFFFAOYSA-N 1 2 324.827 4.790 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)c(F)c1)c1c(F)cncc1F ZINC000552327615 341386999 /nfs/dbraw/zinc/38/69/99/341386999.db2.gz AXJJECNKVAJRLL-DTWKUNHWSA-N 1 2 314.738 4.564 20 0 DJADLO C[C@@H]1C[C@@]1([NH2+]Cc1cc(C(C)(C)C)on1)c1ccc(Cl)cc1 ZINC000564392644 341396940 /nfs/dbraw/zinc/39/69/40/341396940.db2.gz ACIUYKQZXSQSBV-XIKOKIGWSA-N 1 2 318.848 4.650 20 0 DJADLO Cc1ccc(C[N@H+](C)Cc2csc(C(C)(C)C)n2)cc1C ZINC000552537571 341397924 /nfs/dbraw/zinc/39/79/24/341397924.db2.gz IJIBGVCLOUAWGJ-UHFFFAOYSA-N 1 2 302.487 4.689 20 0 DJADLO Cc1ccc(C[N@@H+](C)Cc2csc(C(C)(C)C)n2)cc1C ZINC000552537571 341397925 /nfs/dbraw/zinc/39/79/25/341397925.db2.gz IJIBGVCLOUAWGJ-UHFFFAOYSA-N 1 2 302.487 4.689 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1CCC[C@H](c2ccccc2)C1 ZINC000554388177 341452870 /nfs/dbraw/zinc/45/28/70/341452870.db2.gz OTDARTKBZKVALF-ZWKOTPCHSA-N 1 2 323.440 4.546 20 0 DJADLO CSCCCC[NH2+][C@@H](c1cccc(OC(C)C)c1)C(F)F ZINC000566983733 341573358 /nfs/dbraw/zinc/57/33/58/341573358.db2.gz OTCUZBDVMCTCED-HNNXBMFYSA-N 1 2 317.445 4.513 20 0 DJADLO Cc1nc(C[NH2+][C@@H](C)c2cccc(Cl)c2Cl)sc1C ZINC000153842829 341580104 /nfs/dbraw/zinc/58/01/04/341580104.db2.gz URKIBUNHYBWZSF-VIFPVBQESA-N 1 2 315.269 4.918 20 0 DJADLO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2Cl)s1 ZINC000273199860 341634361 /nfs/dbraw/zinc/63/43/61/341634361.db2.gz RCSJPIZDVJCJEV-HTQZYQBOSA-N 1 2 316.257 4.565 20 0 DJADLO CC(C)n1ccc(C[NH2+][C@H](C)c2cc3cc(Cl)ccc3o2)n1 ZINC000573350008 341725786 /nfs/dbraw/zinc/72/57/86/341725786.db2.gz XRUNJLGVXUTKOA-GFCCVEGCSA-N 1 2 317.820 4.714 20 0 DJADLO CC[C@H](C)n1ncc(N[C@@H](C)c2cn3ccccc3[nH+]2)c1C1CC1 ZINC000574822109 341770018 /nfs/dbraw/zinc/77/00/18/341770018.db2.gz AYDIORCWBUSXQD-KBPBESRZSA-N 1 2 323.444 4.552 20 0 DJADLO C[C@H](Nc1cccc(CSC2CCCC2)c1)c1[nH]cc[nH+]1 ZINC000577407561 341908586 /nfs/dbraw/zinc/90/85/86/341908586.db2.gz RKOXUQKIPMLWMU-ZDUSSCGKSA-N 1 2 301.459 4.759 20 0 DJADLO CCCCn1cc[nH+]c1-c1cccc(N[C@@H](C)c2cc(C)on2)c1 ZINC000577489224 341912233 /nfs/dbraw/zinc/91/22/33/341912233.db2.gz HSJFJKDXPQMPOD-HNNXBMFYSA-N 1 2 324.428 4.820 20 0 DJADLO CC(C)c1nnc(C[NH2+][C@@H](CC2CCCC2)c2ccccc2)o1 ZINC000181942001 519888111 /nfs/dbraw/zinc/88/81/11/519888111.db2.gz ZECRJDHEVKYJEM-KRWDZBQOSA-N 1 2 313.445 4.604 20 0 DJADLO CCC[C@@H]([NH2+]Cc1nc([C@H](C)SCC)no1)c1ccccc1 ZINC000181762963 520784024 /nfs/dbraw/zinc/78/40/24/520784024.db2.gz CXFDTFHHCFCIHI-DZGCQCFKSA-N 1 2 319.474 4.515 20 0 DJADLO CCc1nc([C@@H](C)[NH2+][C@H](C)c2cc3ccccc3o2)cs1 ZINC000162415696 522421080 /nfs/dbraw/zinc/42/10/80/522421080.db2.gz DAXSOGSPWSACRU-VXGBXAGGSA-N 1 2 300.427 4.864 20 0 DJADLO CCc1nc([C@H](C)[NH2+][C@@H](CC)c2cc(F)ccc2F)cs1 ZINC000162316783 522454638 /nfs/dbraw/zinc/45/46/38/522454638.db2.gz DQRNGBCJWIOQCS-HZMBPMFUSA-N 1 2 310.413 4.786 20 0 DJADLO COc1ccc(C)cc1[C@@H](C)[NH2+][C@H](C)c1ncc(C(C)(C)C)o1 ZINC000267050076 523854824 /nfs/dbraw/zinc/85/48/24/523854824.db2.gz OWKOSWAFMILIQF-ZIAGYGMSSA-N 1 2 316.445 4.701 20 0 DJADLO CO[C@H](C)c1nc(C[N@H+]([C@@H](C)c2ccccc2)C2CC2)cs1 ZINC000267007541 523913063 /nfs/dbraw/zinc/91/30/63/523913063.db2.gz KONNLAKKGRZJAA-UONOGXRCSA-N 1 2 316.470 4.576 20 0 DJADLO CO[C@H](C)c1nc(C[N@@H+]([C@@H](C)c2ccccc2)C2CC2)cs1 ZINC000267007541 523913068 /nfs/dbraw/zinc/91/30/68/523913068.db2.gz KONNLAKKGRZJAA-UONOGXRCSA-N 1 2 316.470 4.576 20 0 DJADLO CCc1ccc([C@H](C)[NH2+][C@@H](c2ccccc2)c2ccccn2)o1 ZINC000154657623 524046749 /nfs/dbraw/zinc/04/67/49/524046749.db2.gz KJZKGRZZZUBTQN-YWZLYKJASA-N 1 2 306.409 4.677 20 0 DJADLO Cc1cc(NC(=O)Nc2ccccc2CCC(F)(F)F)cc[nH+]1 ZINC000120216628 525207397 /nfs/dbraw/zinc/20/73/97/525207397.db2.gz PFSSMUDEKVLKNY-UHFFFAOYSA-N 1 2 323.318 4.529 20 0 DJADLO C[C@H](Nc1ccc(-c2cn3c([nH+]2)CCCC3)cc1)c1nccs1 ZINC000182923310 525646881 /nfs/dbraw/zinc/64/68/81/525646881.db2.gz SEORYADVJAPPMF-ZDUSSCGKSA-N 1 2 324.453 4.516 20 0 DJADLO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2cc3cc(Cl)ccc3o2)s1 ZINC000338289034 526405529 /nfs/dbraw/zinc/40/55/29/526405529.db2.gz GPDJWWNVTWVDCG-IUCAKERBSA-N 1 2 321.833 4.658 20 0 DJADLO Cc1csc([C@@H]([NH2+][C@H](C)c2c(F)cccc2F)C2CC2)n1 ZINC000120269327 526416201 /nfs/dbraw/zinc/41/62/01/526416201.db2.gz TULIJGJDYONYHM-BMIGLBTASA-N 1 2 308.397 4.532 20 0 DJADLO Cc1sccc1CNc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000339324611 526922914 /nfs/dbraw/zinc/92/29/14/526922914.db2.gz CJDAOJFUTBENNH-UHFFFAOYSA-N 1 2 321.449 4.584 20 0 DJADLO O=C(Nc1ccc(Oc2cc[nH+]cc2)cc1)c1ccoc1C1CC1 ZINC000336956669 527253149 /nfs/dbraw/zinc/25/31/49/527253149.db2.gz WJPVEBZRNFUCPE-UHFFFAOYSA-N 1 2 320.348 4.597 20 0 DJADLO Cc1ncc(C[NH+]2Cc3ccccc3-c3ccccc3C2)s1 ZINC000338425825 527260543 /nfs/dbraw/zinc/26/05/43/527260543.db2.gz OTBCHNQBLYNRJM-UHFFFAOYSA-N 1 2 306.434 4.634 20 0 DJADLO FC(F)(F)c1ccc(CNc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000338143299 527682332 /nfs/dbraw/zinc/68/23/32/527682332.db2.gz OHHBYFBWYLVXAQ-UHFFFAOYSA-N 1 2 317.314 4.503 20 0 DJADLO CCc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2csc(C)n2)o1 ZINC000340691976 536194946 /nfs/dbraw/zinc/19/49/46/536194946.db2.gz URWWIGKVQHJYHQ-MLGOLLRUSA-N 1 2 304.459 4.580 20 0 DJADLO CCc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2csc(C)n2)o1 ZINC000340691976 536194947 /nfs/dbraw/zinc/19/49/47/536194947.db2.gz URWWIGKVQHJYHQ-MLGOLLRUSA-N 1 2 304.459 4.580 20 0 DJADLO C/C=C/c1ccc(N[C@@H](c2[nH+]ccn2C)c2cccc(F)c2)cc1 ZINC000563737491 334972417 /nfs/dbraw/zinc/97/24/17/334972417.db2.gz FKSCNIMSACAKKE-MEDHRJKHSA-N 1 2 321.399 4.794 20 0 DJADLO C[C@H]([NH2+][C@H](c1ccc(F)cc1F)C(C)(C)C)c1nccs1 ZINC000091736526 193099410 /nfs/dbraw/zinc/09/94/10/193099410.db2.gz OVFAPKCHWPZORE-IINYFYTJSA-N 1 2 310.413 4.859 20 0 DJADLO CCCc1csc(C[N@H+](C)[C@@H](C)c2ccc(F)c(F)c2)n1 ZINC000426042546 335053281 /nfs/dbraw/zinc/05/32/81/335053281.db2.gz CYWDUURYPQAPEA-NSHDSACASA-N 1 2 310.413 4.567 20 0 DJADLO CCCc1csc(C[N@@H+](C)[C@@H](C)c2ccc(F)c(F)c2)n1 ZINC000426042546 335053283 /nfs/dbraw/zinc/05/32/83/335053283.db2.gz CYWDUURYPQAPEA-NSHDSACASA-N 1 2 310.413 4.567 20 0 DJADLO Cc1c(C(=O)Nc2c(C)cc(C)[nH+]c2C)oc2c1c(C)ccc2C ZINC000194147317 335057907 /nfs/dbraw/zinc/05/79/07/335057907.db2.gz AXQVFWOAXJTIDW-UHFFFAOYSA-N 1 2 322.408 4.931 20 0 DJADLO CCn1cc([C@@H](C)[NH2+]C2(c3c(Cl)cccc3Cl)CC2)cn1 ZINC000272152871 130003422 /nfs/dbraw/zinc/00/34/22/130003422.db2.gz ARSMFDSWTDBIBR-LLVKDONJSA-N 1 2 324.255 4.550 20 0 DJADLO CC(C)[C@H]([NH2+][C@H](C)c1cscn1)c1ccc(Cl)cc1F ZINC000272711484 130055532 /nfs/dbraw/zinc/05/55/32/130055532.db2.gz BEJIMAJRFQWFTP-BMIGLBTASA-N 1 2 312.841 4.984 20 0 DJADLO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2cc3cc(C)c(C)cc3o2)s1 ZINC000274218150 130219710 /nfs/dbraw/zinc/21/97/10/130219710.db2.gz NSUUYYVEBPSLTP-NWDGAFQWSA-N 1 2 315.442 4.621 20 0 DJADLO Cc1cnccc1C(=O)Nc1c2ccccc2[nH+]c(C)c1C(C)C ZINC000276949908 130563261 /nfs/dbraw/zinc/56/32/61/130563261.db2.gz XBHSLYLBRLHKFO-UHFFFAOYSA-N 1 2 319.408 4.622 20 0 DJADLO Cc1cc([C@@H](C)[NH2+]C(c2cccs2)c2cccs2)no1 ZINC000284977599 131127995 /nfs/dbraw/zinc/12/79/95/131127995.db2.gz FZGYYTOSBJCTSV-LLVKDONJSA-N 1 2 304.440 4.546 20 0 DJADLO Cc1ccc(-c2csc(C[N@@H+](C)[C@H](C)c3ccccn3)n2)cc1 ZINC000285554266 131180391 /nfs/dbraw/zinc/18/03/91/131180391.db2.gz IOIBQIQRIKNTTN-OAHLLOKOSA-N 1 2 323.465 4.707 20 0 DJADLO Cc1ccc(-c2csc(C[N@H+](C)[C@H](C)c3ccccn3)n2)cc1 ZINC000285554266 131180392 /nfs/dbraw/zinc/18/03/92/131180392.db2.gz IOIBQIQRIKNTTN-OAHLLOKOSA-N 1 2 323.465 4.707 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1ccc(F)c(Cl)c1 ZINC000285738083 131198012 /nfs/dbraw/zinc/19/80/12/131198012.db2.gz QFQJPRQZOXAVEO-BDAKNGLRSA-N 1 2 314.738 4.564 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)[C@@H](C)c1ccc(Cl)cc1 ZINC000287645035 131292628 /nfs/dbraw/zinc/29/26/28/131292628.db2.gz VWNWUXDQAOLKCL-ZDUSSCGKSA-N 1 2 317.820 4.577 20 0 DJADLO Cc1ccc(CSCc2ccc(C(F)(F)F)cn2)c(C)[nH+]1 ZINC000340624961 132096433 /nfs/dbraw/zinc/09/64/33/132096433.db2.gz VYAKAVIRMKFNRH-UHFFFAOYSA-N 1 2 312.360 4.546 20 0 DJADLO Cc1nc(C[N@@H+](C)[C@@H](C)c2ccc(C(F)(F)F)cc2)oc1C ZINC000299353008 132100579 /nfs/dbraw/zinc/10/05/79/132100579.db2.gz HJUIIHLDPJUOIR-NSHDSACASA-N 1 2 312.335 4.503 20 0 DJADLO Cc1nc(C[N@H+](C)[C@@H](C)c2ccc(C(F)(F)F)cc2)oc1C ZINC000299353008 132100580 /nfs/dbraw/zinc/10/05/80/132100580.db2.gz HJUIIHLDPJUOIR-NSHDSACASA-N 1 2 312.335 4.503 20 0 DJADLO COc1cccc(F)c1[C@@H](C)[NH2+][C@@H](C)c1c(F)cccc1F ZINC000174220173 332848121 /nfs/dbraw/zinc/84/81/21/332848121.db2.gz JTUARZFNIAUQQU-WDEREUQCSA-N 1 2 309.331 4.524 20 0 DJADLO Cc1cc(C)c(NC(=O)CCCCCc2cccs2)c(C)[nH+]1 ZINC000109099583 331510240 /nfs/dbraw/zinc/51/02/40/331510240.db2.gz LUURTFIQLJINHT-UHFFFAOYSA-N 1 2 316.470 4.810 20 0 DJADLO CCCCOC1CCN(c2cc[nH+]c3c(Cl)cccc23)CC1 ZINC000557629429 331804269 /nfs/dbraw/zinc/80/42/69/331804269.db2.gz PDRIZIPHIPCJJB-UHFFFAOYSA-N 1 2 318.848 4.674 20 0 DJADLO Cc1cnc([C@H](C)[NH2+]C(c2ccccc2)c2ccccc2)s1 ZINC000317500133 331824369 /nfs/dbraw/zinc/82/43/69/331824369.db2.gz DIBKTJNLTBRXNI-HNNXBMFYSA-N 1 2 308.450 4.892 20 0 DJADLO CC(C)c1nc(N2Cc3ccccc3-c3ccccc3C2)cc[nH+]1 ZINC000518365093 332018076 /nfs/dbraw/zinc/01/80/76/332018076.db2.gz GRZQYWXLCAGCDC-UHFFFAOYSA-N 1 2 315.420 4.787 20 0 DJADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1cccc(C2CCC2)c1 ZINC000409619849 332042049 /nfs/dbraw/zinc/04/20/49/332042049.db2.gz ONHCHQRGVWNUIT-UHFFFAOYSA-N 1 2 317.392 4.597 20 0 DJADLO C[C@H](c1c(F)cccc1F)[N@H+](C)Cc1cnc2ccccc2c1 ZINC000410342514 332113179 /nfs/dbraw/zinc/11/31/79/332113179.db2.gz KTXHRWDOTFGYAY-CYBMUJFWSA-N 1 2 312.363 4.706 20 0 DJADLO C[C@H](c1c(F)cccc1F)[N@@H+](C)Cc1cnc2ccccc2c1 ZINC000410342514 332113180 /nfs/dbraw/zinc/11/31/80/332113180.db2.gz KTXHRWDOTFGYAY-CYBMUJFWSA-N 1 2 312.363 4.706 20 0 DJADLO Clc1scc(C[N@@H+]2CCC[C@@H]2c2ccccn2)c1Cl ZINC000569538995 332130512 /nfs/dbraw/zinc/13/05/12/332130512.db2.gz VIZRBSFOIFOGGF-GFCCVEGCSA-N 1 2 313.253 4.787 20 0 DJADLO Clc1scc(C[N@H+]2CCC[C@@H]2c2ccccn2)c1Cl ZINC000569538995 332130513 /nfs/dbraw/zinc/13/05/13/332130513.db2.gz VIZRBSFOIFOGGF-GFCCVEGCSA-N 1 2 313.253 4.787 20 0 DJADLO C[C@@H]([NH2+]Cc1ncc(-c2cccs2)o1)c1cccc(Cl)c1 ZINC000181419770 332193930 /nfs/dbraw/zinc/19/39/30/332193930.db2.gz AXLWGSIEMMWOMH-LLVKDONJSA-N 1 2 318.829 4.907 20 0 DJADLO Cc1nsc(C)c1C[N@H+](Cc1ccco1)Cc1cccs1 ZINC000555877779 332265951 /nfs/dbraw/zinc/26/59/51/332265951.db2.gz FGBNBXRQGFRNPD-UHFFFAOYSA-N 1 2 318.467 4.617 20 0 DJADLO Cc1nsc(C)c1C[N@@H+](Cc1ccco1)Cc1cccs1 ZINC000555877779 332265953 /nfs/dbraw/zinc/26/59/53/332265953.db2.gz FGBNBXRQGFRNPD-UHFFFAOYSA-N 1 2 318.467 4.617 20 0 DJADLO Cc1cc[nH+]cc1NCc1cnc(-c2ccc(Cl)cc2)s1 ZINC000559987301 332299733 /nfs/dbraw/zinc/29/97/33/332299733.db2.gz LTMHFPRHUQGYKW-UHFFFAOYSA-N 1 2 315.829 4.779 20 0 DJADLO CC(C)(C)c1cnc(C[NH+]2CCC(CC(F)(F)F)CC2)s1 ZINC000560276883 332327032 /nfs/dbraw/zinc/32/70/32/332327032.db2.gz SDLRDJLIHMDABQ-UHFFFAOYSA-N 1 2 320.424 4.605 20 0 DJADLO Cn1ccc2ccc(N[C@@H](c3[nH]cc[nH+]3)C3CCCCC3)cc21 ZINC000560549037 332357138 /nfs/dbraw/zinc/35/71/38/332357138.db2.gz MGBHZQKKPCNXLD-GOSISDBHSA-N 1 2 308.429 4.635 20 0 DJADLO Cc1nc(C[NH2+][C@@H](C)c2csc(Cl)c2)nc2ccccc12 ZINC000526049360 332371024 /nfs/dbraw/zinc/37/10/24/332371024.db2.gz WKDNIGZDEXJMHX-JTQLQIEISA-N 1 2 317.845 4.504 20 0 DJADLO CC[N@H+](Cc1ncc(C)s1)Cc1ccc(Cl)c(Cl)c1 ZINC000560840537 332389670 /nfs/dbraw/zinc/38/96/70/332389670.db2.gz LVPRJTGQCTWEOZ-UHFFFAOYSA-N 1 2 315.269 4.780 20 0 DJADLO CC[N@@H+](Cc1ncc(C)s1)Cc1ccc(Cl)c(Cl)c1 ZINC000560840537 332389672 /nfs/dbraw/zinc/38/96/72/332389672.db2.gz LVPRJTGQCTWEOZ-UHFFFAOYSA-N 1 2 315.269 4.780 20 0 DJADLO Cc1cc(C)c(NC(=O)[C@@H](C)c2ccc(CC(C)C)cc2)c(C)[nH+]1 ZINC000428301356 332439853 /nfs/dbraw/zinc/43/98/53/332439853.db2.gz CCUQBJKXBOERKQ-INIZCTEOSA-N 1 2 324.468 4.948 20 0 DJADLO Cc1[nH]c(CNc2cccc(Cl)c2SC(C)C)[nH+]c1C ZINC000566499437 332459422 /nfs/dbraw/zinc/45/94/22/332459422.db2.gz UGSLXSRUBNXVGR-UHFFFAOYSA-N 1 2 309.866 4.793 20 0 DJADLO Cc1cnc([C@@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2Cl)cn1 ZINC000427817845 332527576 /nfs/dbraw/zinc/52/75/76/332527576.db2.gz NGHMPJUQCRGUMV-GHMZBOCLSA-N 1 2 310.228 4.504 20 0 DJADLO CC(C)=CCOc1cccc(C(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC000525655321 332528969 /nfs/dbraw/zinc/52/89/69/332528969.db2.gz ZQRPQQGLRXHBTF-UHFFFAOYSA-N 1 2 324.424 4.604 20 0 DJADLO Cc1nc(C[NH2+][C@H](CC(F)(F)F)c2ccccc2C)cs1 ZINC000444015719 332648859 /nfs/dbraw/zinc/64/88/59/332648859.db2.gz WJXXOJOGYHNIQU-CQSZACIVSA-N 1 2 314.376 4.543 20 0 DJADLO Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+][C@@H](C)c1cscn1 ZINC000570058394 332707200 /nfs/dbraw/zinc/70/72/00/332707200.db2.gz SUNFCSCRDYQWFY-UWVGGRQHSA-N 1 2 309.504 4.617 20 0 DJADLO CC(C)c1ccc(NC(=O)C[C@@H](C)n2cc[nH+]c2)c(C(C)C)c1 ZINC000570099068 332711857 /nfs/dbraw/zinc/71/18/57/332711857.db2.gz ZBWFYKQEZFSKDU-OAHLLOKOSA-N 1 2 313.445 4.720 20 0 DJADLO CC(C)CCc1noc(C[N@H+](C)[C@@H](C)c2cccc(Cl)c2)n1 ZINC000518828015 335116215 /nfs/dbraw/zinc/11/62/15/335116215.db2.gz IZWACGSWNILGJS-ZDUSSCGKSA-N 1 2 321.852 4.505 20 0 DJADLO CC(C)CCc1noc(C[N@@H+](C)[C@@H](C)c2cccc(Cl)c2)n1 ZINC000518828015 335116217 /nfs/dbraw/zinc/11/62/17/335116217.db2.gz IZWACGSWNILGJS-ZDUSSCGKSA-N 1 2 321.852 4.505 20 0 DJADLO Cc1nc([C@H](C)[N@@H+]2CCC[C@@H]2CF)oc1-c1ccc(Cl)cc1 ZINC000580219566 333020125 /nfs/dbraw/zinc/02/01/25/333020125.db2.gz RBYNPJNVJOKXER-SWLSCSKDSA-N 1 2 322.811 4.798 20 0 DJADLO Cc1nc([C@H](C)[N@H+]2CCC[C@@H]2CF)oc1-c1ccc(Cl)cc1 ZINC000580219566 333020126 /nfs/dbraw/zinc/02/01/26/333020126.db2.gz RBYNPJNVJOKXER-SWLSCSKDSA-N 1 2 322.811 4.798 20 0 DJADLO Cc1cccc(N[C@H](c2[nH]cc[nH+]2)c2ccc(F)cc2)c1Cl ZINC000188432790 333046000 /nfs/dbraw/zinc/04/60/00/333046000.db2.gz WBODBIJSMQDDCO-INIZCTEOSA-N 1 2 315.779 4.712 20 0 DJADLO CC(C)(C)c1nc(C[N@H+](CCC(F)(F)F)CC2CC2)cs1 ZINC000177165996 333125439 /nfs/dbraw/zinc/12/54/39/333125439.db2.gz GPLLQMKCWQJISA-UHFFFAOYSA-N 1 2 320.424 4.605 20 0 DJADLO CC(C)(C)c1nc(C[N@@H+](CCC(F)(F)F)CC2CC2)cs1 ZINC000177165996 333125440 /nfs/dbraw/zinc/12/54/40/333125440.db2.gz GPLLQMKCWQJISA-UHFFFAOYSA-N 1 2 320.424 4.605 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1nc(C2CCCCC2)no1)c1ccc(F)cc1 ZINC000185270916 335124447 /nfs/dbraw/zinc/12/44/47/335124447.db2.gz GZIKMJZFYCVAIR-OLZOCXBDSA-N 1 2 317.408 4.668 20 0 DJADLO C[C@H](CCCC(F)(F)F)Nc1ccc(N2CCCCC2)[nH+]c1 ZINC000318604490 333193116 /nfs/dbraw/zinc/19/31/16/333193116.db2.gz NGTPFKQTGSBTGX-CYBMUJFWSA-N 1 2 315.383 4.605 20 0 DJADLO Cc1cccc(C)c1C[NH2+][C@H](C)c1nc(C2CCCCC2)no1 ZINC000185258795 335122943 /nfs/dbraw/zinc/12/29/43/335122943.db2.gz UNCXNSRCULAXSZ-OAHLLOKOSA-N 1 2 313.445 4.585 20 0 DJADLO C[C@H](C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1)c1ccccc1 ZINC000182506289 335128075 /nfs/dbraw/zinc/12/80/75/335128075.db2.gz XMMUFQRLHWAPNA-HNNXBMFYSA-N 1 2 318.376 4.616 20 0 DJADLO CC(C)n1ccnc1C[NH2+][C@@H](C)c1cc(Cl)ccc1Cl ZINC000186756948 333222680 /nfs/dbraw/zinc/22/26/80/333222680.db2.gz LJEKPVVTTRUFOU-NSHDSACASA-N 1 2 312.244 4.622 20 0 DJADLO Cc1nc(C[N@@H+](C)[C@H](C)c2ccc(Cl)c(Cl)c2)cs1 ZINC000525782236 333306961 /nfs/dbraw/zinc/30/69/61/333306961.db2.gz UMESKQHKGLJUSC-SECBINFHSA-N 1 2 315.269 4.951 20 0 DJADLO Cc1nc(C[N@H+](C)[C@H](C)c2ccc(Cl)c(Cl)c2)cs1 ZINC000525782236 333306962 /nfs/dbraw/zinc/30/69/62/333306962.db2.gz UMESKQHKGLJUSC-SECBINFHSA-N 1 2 315.269 4.951 20 0 DJADLO C[C@@H](c1nc2ccccc2s1)[N@H+](C)Cc1ccc(Cl)cn1 ZINC000521483685 333372512 /nfs/dbraw/zinc/37/25/12/333372512.db2.gz WFLWNPARSUWOCM-NSHDSACASA-N 1 2 317.845 4.538 20 0 DJADLO C[C@@H](c1nc2ccccc2s1)[N@@H+](C)Cc1ccc(Cl)cn1 ZINC000521483685 333372513 /nfs/dbraw/zinc/37/25/13/333372513.db2.gz WFLWNPARSUWOCM-NSHDSACASA-N 1 2 317.845 4.538 20 0 DJADLO C[C@@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1ccc(F)c(F)c1 ZINC000319684745 333396905 /nfs/dbraw/zinc/39/69/05/333396905.db2.gz KBKPGGOPIXXSDV-CYBMUJFWSA-N 1 2 317.383 4.523 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1nc2ccccc2o1)c1ccccc1Cl ZINC000182422834 333503579 /nfs/dbraw/zinc/50/35/79/333503579.db2.gz BJUCYKSVESNSFO-NEPJUHHUSA-N 1 2 300.789 4.893 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1cc(Cl)ccc1Cl)c1cc2n(n1)CCC2 ZINC000414072381 333891340 /nfs/dbraw/zinc/89/13/40/333891340.db2.gz LHEZNXOVDAYZJU-QWRGUYRKSA-N 1 2 324.255 4.548 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1cccc(Cl)c1Cl)c1cc2n(n1)CCC2 ZINC000414112539 333905050 /nfs/dbraw/zinc/90/50/50/333905050.db2.gz JXNXZXTZYBLDSJ-GHMZBOCLSA-N 1 2 324.255 4.548 20 0 DJADLO Cc1ncc(C[NH2+][C@@H]2CCCc3c(Cl)sc(Cl)c32)o1 ZINC000414173020 333907829 /nfs/dbraw/zinc/90/78/29/333907829.db2.gz FIZGLIUPXVTYIJ-SNVBAGLBSA-N 1 2 317.241 4.519 20 0 DJADLO Cc1ncc(C[NH2+][C@H]2CCCc3c(Cl)sc(Cl)c32)o1 ZINC000414173014 333907868 /nfs/dbraw/zinc/90/78/68/333907868.db2.gz FIZGLIUPXVTYIJ-JTQLQIEISA-N 1 2 317.241 4.519 20 0 DJADLO CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+][C@@H](C)c1csnn1 ZINC000414310080 333937224 /nfs/dbraw/zinc/93/72/24/333937224.db2.gz VYVHMUKFFZEKRU-RYUDHWBXSA-N 1 2 315.442 4.567 20 0 DJADLO C[C@@H]1CC[N@H+](Cc2nc(C3CC3)cs2)[C@@H](c2ccco2)C1 ZINC000343597781 335175900 /nfs/dbraw/zinc/17/59/00/335175900.db2.gz DEAOLWOMTXHEGW-IUODEOHRSA-N 1 2 302.443 4.587 20 0 DJADLO C[C@@H]1CC[N@@H+](Cc2nc(C3CC3)cs2)[C@@H](c2ccco2)C1 ZINC000343597781 335175901 /nfs/dbraw/zinc/17/59/01/335175901.db2.gz DEAOLWOMTXHEGW-IUODEOHRSA-N 1 2 302.443 4.587 20 0 DJADLO Cc1ccc2cc(CNc3ccc4c(c3)CCC[NH2+]4)ccc2n1 ZINC000414854862 334128144 /nfs/dbraw/zinc/12/81/44/334128144.db2.gz UZURGVWMSYQLRC-UHFFFAOYSA-N 1 2 303.409 4.513 20 0 DJADLO CC[C@H]([NH2+]Cc1csc(Cl)n1)c1ccc(Cl)s1 ZINC000295077891 334217671 /nfs/dbraw/zinc/21/76/71/334217671.db2.gz XGBZMHYKEHPSMN-QMMMGPOBSA-N 1 2 307.271 4.752 20 0 DJADLO CCn1ccnc1[C@H](C)[NH2+][C@@H](C)c1ccc(Cl)cc1Cl ZINC000296081137 334229751 /nfs/dbraw/zinc/22/97/51/334229751.db2.gz SPFVAMZJSIELQI-QWRGUYRKSA-N 1 2 312.244 4.622 20 0 DJADLO CCn1cc[nH+]c1[C@@H](C)Nc1ccc(CCC(F)(F)F)cc1 ZINC000296833241 334237073 /nfs/dbraw/zinc/23/70/73/334237073.db2.gz MQBLQQAENVNEJL-GFCCVEGCSA-N 1 2 311.351 4.571 20 0 DJADLO COc1ccccc1[C@H](C)[NH2+]Cc1nc(-c2ccccc2)oc1C ZINC000298078798 334246189 /nfs/dbraw/zinc/24/61/89/334246189.db2.gz GLFAFSWKBKBKSN-AWEZNQCLSA-N 1 2 322.408 4.509 20 0 DJADLO COc1ccccc1[C@@H](C)[NH2+]Cc1nc(-c2ccccc2)oc1C ZINC000298078801 334246237 /nfs/dbraw/zinc/24/62/37/334246237.db2.gz GLFAFSWKBKBKSN-CQSZACIVSA-N 1 2 322.408 4.509 20 0 DJADLO C[C@H](c1cccc(Cl)c1)[N@@H+]1CCO[C@H](c2ccccc2F)C1 ZINC000303225069 334304840 /nfs/dbraw/zinc/30/48/40/334304840.db2.gz WGUPQZOKMFAFKA-ACJLOTCBSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@H](c1cccc(Cl)c1)[N@H+]1CCO[C@H](c2ccccc2F)C1 ZINC000303225069 334304842 /nfs/dbraw/zinc/30/48/42/334304842.db2.gz WGUPQZOKMFAFKA-ACJLOTCBSA-N 1 2 319.807 4.614 20 0 DJADLO Cc1cccc2[nH+]c(CNc3cc(Cl)cc(Cl)c3)cn21 ZINC000303889344 334340770 /nfs/dbraw/zinc/34/07/70/334340770.db2.gz KAVNQNCOQRFILA-UHFFFAOYSA-N 1 2 306.196 4.562 20 0 DJADLO CSc1cccc(NCc2ccc(-n3cc[nH+]c3)cc2)c1C ZINC000341313172 334434333 /nfs/dbraw/zinc/43/43/33/334434333.db2.gz JMGJUNRBHSEBMV-UHFFFAOYSA-N 1 2 309.438 4.515 20 0 DJADLO FC(F)(F)C[C@@H]([NH2+]Cc1nc2ccccc2o1)c1ccccc1 ZINC000341583328 334458488 /nfs/dbraw/zinc/45/84/88/334458488.db2.gz CYYVBHAGVOBJEP-CQSZACIVSA-N 1 2 320.314 4.611 20 0 DJADLO CC[C@@H](C)[C@H]([NH2+]Cc1nnc(C(C)C)o1)c1ccc(Cl)cc1 ZINC000341916414 334492064 /nfs/dbraw/zinc/49/20/64/334492064.db2.gz YGCYHWRHJDEKTH-WBMJQRKESA-N 1 2 321.852 4.723 20 0 DJADLO CSc1ccc(C)c(NCc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000342847144 334582626 /nfs/dbraw/zinc/58/26/26/334582626.db2.gz AZSUQUFWZYZPFU-UHFFFAOYSA-N 1 2 309.438 4.515 20 0 DJADLO Fc1cccc(CNc2cccc(-c3[nH+]cc4n3CCCC4)c2)c1 ZINC000444006499 338466775 /nfs/dbraw/zinc/46/67/75/338466775.db2.gz ANMSANGRDKAOPL-UHFFFAOYSA-N 1 2 321.399 4.638 20 0 DJADLO Brc1csc(CNc2ccc3ccccc3[nH+]2)c1 ZINC000070212850 334866462 /nfs/dbraw/zinc/86/64/62/334866462.db2.gz XLQAZQARXOXGFC-UHFFFAOYSA-N 1 2 319.227 4.671 20 0 DJADLO CCc1c[nH+]ccc1[C@H](C)[C@H](Cc1ccccn1)c1cccnc1 ZINC000345843082 335355004 /nfs/dbraw/zinc/35/50/04/335355004.db2.gz TVCKBXGSUMKRSF-KKSFZXQISA-N 1 2 317.436 4.564 20 0 DJADLO CCn1c[nH+]cc1CNc1cccc(Cl)c1SC(C)C ZINC000417826180 335642758 /nfs/dbraw/zinc/64/27/58/335642758.db2.gz MNYAXJRHJDVTEJ-UHFFFAOYSA-N 1 2 309.866 4.669 20 0 DJADLO C[C@H](SCCn1cc[nH+]c1)c1ccc(Cl)c(Cl)c1 ZINC000535582865 335656119 /nfs/dbraw/zinc/65/61/19/335656119.db2.gz WFWAIZWFHRYVBJ-JTQLQIEISA-N 1 2 301.242 4.684 20 0 DJADLO Fc1ccc(SCc2c[nH+]cn2Cc2ccccc2)c(F)c1 ZINC000445596287 338501851 /nfs/dbraw/zinc/50/18/51/338501851.db2.gz LFSCVGXDSDOWGO-UHFFFAOYSA-N 1 2 316.376 4.502 20 0 DJADLO Cc1cccc2c1cc[nH+]c2N1C[C@H](C)C[C@@H]1c1cccnc1 ZINC000519540028 335875196 /nfs/dbraw/zinc/87/51/96/335875196.db2.gz KNECJBMRHVTYAU-AUUYWEPGSA-N 1 2 303.409 4.526 20 0 DJADLO CC[C@@H]([NH2+][C@H](C)c1cscn1)c1cc(Cl)ccc1OC ZINC000519833119 335899044 /nfs/dbraw/zinc/89/90/44/335899044.db2.gz MSNQHJCJZQNYSN-ZWNOBZJWSA-N 1 2 310.850 4.607 20 0 DJADLO CC[N@H+](Cc1nc(-c2ccc(C)cc2)cs1)Cc1ccncc1 ZINC000351758896 336065717 /nfs/dbraw/zinc/06/57/17/336065717.db2.gz LAVLKLGROZBIJR-UHFFFAOYSA-N 1 2 323.465 4.536 20 0 DJADLO CC[N@@H+](Cc1nc(-c2ccc(C)cc2)cs1)Cc1ccncc1 ZINC000351758896 336065718 /nfs/dbraw/zinc/06/57/18/336065718.db2.gz LAVLKLGROZBIJR-UHFFFAOYSA-N 1 2 323.465 4.536 20 0 DJADLO Cc1c[nH]c(-c2ccccc2NC(=O)C[C@H]2CCC[C@H](C)C2)[nH+]1 ZINC000331707890 336145107 /nfs/dbraw/zinc/14/51/07/336145107.db2.gz BRILVWMBKBPIIT-ZFWWWQNUSA-N 1 2 311.429 4.540 20 0 DJADLO Cc1coc(C)c1C(=O)Nc1c2ccccc2[nH+]c(C)c1C(C)C ZINC000332015483 336155983 /nfs/dbraw/zinc/15/59/83/336155983.db2.gz YVIKFXLDVWAOFB-UHFFFAOYSA-N 1 2 322.408 4.551 20 0 DJADLO Cc1ccc([C@H](C)[NH2+]Cc2noc(C3CCCCC3)n2)cc1C ZINC000332293776 336166791 /nfs/dbraw/zinc/16/67/91/336166791.db2.gz LXHIFZQQGCMQLX-HNNXBMFYSA-N 1 2 313.445 4.585 20 0 DJADLO Cc1ccc([C@@H](C)[NH2+]Cc2noc(C3CCCCC3)n2)c(C)c1 ZINC000332326289 336168597 /nfs/dbraw/zinc/16/85/97/336168597.db2.gz SPHUYXBIOWAFHG-OAHLLOKOSA-N 1 2 313.445 4.585 20 0 DJADLO CCc1ccc(C[NH2+][C@H](c2ccco2)c2ccccc2OC)cc1 ZINC000532675786 336266266 /nfs/dbraw/zinc/26/62/66/336266266.db2.gz HQQNYHMTLWYWLP-NRFANRHFSA-N 1 2 321.420 4.730 20 0 DJADLO COc1c(C)ccc(N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)c1C ZINC000325113671 336279384 /nfs/dbraw/zinc/27/93/84/336279384.db2.gz JJHJHBVGOLKAKA-INIZCTEOSA-N 1 2 321.424 4.671 20 0 DJADLO CCCOc1ccccc1N[C@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC000325120553 336279481 /nfs/dbraw/zinc/27/94/81/336279481.db2.gz UPCZASAHHXGQAN-MRXNPFEDSA-N 1 2 321.424 4.834 20 0 DJADLO CC(C)COC[C@H]([NH2+]Cc1cc2ccccc2o1)c1ccco1 ZINC000101596989 336283520 /nfs/dbraw/zinc/28/35/20/336283520.db2.gz DSHVJCIYAFVIKI-KRWDZBQOSA-N 1 2 313.397 4.529 20 0 DJADLO c1ccc2sc([C@@H]3CCCN3c3[nH]c4ccccc4[nH+]3)nc2c1 ZINC000301083749 336288984 /nfs/dbraw/zinc/28/89/84/336288984.db2.gz VEXDGIHIPINTPO-HNNXBMFYSA-N 1 2 320.421 4.514 20 0 DJADLO Cc1cc([C@@H](C)Nc2cc(C)[nH+]c(-c3cccnc3)n2)c(C)s1 ZINC000301110797 336290527 /nfs/dbraw/zinc/29/05/27/336290527.db2.gz ODODTBZMXKENEE-CYBMUJFWSA-N 1 2 324.453 4.698 20 0 DJADLO COc1cc(C)c([C@H](C)Nc2ccc3ccccc3[nH+]2)cc1OC ZINC000301121814 336291092 /nfs/dbraw/zinc/29/10/92/336291092.db2.gz SYSGCTPTYGCKHD-AWEZNQCLSA-N 1 2 322.408 4.734 20 0 DJADLO Cc1ccc([C@@H]2CCCN2c2cc(C)[nH+]c(C(C)C)n2)s1 ZINC000301260609 336297363 /nfs/dbraw/zinc/29/73/63/336297363.db2.gz FJRCEMOTCYOTNV-AWEZNQCLSA-N 1 2 301.459 4.620 20 0 DJADLO C[C@H](Nc1ccc2ccccc2[nH+]1)c1cccc(-n2cccn2)c1 ZINC000301418288 336305443 /nfs/dbraw/zinc/30/54/43/336305443.db2.gz GRHWZHWEVYKQFA-HNNXBMFYSA-N 1 2 314.392 4.594 20 0 DJADLO CC(C)c1nc(N[C@H](C)c2ccc(-c3ccncc3)cc2)cc[nH+]1 ZINC000301462033 336308204 /nfs/dbraw/zinc/30/82/04/336308204.db2.gz ZEUNTUFRICIOBP-OAHLLOKOSA-N 1 2 318.424 4.835 20 0 DJADLO C[C@@H](Nc1cc[nH+]c(C(C)(C)C)n1)c1cccc(N2CCCC2)c1 ZINC000301554704 336314539 /nfs/dbraw/zinc/31/45/39/336314539.db2.gz IAWJAEZAUPSRHY-OAHLLOKOSA-N 1 2 324.472 4.547 20 0 DJADLO Cc1cc(N2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)nc[nH+]1 ZINC000301599949 336317522 /nfs/dbraw/zinc/31/75/22/336317522.db2.gz UTMYASLXZIZQTF-OAHLLOKOSA-N 1 2 321.346 4.535 20 0 DJADLO Cc1cc2ccccc2[nH+]c1N[C@@H](C)c1nc2ccccc2[nH]1 ZINC000301700825 336324379 /nfs/dbraw/zinc/32/43/79/336324379.db2.gz PRJQYBQLCZJWJD-ZDUSSCGKSA-N 1 2 302.381 4.593 20 0 DJADLO Cc1cc2ccccc2[nH+]c1N1C[C@H](C)O[C@@H](c2ccsc2)C1 ZINC000301737416 336326545 /nfs/dbraw/zinc/32/65/45/336326545.db2.gz VUVCMKVFNRUVLG-KBXCAEBGSA-N 1 2 324.449 4.571 20 0 DJADLO C[C@H](Nc1cc(C(F)(F)F)cc[nH+]1)c1cccc(F)c1F ZINC000301932557 336338608 /nfs/dbraw/zinc/33/86/08/336338608.db2.gz PIBFIACDYQKRRA-QMMMGPOBSA-N 1 2 302.246 4.552 20 0 DJADLO Cc1nc2c(s1)[C@H](Nc1[nH+]c3ccccc3cc1C)CCC2 ZINC000302029348 336343991 /nfs/dbraw/zinc/34/39/91/336343991.db2.gz MLJSJGFSBHGINJ-MRXNPFEDSA-N 1 2 309.438 4.798 20 0 DJADLO C[C@@H]1CCN(c2cc(C(F)(F)F)cc[nH+]2)[C@H](c2ccco2)C1 ZINC000302040369 336344785 /nfs/dbraw/zinc/34/47/85/336344785.db2.gz NKWQDCOOCCDJCY-YPMHNXCESA-N 1 2 310.319 4.671 20 0 DJADLO CC[C@@H](Nc1cc(C(C)(C)C)[nH+]c(C(C)C)n1)c1nccs1 ZINC000302893921 336373615 /nfs/dbraw/zinc/37/36/15/336373615.db2.gz OLHPBRONAXWXIO-GFCCVEGCSA-N 1 2 318.490 4.917 20 0 DJADLO CC(C)c1[nH]ccc1C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000352955179 336379114 /nfs/dbraw/zinc/37/91/14/336379114.db2.gz IDFZTJLDGLYKBZ-UHFFFAOYSA-N 1 2 321.380 4.578 20 0 DJADLO CC(C)n1ccc(C[NH2+][C@@H](C)c2ccc(-c3ccccc3)o2)n1 ZINC000514643320 336389735 /nfs/dbraw/zinc/38/97/35/336389735.db2.gz BTNCTFXBJLBPSC-HNNXBMFYSA-N 1 2 309.413 4.575 20 0 DJADLO Clc1scc(C[NH+]2CCC(OC3CCC3)CC2)c1Cl ZINC000418091990 336399148 /nfs/dbraw/zinc/39/91/48/336399148.db2.gz OGDCFMUNTXVYGT-UHFFFAOYSA-N 1 2 320.285 4.588 20 0 DJADLO Cc1ccc(NC(=O)C[C@@H](C)Cc2ccc(Cl)cc2)c(C)[nH+]1 ZINC000536797714 336399173 /nfs/dbraw/zinc/39/91/73/336399173.db2.gz SOJKVNTVKBXNMR-LBPRGKRZSA-N 1 2 316.832 4.559 20 0 DJADLO CC(C)CC[C@H]([NH2+]Cc1nnc(C(C)C)s1)c1ccoc1 ZINC000353545626 336424082 /nfs/dbraw/zinc/42/40/82/336424082.db2.gz TUGDGPULCYRKHQ-AWEZNQCLSA-N 1 2 307.463 4.522 20 0 DJADLO CC(C)[C@@H]([NH2+][C@H](c1nccs1)c1ccccc1)c1cccnc1 ZINC000359371248 336669843 /nfs/dbraw/zinc/66/98/43/336669843.db2.gz KNRGWBWAGVFSMX-MSOLQXFVSA-N 1 2 323.465 4.614 20 0 DJADLO CCC[C@@H]([NH2+][C@@H](C)c1csc(C)n1)c1ccc(F)cc1F ZINC000360994675 336731416 /nfs/dbraw/zinc/73/14/16/336731416.db2.gz GGOAWPHMMRKQMF-ZUZCIYMTSA-N 1 2 310.413 4.922 20 0 DJADLO CCC[C@H]([NH2+][C@@H](C)c1csc(C)n1)c1ccc(F)cc1F ZINC000360994673 336731426 /nfs/dbraw/zinc/73/14/26/336731426.db2.gz GGOAWPHMMRKQMF-BONVTDFDSA-N 1 2 310.413 4.922 20 0 DJADLO CC(C)c1nc([C@H](C)[NH2+][C@H]2c3ccc(F)cc3O[C@@H]2C)cs1 ZINC000368586306 336848619 /nfs/dbraw/zinc/84/86/19/336848619.db2.gz XNOWYWUQWJVPOH-LYOVBCGYSA-N 1 2 320.433 4.578 20 0 DJADLO Cc1ccc([C@@H]2CCCN2C(=O)Nc2c(C)cc[nH+]c2C)cc1C ZINC000376644565 337038917 /nfs/dbraw/zinc/03/89/17/337038917.db2.gz IDJQJNQXCFNABK-SFHVURJKSA-N 1 2 323.440 4.684 20 0 DJADLO Cc1ccc([C@H](C)[NH2+][C@@H](c2nccs2)c2ccccc2)cc1 ZINC000123344347 337044918 /nfs/dbraw/zinc/04/49/18/337044918.db2.gz GZWXTHLOSNKPQX-MAUKXSAKSA-N 1 2 308.450 4.892 20 0 DJADLO Cc1ccc(CNc2cccc3c2CN(c2cccc[nH+]2)C3)s1 ZINC000378268443 337069053 /nfs/dbraw/zinc/06/90/53/337069053.db2.gz GWLPPMFTZDGLOV-UHFFFAOYSA-N 1 2 321.449 4.584 20 0 DJADLO C[C@@H]([NH2+]Cc1nc(-c2ccccc2)c[nH]1)c1ccccc1Cl ZINC000194218366 337083064 /nfs/dbraw/zinc/08/30/64/337083064.db2.gz DECYISAINDEFIR-CYBMUJFWSA-N 1 2 311.816 4.581 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1cccc(F)c1)c1ncc(-c2ccccc2)o1 ZINC000172581903 337130035 /nfs/dbraw/zinc/13/00/35/337130035.db2.gz XALDIWKZWLDEEC-KBPBESRZSA-N 1 2 310.372 4.893 20 0 DJADLO Fc1ccc2c(c1)[C@H]([NH2+][C@@H](c1nccs1)c1ccccc1)CC2 ZINC000177695540 337158500 /nfs/dbraw/zinc/15/85/00/337158500.db2.gz CYESRUYMIAPDPM-QZTJIDSGSA-N 1 2 324.424 4.649 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1nccs1)c1ccccc1)c1ccsc1 ZINC000178197806 337161295 /nfs/dbraw/zinc/16/12/95/337161295.db2.gz GKIWLJXYDMSMKW-IUODEOHRSA-N 1 2 300.452 4.645 20 0 DJADLO CC[C@H]([NH2+]Cc1csc(-c2ccco2)n1)c1ccccc1F ZINC000180787406 337177876 /nfs/dbraw/zinc/17/78/76/337177876.db2.gz CUMQCQSPBCPKGT-HNNXBMFYSA-N 1 2 316.401 4.783 20 0 DJADLO Cc1cnc([C@@H](C)[NH2+]Cc2ccc(Oc3ccccc3)o2)s1 ZINC000180995147 337179138 /nfs/dbraw/zinc/17/91/38/337179138.db2.gz BIWCCNNZNKKVTE-CYBMUJFWSA-N 1 2 314.410 4.688 20 0 DJADLO Cc1ccc(CSCc2csc(-c3ccco3)n2)c(C)[nH+]1 ZINC000184811508 337200355 /nfs/dbraw/zinc/20/03/55/337200355.db2.gz IZKKZECTTPCTMX-UHFFFAOYSA-N 1 2 316.451 4.848 20 0 DJADLO Cc1cc([C@H](C)[NH2+][C@H](c2ccccc2)c2ccccn2)c(C)o1 ZINC000321410180 337262470 /nfs/dbraw/zinc/26/24/70/337262470.db2.gz BEVSQTNBMNIQKR-MGPUTAFESA-N 1 2 306.409 4.732 20 0 DJADLO CSc1ccc(C[N@@H+]2CCC[C@H]2c2csc(C)n2)cc1 ZINC000189854920 337283467 /nfs/dbraw/zinc/28/34/67/337283467.db2.gz BMBRVMITWWZFOA-INIZCTEOSA-N 1 2 304.484 4.511 20 0 DJADLO CSc1ccc(C[N@H+]2CCC[C@H]2c2csc(C)n2)cc1 ZINC000189854920 337283468 /nfs/dbraw/zinc/28/34/68/337283468.db2.gz BMBRVMITWWZFOA-INIZCTEOSA-N 1 2 304.484 4.511 20 0 DJADLO CC[C@H]([NH2+][C@H](C)c1ccn(C)n1)c1ccc(Cl)cc1Cl ZINC000459778478 337284655 /nfs/dbraw/zinc/28/46/55/337284655.db2.gz FLHOMWJIZJYGTB-YGRLFVJLSA-N 1 2 312.244 4.529 20 0 DJADLO C[C@@H]([NH2+][C@H](c1nccs1)c1ccccc1)c1ccccc1F ZINC000195069797 337464769 /nfs/dbraw/zinc/46/47/69/337464769.db2.gz LKXANAFDHQXESC-DYVFJYSZSA-N 1 2 312.413 4.722 20 0 DJADLO CCCCc1nc(C[NH2+][C@H](CC(F)F)c2ccccc2)cs1 ZINC000420988520 337517561 /nfs/dbraw/zinc/51/75/61/337517561.db2.gz URZMWORVFBWUAW-OAHLLOKOSA-N 1 2 324.440 4.972 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1ccncc1Cl)c1nc(C(C)(C)C)cs1 ZINC000421828486 337647010 /nfs/dbraw/zinc/64/70/10/337647010.db2.gz DAGOGGSMZDWRTM-QWRGUYRKSA-N 1 2 323.893 4.901 20 0 DJADLO Cc1ccccc1[C@@H](CC(F)(F)F)[NH2+][C@H](C)c1cscn1 ZINC000572469119 337666520 /nfs/dbraw/zinc/66/65/20/337666520.db2.gz XBSNBLLMYCZPES-DGCLKSJQSA-N 1 2 314.376 4.796 20 0 DJADLO CC(C)c1nc([C@@H](C)[NH2+][C@@H](c2ccccn2)C2CCC2)cs1 ZINC000527967889 337781165 /nfs/dbraw/zinc/78/11/65/337781165.db2.gz RNCYBMUMKJRAGQ-CXAGYDPISA-N 1 2 315.486 4.854 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1ncccc1F)c1cccc(Cl)c1Cl ZINC000528034884 337782227 /nfs/dbraw/zinc/78/22/27/337782227.db2.gz BEJKYNQVGIPFMS-UWVGGRQHSA-N 1 2 313.203 4.939 20 0 DJADLO COc1ccc([C@H](C)[NH2+][C@H](C)c2nc(C)cs2)c(Cl)c1 ZINC000424261675 337813243 /nfs/dbraw/zinc/81/32/43/337813243.db2.gz CPLOITJEZXSJMK-WDEREUQCSA-N 1 2 310.850 4.525 20 0 DJADLO Cc1c[nH+]ccc1NC(=O)CC(c1ccccc1)c1ccccc1 ZINC000107287625 337828265 /nfs/dbraw/zinc/82/82/65/337828265.db2.gz WBNVGVQNYNOPOP-UHFFFAOYSA-N 1 2 316.404 4.551 20 0 DJADLO Cc1c2cc(Cl)ccc2oc1C(=O)Nc1ccc(C)[nH+]c1C ZINC000119121440 337854559 /nfs/dbraw/zinc/85/45/59/337854559.db2.gz HEPOFJQIHSIVAZ-UHFFFAOYSA-N 1 2 314.772 4.659 20 0 DJADLO C[C@H]([NH2+][C@@H](c1ccco1)c1ccccc1)c1cc(F)cc(F)c1 ZINC000120837202 337881297 /nfs/dbraw/zinc/88/12/97/337881297.db2.gz LQENEJCSVRFVIE-ORAYPTAESA-N 1 2 313.347 4.998 20 0 DJADLO CCCCN(C(=O)Nc1cc[nH+]cc1C)[C@@H](C)c1ccccc1 ZINC000121630818 337896701 /nfs/dbraw/zinc/89/67/01/337896701.db2.gz ODSVOKKLWGOGMC-INIZCTEOSA-N 1 2 311.429 4.785 20 0 DJADLO C[C@H]([NH2+]Cc1nc2ccc(F)cc2o1)c1c(F)cccc1Cl ZINC000537175689 337907198 /nfs/dbraw/zinc/90/71/98/337907198.db2.gz WLEGKUHLRAFVBD-VIFPVBQESA-N 1 2 322.742 4.610 20 0 DJADLO COc1ccc(F)cc1[C@@H](C)[NH2+][C@H](C)c1c(F)cccc1F ZINC000122335716 337914301 /nfs/dbraw/zinc/91/43/01/337914301.db2.gz WJAIWJUVRCEMSA-GHMZBOCLSA-N 1 2 309.331 4.524 20 0 DJADLO Cc1cccc2c1CC[C@H]2[NH2+][C@@H](c1nccs1)c1ccccc1 ZINC000123110882 337944779 /nfs/dbraw/zinc/94/47/79/337944779.db2.gz DTVRJRQFBNMZEY-RTBURBONSA-N 1 2 320.461 4.818 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)C[C@@H](C)Cc1ccc(Cl)cc1 ZINC000425598682 338015854 /nfs/dbraw/zinc/01/58/54/338015854.db2.gz XEQATWJIKYTVHO-LBPRGKRZSA-N 1 2 316.832 4.559 20 0 DJADLO Cc1ccoc1C[NH2+][C@H](C)c1csc(-c2ccccc2F)n1 ZINC000426286951 338024658 /nfs/dbraw/zinc/02/46/58/338024658.db2.gz UJLZMJYJJKMALS-GFCCVEGCSA-N 1 2 316.401 4.701 20 0 DJADLO CCCc1nc(C)c(C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)o1 ZINC000428216908 338042836 /nfs/dbraw/zinc/04/28/36/338042836.db2.gz FJNZOYOISGXSAR-HNNXBMFYSA-N 1 2 304.821 4.536 20 0 DJADLO CCCc1nc(C)c(C[N@H+]2CC[C@H]2c2ccc(Cl)cc2)o1 ZINC000428216908 338042837 /nfs/dbraw/zinc/04/28/37/338042837.db2.gz FJNZOYOISGXSAR-HNNXBMFYSA-N 1 2 304.821 4.536 20 0 DJADLO Cc1nc(C(C)C)oc1C[N@@H+]1CCc2c(F)cc(F)cc2[C@@H]1C ZINC000428247838 338044273 /nfs/dbraw/zinc/04/42/73/338044273.db2.gz OLPPZHQOUJTXKW-LBPRGKRZSA-N 1 2 320.383 4.504 20 0 DJADLO Cc1nc(C(C)C)oc1C[N@H+]1CCc2c(F)cc(F)cc2[C@@H]1C ZINC000428247838 338044274 /nfs/dbraw/zinc/04/42/74/338044274.db2.gz OLPPZHQOUJTXKW-LBPRGKRZSA-N 1 2 320.383 4.504 20 0 DJADLO Cc1nc(C(C)C)oc1C[N@H+](C)[C@@H](C)c1ccccc1Cl ZINC000428458876 338052943 /nfs/dbraw/zinc/05/29/43/338052943.db2.gz LNJBQFHHFWTWTP-ZDUSSCGKSA-N 1 2 306.837 4.953 20 0 DJADLO Cc1nc(C(C)C)oc1C[N@@H+](C)[C@@H](C)c1ccccc1Cl ZINC000428458876 338052944 /nfs/dbraw/zinc/05/29/44/338052944.db2.gz LNJBQFHHFWTWTP-ZDUSSCGKSA-N 1 2 306.837 4.953 20 0 DJADLO Cc1nc(C(C)C)oc1C[N@H+](Cc1ccco1)Cc1ccccc1 ZINC000428469581 338054092 /nfs/dbraw/zinc/05/40/92/338054092.db2.gz KJYJRHXKJGFFNB-UHFFFAOYSA-N 1 2 324.424 4.902 20 0 DJADLO Cc1nc(C(C)C)oc1C[N@@H+](Cc1ccco1)Cc1ccccc1 ZINC000428469581 338054093 /nfs/dbraw/zinc/05/40/93/338054093.db2.gz KJYJRHXKJGFFNB-UHFFFAOYSA-N 1 2 324.424 4.902 20 0 DJADLO CCC[N@H+](Cc1oc(CC)nc1C)Cc1c(F)cccc1Cl ZINC000428480072 338054601 /nfs/dbraw/zinc/05/46/01/338054601.db2.gz BHGKZZJZLORWSK-UHFFFAOYSA-N 1 2 324.827 4.750 20 0 DJADLO CCC[N@@H+](Cc1oc(CC)nc1C)Cc1c(F)cccc1Cl ZINC000428480072 338054602 /nfs/dbraw/zinc/05/46/02/338054602.db2.gz BHGKZZJZLORWSK-UHFFFAOYSA-N 1 2 324.827 4.750 20 0 DJADLO FC(F)(F)c1ccc(CNc2ccc(-n3cc[nH+]c3)cc2)s1 ZINC000428878781 338064093 /nfs/dbraw/zinc/06/40/93/338064093.db2.gz FPBCDQAJSGXLDT-UHFFFAOYSA-N 1 2 323.343 4.565 20 0 DJADLO CCc1nc([C@@H](C)[NH2+]Cc2csc(Cl)c2Cl)cs1 ZINC000432248915 338148889 /nfs/dbraw/zinc/14/88/89/338148889.db2.gz ANRKLTKCRNWPJQ-SSDOTTSWSA-N 1 2 321.298 4.925 20 0 DJADLO CCc1nc([C@H](C)[NH2+]Cc2csc(Cl)c2Cl)cs1 ZINC000432248916 338148946 /nfs/dbraw/zinc/14/89/46/338148946.db2.gz ANRKLTKCRNWPJQ-ZETCQYMHSA-N 1 2 321.298 4.925 20 0 DJADLO Cc1csc([C@@H](C)[NH2+]Cc2ccc(F)c(Cl)c2Cl)n1 ZINC000432242464 338150158 /nfs/dbraw/zinc/15/01/58/338150158.db2.gz KTDQTROKFJRQIJ-MRVPVSSYSA-N 1 2 319.232 4.748 20 0 DJADLO Clc1scc(CNc2cccc(-n3cc[nH+]c3)c2)c1Cl ZINC000432256861 338151609 /nfs/dbraw/zinc/15/16/09/338151609.db2.gz VBPMMUMMNHSIFE-UHFFFAOYSA-N 1 2 324.236 4.853 20 0 DJADLO C[C@@H]([NH2+]Cc1cc(F)c(Cl)cc1F)c1ccc(F)cc1F ZINC000432512844 338158041 /nfs/dbraw/zinc/15/80/41/338158041.db2.gz XZJLFPZTKPASSN-MRVPVSSYSA-N 1 2 317.713 4.747 20 0 DJADLO CC1(CNc2ccc(-c3ccc(Cl)s3)c[nH+]2)CCOCC1 ZINC000432731654 338164723 /nfs/dbraw/zinc/16/47/23/338164723.db2.gz QSILSJRELPSVGB-UHFFFAOYSA-N 1 2 322.861 4.692 20 0 DJADLO Clc1scc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)c1Cl ZINC000432753642 338166540 /nfs/dbraw/zinc/16/65/40/338166540.db2.gz WEBXOMZRZZNNHE-NSHDSACASA-N 1 2 301.242 4.720 20 0 DJADLO Clc1scc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)c1Cl ZINC000432753642 338166541 /nfs/dbraw/zinc/16/65/41/338166541.db2.gz WEBXOMZRZZNNHE-NSHDSACASA-N 1 2 301.242 4.720 20 0 DJADLO Cc1ccc(CN2CC[C@H](C(F)(F)F)c3ccccc32)c(C)[nH+]1 ZINC000433028894 338177254 /nfs/dbraw/zinc/17/72/54/338177254.db2.gz QFVGHAUCJKRXET-INIZCTEOSA-N 1 2 320.358 4.755 20 0 DJADLO CC(C)O[C@H](C[NH2+][C@@H](c1ccccc1)C(F)F)c1ccccc1 ZINC000433052518 338178798 /nfs/dbraw/zinc/17/87/98/338178798.db2.gz MRJXGWIEUYSTGT-MSOLQXFVSA-N 1 2 319.395 4.749 20 0 DJADLO FC(F)[C@H]([NH2+]CC1CCC(C(F)(F)F)CC1)c1ccccc1 ZINC000433053399 338178841 /nfs/dbraw/zinc/17/88/41/338178841.db2.gz QCIIOZKDWQJDMG-UXUKBGGZSA-N 1 2 321.333 4.951 20 0 DJADLO FC(F)[C@@H]([NH2+]CC1CCC(C(F)(F)F)CC1)c1ccccc1 ZINC000433053398 338178860 /nfs/dbraw/zinc/17/88/60/338178860.db2.gz QCIIOZKDWQJDMG-UBHUBRDASA-N 1 2 321.333 4.951 20 0 DJADLO Clc1ccc(NCc2ccc(N3CCCC3)[nH+]c2)cc1Cl ZINC000433343833 338193383 /nfs/dbraw/zinc/19/33/83/338193383.db2.gz PLOMAXMWIJYJCZ-UHFFFAOYSA-N 1 2 322.239 4.601 20 0 DJADLO CC(C)c1nc(N2CCC[C@H]2c2cccnc2)cc(C(C)(C)C)[nH+]1 ZINC000433600124 338197831 /nfs/dbraw/zinc/19/78/31/338197831.db2.gz PIGMMHNYOUCOSH-INIZCTEOSA-N 1 2 324.472 4.634 20 0 DJADLO CC(C)[C@H](c1ccc(F)cc1)[N@H+](C)Cc1ncc(Cl)s1 ZINC000434612249 338221173 /nfs/dbraw/zinc/22/11/73/338221173.db2.gz PUZKRRWYQVOZLL-OAHLLOKOSA-N 1 2 312.841 4.765 20 0 DJADLO CC(C)[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1ncc(Cl)s1 ZINC000434612249 338221174 /nfs/dbraw/zinc/22/11/74/338221174.db2.gz PUZKRRWYQVOZLL-OAHLLOKOSA-N 1 2 312.841 4.765 20 0 DJADLO Cc1cc(C)c(NC(=O)N[C@H](c2ccccc2)C(C)C)c(C)[nH+]1 ZINC000436495427 338274282 /nfs/dbraw/zinc/27/42/82/338274282.db2.gz PEJDSSYUMLRAEL-KRWDZBQOSA-N 1 2 311.429 4.526 20 0 DJADLO CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)[NH+]1Cc2ccccc2C1 ZINC000155528887 338287871 /nfs/dbraw/zinc/28/78/71/338287871.db2.gz YXBWUNYDQHAYAN-HZPDHXFCSA-N 1 2 322.452 4.543 20 0 DJADLO Oc1cccc2c1CCC[C@@H]2Nc1[nH+]ccc2ccc(F)cc21 ZINC000436904051 338292958 /nfs/dbraw/zinc/29/29/58/338292958.db2.gz PMGPKPDJTHPQHM-KRWDZBQOSA-N 1 2 308.356 4.569 20 0 DJADLO CCCC[C@@H](CC)CSCc1[nH+]ccn1CC(F)(F)F ZINC000437274408 338305602 /nfs/dbraw/zinc/30/56/02/338305602.db2.gz GNYANXUBJXHTHF-GFCCVEGCSA-N 1 2 308.413 4.895 20 0 DJADLO Cc1sc(C[NH2+]Cc2ccc(Cl)cc2F)nc1C(C)C ZINC000438211113 338336711 /nfs/dbraw/zinc/33/67/11/338336711.db2.gz JRDAVNCDTAHWLL-UHFFFAOYSA-N 1 2 312.841 4.657 20 0 DJADLO CSc1cccc(C)c1NCc1c[nH+]cn1Cc1ccccc1 ZINC000438305097 338339070 /nfs/dbraw/zinc/33/90/70/338339070.db2.gz WOWIBGKPGPNMCS-UHFFFAOYSA-N 1 2 323.465 4.574 20 0 DJADLO c1[nH+]cn(Cc2ccccc2)c1CNc1cccc2ccccc21 ZINC000438311951 338339385 /nfs/dbraw/zinc/33/93/85/338339385.db2.gz MXKXIMCXCOYQRF-UHFFFAOYSA-N 1 2 313.404 4.697 20 0 DJADLO Cc1ccc(Cl)c(NCc2c[nH+]cn2Cc2ccccc2)c1 ZINC000438316012 338339437 /nfs/dbraw/zinc/33/94/37/338339437.db2.gz NPPKXZKXJLCKRB-UHFFFAOYSA-N 1 2 311.816 4.505 20 0 DJADLO CC(C)(C)c1ccc(NCc2c[nH+]cn2Cc2ccccc2)cc1 ZINC000438318894 338339451 /nfs/dbraw/zinc/33/94/51/338339451.db2.gz FNLDAYLJUCPTNU-UHFFFAOYSA-N 1 2 319.452 4.841 20 0 DJADLO CC(C)c1ccc(NCc2c[nH+]cn2Cc2ccccc2)cc1 ZINC000438325987 338339716 /nfs/dbraw/zinc/33/97/16/338339716.db2.gz VFWDOVGRVREXBO-UHFFFAOYSA-N 1 2 305.425 4.667 20 0 DJADLO CC(C)=CC[N@H+](Cc1cc(C)on1)Cc1ccc(Cl)cc1 ZINC000439495429 338371846 /nfs/dbraw/zinc/37/18/46/338371846.db2.gz QQSLJNITQUOJOC-UHFFFAOYSA-N 1 2 304.821 4.605 20 0 DJADLO CC(C)=CC[N@@H+](Cc1cc(C)on1)Cc1ccc(Cl)cc1 ZINC000439495429 338371847 /nfs/dbraw/zinc/37/18/47/338371847.db2.gz QQSLJNITQUOJOC-UHFFFAOYSA-N 1 2 304.821 4.605 20 0 DJADLO CC(C)CC(C)(C)C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000439749500 338377098 /nfs/dbraw/zinc/37/70/98/338377098.db2.gz FLBNCBGMZVYIAY-UHFFFAOYSA-N 1 2 312.413 4.885 20 0 DJADLO CSc1ccccc1[C@H](C)Nc1ccc(N2CCCC2)[nH+]c1 ZINC000442880772 338437717 /nfs/dbraw/zinc/43/77/17/338437717.db2.gz YMPVGLXKRWRMFN-AWEZNQCLSA-N 1 2 313.470 4.577 20 0 DJADLO Cc1ccc(NC(=O)[C@@H]2C[C@@H]2c2cccc3ccccc32)c(C)[nH+]1 ZINC000446419808 338527610 /nfs/dbraw/zinc/52/76/10/338527610.db2.gz XXHNSLKLBKVIRC-RTBURBONSA-N 1 2 316.404 4.594 20 0 DJADLO Cc1ccc(NC(=O)C(C)(C)Cc2cccc(Cl)c2)c(C)[nH+]1 ZINC000446430872 338528013 /nfs/dbraw/zinc/52/80/13/338528013.db2.gz YKFXUCUWHBDDKC-UHFFFAOYSA-N 1 2 316.832 4.559 20 0 DJADLO Cc1ccc(NC(=O)CCCc2csc3ccccc23)c(C)[nH+]1 ZINC000446435906 338528123 /nfs/dbraw/zinc/52/81/23/338528123.db2.gz HSVGGGTWMZQTGR-UHFFFAOYSA-N 1 2 324.449 4.875 20 0 DJADLO C[C@@H]1CCN(c2cccc[nH+]2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000446869908 338539145 /nfs/dbraw/zinc/53/91/45/338539145.db2.gz DUKUTCUQJOMING-MLGOLLRUSA-N 1 2 306.331 4.688 20 0 DJADLO CCC[C@H]1CCC[C@H]1C(=O)Nc1ccccc1-c1[nH]cc(C)[nH+]1 ZINC000450209839 338671159 /nfs/dbraw/zinc/67/11/59/338671159.db2.gz YKZXXMKLMYGILR-LSDHHAIUSA-N 1 2 311.429 4.540 20 0 DJADLO C[C@@H]1C[C@@H](Nc2ccc(C(C)(C)C(F)(F)F)cc2)c2[nH+]ccn21 ZINC000453201830 338807185 /nfs/dbraw/zinc/80/71/85/338807185.db2.gz CRRJVQSXBYSXMZ-BXUZGUMPSA-N 1 2 323.362 4.841 20 0 DJADLO CCc1ncc(C[NH2+][C@H](C)c2cc(F)c(Cl)cc2Cl)o1 ZINC000453341671 338827795 /nfs/dbraw/zinc/82/77/95/338827795.db2.gz CIAMREQRJZDTSK-MRVPVSSYSA-N 1 2 317.191 4.534 20 0 DJADLO CC[C@H]([NH2+][C@H]1C[C@@H](C)n2ccnc21)c1ccc(Cl)cc1Cl ZINC000453358547 338830939 /nfs/dbraw/zinc/83/09/39/338830939.db2.gz PXZBWIKNYWGAFN-ONERCXAPSA-N 1 2 324.255 4.937 20 0 DJADLO C[C@@H](c1nc(C2CC2)no1)[N@@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC000459578135 339037015 /nfs/dbraw/zinc/03/70/15/339037015.db2.gz XHCNZGJAIHFZSA-WMLDXEAASA-N 1 2 323.440 4.625 20 0 DJADLO C[C@@H](c1nc(C2CC2)no1)[N@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC000459578135 339037016 /nfs/dbraw/zinc/03/70/16/339037016.db2.gz XHCNZGJAIHFZSA-WMLDXEAASA-N 1 2 323.440 4.625 20 0 DJADLO COCC[C@@H](C)SCCCCCn1c(C)[nH+]c2ccccc21 ZINC000461248556 339060864 /nfs/dbraw/zinc/06/08/64/339060864.db2.gz PNKOFAAKKLMAFJ-OAHLLOKOSA-N 1 2 320.502 4.673 20 0 DJADLO c1[nH+]cn(Cc2ccccc2)c1CNc1cccc(C2CCC2)c1 ZINC000461733455 339066193 /nfs/dbraw/zinc/06/61/93/339066193.db2.gz AKCWPXJMFZBHDA-UHFFFAOYSA-N 1 2 317.436 4.811 20 0 DJADLO Cc1nc(N[C@@H](c2ccsc2)c2ccc(Cl)cc2)cc[nH+]1 ZINC000462374070 339077219 /nfs/dbraw/zinc/07/72/19/339077219.db2.gz UHEBBGNQFWLFNI-MRXNPFEDSA-N 1 2 315.829 4.701 20 0 DJADLO Cc1nc(N[C@H](CCc2ccccc2)c2ccccc2)cc[nH+]1 ZINC000462385989 339077807 /nfs/dbraw/zinc/07/78/07/339077807.db2.gz CAJNVEULYDATSJ-LJQANCHMSA-N 1 2 303.409 4.571 20 0 DJADLO Fc1cc2[nH+]cn(CCOc3cccc4ccccc43)c2cc1F ZINC000462565137 339081579 /nfs/dbraw/zinc/08/15/79/339081579.db2.gz JAIHYSNLKNGWGP-UHFFFAOYSA-N 1 2 324.330 4.547 20 0 DJADLO Cc1nc([C@@H](C)[NH2+][C@H](C)c2oc3ccccc3c2C)cs1 ZINC000462823582 339092302 /nfs/dbraw/zinc/09/23/02/339092302.db2.gz VZAZVYYKVHYGQY-VXGBXAGGSA-N 1 2 300.427 4.918 20 0 DJADLO COc1ccccc1[C@H](C)SCc1cn2c(cccc2C)[nH+]1 ZINC000463192094 339108775 /nfs/dbraw/zinc/10/87/75/339108775.db2.gz OTDSSJOSTPZYQM-AWEZNQCLSA-N 1 2 312.438 4.646 20 0 DJADLO Cc1ccc2sc(C(=O)Nc3c(C)cc(C)[nH+]c3C)cc2c1 ZINC000463256336 339112338 /nfs/dbraw/zinc/11/23/38/339112338.db2.gz DYDHDCJDJKHGAS-UHFFFAOYSA-N 1 2 310.422 4.782 20 0 DJADLO Cc1cc(F)cc(C(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)c1 ZINC000463636520 339122935 /nfs/dbraw/zinc/12/29/35/339122935.db2.gz NXSFJZUSMKLPSS-UHFFFAOYSA-N 1 2 322.339 4.574 20 0 DJADLO CCCc1nc(C[N@@H+]2C[C@H](C)C[C@@H]2c2ccccc2F)cs1 ZINC000464725093 339150145 /nfs/dbraw/zinc/15/01/45/339150145.db2.gz LVTYMBCUKQOMDT-CXAGYDPISA-N 1 2 318.461 4.818 20 0 DJADLO CCCc1nc(C[N@H+]2C[C@H](C)C[C@@H]2c2ccccc2F)cs1 ZINC000464725093 339150146 /nfs/dbraw/zinc/15/01/46/339150146.db2.gz LVTYMBCUKQOMDT-CXAGYDPISA-N 1 2 318.461 4.818 20 0 DJADLO C[C@@H]1C[C@@H](c2ccccc2F)[N@H+](Cc2ncc(C(C)(C)C)o2)C1 ZINC000464727974 339150323 /nfs/dbraw/zinc/15/03/23/339150323.db2.gz BYWOSWDGOZNPBC-CJNGLKHVSA-N 1 2 316.420 4.694 20 0 DJADLO C[C@@H]1C[C@@H](c2ccccc2F)[N@@H+](Cc2ncc(C(C)(C)C)o2)C1 ZINC000464727974 339150324 /nfs/dbraw/zinc/15/03/24/339150324.db2.gz BYWOSWDGOZNPBC-CJNGLKHVSA-N 1 2 316.420 4.694 20 0 DJADLO CC(C)CCc1nc(C[NH+]2CCC(C(F)(F)F)CC2)cs1 ZINC000464779852 339153148 /nfs/dbraw/zinc/15/31/48/339153148.db2.gz ZZGCLFKIGZMDKZ-UHFFFAOYSA-N 1 2 320.424 4.506 20 0 DJADLO C[C@H]1CC[N@H+](Cc2cc(-c3ccco3)on2)[C@@H](c2ccco2)C1 ZINC000464862255 339158678 /nfs/dbraw/zinc/15/86/78/339158678.db2.gz XBOJLTGPTORGNP-DZGCQCFKSA-N 1 2 312.369 4.501 20 0 DJADLO C[C@H]1CC[N@@H+](Cc2cc(-c3ccco3)on2)[C@@H](c2ccco2)C1 ZINC000464862255 339158679 /nfs/dbraw/zinc/15/86/79/339158679.db2.gz XBOJLTGPTORGNP-DZGCQCFKSA-N 1 2 312.369 4.501 20 0 DJADLO Fc1ccccc1C=C1CC[NH+](Cc2ccncc2Cl)CC1 ZINC000464896205 339160772 /nfs/dbraw/zinc/16/07/72/339160772.db2.gz NYLGLDPYBSXILC-UHFFFAOYSA-N 1 2 316.807 4.554 20 0 DJADLO Fc1ccc(NCc2c[nH+]c3ccc(Cl)cn23)cc1C1CC1 ZINC000466475436 339206544 /nfs/dbraw/zinc/20/65/44/339206544.db2.gz TXVOBXZETSMMNL-UHFFFAOYSA-N 1 2 315.779 4.616 20 0 DJADLO CCc1noc(C)c1C[N@H+](Cc1ccco1)Cc1cccc(C)c1 ZINC000466827782 339218426 /nfs/dbraw/zinc/21/84/26/339218426.db2.gz GFBSSVBEKSBAMF-UHFFFAOYSA-N 1 2 324.424 4.649 20 0 DJADLO CCc1noc(C)c1C[N@@H+](Cc1ccco1)Cc1cccc(C)c1 ZINC000466827782 339218427 /nfs/dbraw/zinc/21/84/27/339218427.db2.gz GFBSSVBEKSBAMF-UHFFFAOYSA-N 1 2 324.424 4.649 20 0 DJADLO COCc1ccc([C@H]2CCC[N@@H+]2Cc2c(F)cccc2Cl)o1 ZINC000467119153 339226789 /nfs/dbraw/zinc/22/67/89/339226789.db2.gz RBDKDMXRPWOMLQ-MRXNPFEDSA-N 1 2 323.795 4.556 20 0 DJADLO COCc1ccc([C@H]2CCC[N@H+]2Cc2c(F)cccc2Cl)o1 ZINC000467119153 339226790 /nfs/dbraw/zinc/22/67/90/339226790.db2.gz RBDKDMXRPWOMLQ-MRXNPFEDSA-N 1 2 323.795 4.556 20 0 DJADLO CCC(CC)n1ccc(C[NH2+][C@@H](C)c2cc3ccccc3o2)n1 ZINC000467277998 339229752 /nfs/dbraw/zinc/22/97/52/339229752.db2.gz IGKUBRASXYGJFK-AWEZNQCLSA-N 1 2 311.429 4.841 20 0 DJADLO CC(C)(C)C[C@H]([NH2+][C@@H]1CCC[C@H]([C@H]2CCOC2)C1)C(F)(F)F ZINC000467346844 339232926 /nfs/dbraw/zinc/23/29/26/339232926.db2.gz QQRVUJKUGYJZLP-XQLPTFJDSA-N 1 2 321.427 4.538 20 0 DJADLO Cc1ccc[nH+]c1[C@@H]1CCC[C@@H](Nc2cnn([C@H](C)C3CC3)c2)C1 ZINC000467349372 339233147 /nfs/dbraw/zinc/23/31/47/339233147.db2.gz JALOCYBHBQQZMT-KBAYOESNSA-N 1 2 324.472 4.696 20 0 DJADLO Cc1nc2ccc(N[C@@H]3CCC[C@H](c4[nH+]cccc4C)C3)cc2o1 ZINC000467357861 339233860 /nfs/dbraw/zinc/23/38/60/339233860.db2.gz ZFEJWWMVMIELSC-JKSUJKDBSA-N 1 2 321.424 4.978 20 0 DJADLO COc1cc(N[C@@H]2CCC[C@H](c3[nH+]cccc3C)C2)ccc1F ZINC000467368376 339234615 /nfs/dbraw/zinc/23/46/15/339234615.db2.gz VDHAKVSDSCKHQS-LSDHHAIUSA-N 1 2 314.404 4.676 20 0 DJADLO C[C@H]([NH2+]C1(c2ccccc2)CC1)c1nc(C(F)(F)F)cs1 ZINC000467736343 339244743 /nfs/dbraw/zinc/24/47/43/339244743.db2.gz BXYHZEURRHEKQR-JTQLQIEISA-N 1 2 312.360 4.502 20 0 DJADLO Cc1cc(-c2cccc(Cl)c2)ccc1NCc1[nH+]ccn1C ZINC000467765677 339246191 /nfs/dbraw/zinc/24/61/91/339246191.db2.gz AUSZZXBIKBFKAL-UHFFFAOYSA-N 1 2 311.816 4.661 20 0 DJADLO C[C@H](c1ccccc1Cl)[N@@H+]1CCO[C@H](c2ccsc2)C1 ZINC000468127965 339254818 /nfs/dbraw/zinc/25/48/18/339254818.db2.gz CSRPQQIDZYOWBV-WBMJQRKESA-N 1 2 307.846 4.536 20 0 DJADLO C[C@H](c1ccccc1Cl)[N@H+]1CCO[C@H](c2ccsc2)C1 ZINC000468127965 339254819 /nfs/dbraw/zinc/25/48/19/339254819.db2.gz CSRPQQIDZYOWBV-WBMJQRKESA-N 1 2 307.846 4.536 20 0 DJADLO COCc1ccc([C@H]2CCC[N@@H+]2Cc2cc(Cl)ccc2F)o1 ZINC000468693401 339268767 /nfs/dbraw/zinc/26/87/67/339268767.db2.gz JCARMXAVKMHRHB-MRXNPFEDSA-N 1 2 323.795 4.556 20 0 DJADLO COCc1ccc([C@H]2CCC[N@H+]2Cc2cc(Cl)ccc2F)o1 ZINC000468693401 339268768 /nfs/dbraw/zinc/26/87/68/339268768.db2.gz JCARMXAVKMHRHB-MRXNPFEDSA-N 1 2 323.795 4.556 20 0 DJADLO CCN(CC)c1ccc(N[C@H](C)c2csc(C(C)C)n2)c[nH+]1 ZINC000469798358 339300827 /nfs/dbraw/zinc/30/08/27/339300827.db2.gz GBZULQLRZKAJAT-CYBMUJFWSA-N 1 2 318.490 4.681 20 0 DJADLO C[C@@H](c1cc(F)ccc1F)[N@@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000470209927 339314332 /nfs/dbraw/zinc/31/43/32/339314332.db2.gz PHEQEWPQESRILN-BWACUDIHSA-N 1 2 323.408 4.549 20 0 DJADLO C[C@@H](c1cc(F)ccc1F)[N@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000470209927 339314333 /nfs/dbraw/zinc/31/43/33/339314333.db2.gz PHEQEWPQESRILN-BWACUDIHSA-N 1 2 323.408 4.549 20 0 DJADLO Cc1ccc2[nH]c(CNc3cccc(-n4cc[nH+]c4)c3)cc2c1C ZINC000472061122 339361762 /nfs/dbraw/zinc/36/17/62/339361762.db2.gz AFGDVQDIWXORLA-UHFFFAOYSA-N 1 2 316.408 4.583 20 0 DJADLO CC(C)[C@@H]([NH2+]Cc1ncc(Cl)s1)c1ccc(F)cc1F ZINC000472063257 339361771 /nfs/dbraw/zinc/36/17/71/339361771.db2.gz DDLZUGMZQFRWJU-CQSZACIVSA-N 1 2 316.804 4.562 20 0 DJADLO Clc1ccc([C@@H]2CCC[N@@H+]2Cc2ccncc2Cl)cc1 ZINC000472241898 339367306 /nfs/dbraw/zinc/36/73/06/339367306.db2.gz OJPZPPDKUUYEPX-INIZCTEOSA-N 1 2 307.224 4.726 20 0 DJADLO Clc1ccc([C@@H]2CCC[N@H+]2Cc2ccncc2Cl)cc1 ZINC000472241898 339367307 /nfs/dbraw/zinc/36/73/07/339367307.db2.gz OJPZPPDKUUYEPX-INIZCTEOSA-N 1 2 307.224 4.726 20 0 DJADLO C[C@@H](c1cccc(Cl)c1)[N@@H+]1CCO[C@H](c2cccs2)C1 ZINC000472833081 339378022 /nfs/dbraw/zinc/37/80/22/339378022.db2.gz XXPDIFMGKRPORY-WFASDCNBSA-N 1 2 307.846 4.536 20 0 DJADLO C[C@@H](c1cccc(Cl)c1)[N@H+]1CCO[C@H](c2cccs2)C1 ZINC000472833081 339378023 /nfs/dbraw/zinc/37/80/23/339378023.db2.gz XXPDIFMGKRPORY-WFASDCNBSA-N 1 2 307.846 4.536 20 0 DJADLO C[C@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2ncc(Cl)s2)C1 ZINC000473137957 339382059 /nfs/dbraw/zinc/38/20/59/339382059.db2.gz BTDDDCPOJUGDDW-GXFFZTMASA-N 1 2 310.825 4.519 20 0 DJADLO C[C@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2ncc(Cl)s2)C1 ZINC000473137957 339382060 /nfs/dbraw/zinc/38/20/60/339382060.db2.gz BTDDDCPOJUGDDW-GXFFZTMASA-N 1 2 310.825 4.519 20 0 DJADLO C[C@@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2ncc(Cl)s2)C1 ZINC000473137960 339382081 /nfs/dbraw/zinc/38/20/81/339382081.db2.gz BTDDDCPOJUGDDW-ZWNOBZJWSA-N 1 2 310.825 4.519 20 0 DJADLO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2ncc(Cl)s2)C1 ZINC000473137960 339382082 /nfs/dbraw/zinc/38/20/82/339382082.db2.gz BTDDDCPOJUGDDW-ZWNOBZJWSA-N 1 2 310.825 4.519 20 0 DJADLO Cc1ccc(C[N@H+](Cc2ncc(Cl)s2)C2CC2)cc1C ZINC000473150121 339383026 /nfs/dbraw/zinc/38/30/26/339383026.db2.gz YZMXMIIOXRAEEH-UHFFFAOYSA-N 1 2 306.862 4.578 20 0 DJADLO Cc1ccc(C[N@@H+](Cc2ncc(Cl)s2)C2CC2)cc1C ZINC000473150121 339383027 /nfs/dbraw/zinc/38/30/27/339383027.db2.gz YZMXMIIOXRAEEH-UHFFFAOYSA-N 1 2 306.862 4.578 20 0 DJADLO COc1c2ccccc2oc1C[NH2+][C@H](C)c1cc(F)ccc1F ZINC000473799634 339392367 /nfs/dbraw/zinc/39/23/67/339392367.db2.gz ULVHFXSLVWAZLW-LLVKDONJSA-N 1 2 317.335 4.570 20 0 DJADLO C[C@H](CC(C)(C)C)C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000475910538 339464767 /nfs/dbraw/zinc/46/47/67/339464767.db2.gz JLLPQYONYXPUAD-CQSZACIVSA-N 1 2 312.413 4.885 20 0 DJADLO FC(F)c1cccc(CSCc2cn3ccccc3[nH+]2)c1 ZINC000479605267 339543560 /nfs/dbraw/zinc/54/35/60/339543560.db2.gz MYPKECLCJVUGBL-UHFFFAOYSA-N 1 2 304.365 4.705 20 0 DJADLO C[C@@H](CCCC(F)(F)F)Nc1ccc(N2CCCCC2)c[nH+]1 ZINC000480177049 339562149 /nfs/dbraw/zinc/56/21/49/339562149.db2.gz ZJEVOFOIUUSMAF-ZDUSSCGKSA-N 1 2 315.383 4.605 20 0 DJADLO Cc1cccc(-c2cc(Cl)ccc2NCc2[nH+]ccn2C)c1 ZINC000480308197 339568345 /nfs/dbraw/zinc/56/83/45/339568345.db2.gz HBTXJGXLEDPDNV-UHFFFAOYSA-N 1 2 311.816 4.661 20 0 DJADLO CC[C@@H]([NH2+][C@@H](C)c1c(F)cccc1OC)c1cc(F)ccc1F ZINC000483728475 339673034 /nfs/dbraw/zinc/67/30/34/339673034.db2.gz PTJFDRGEDHRSDZ-MEDUHNTESA-N 1 2 323.358 4.914 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H]1CCCC[C@H]1c1ccccc1 ZINC000485483459 339704250 /nfs/dbraw/zinc/70/42/50/339704250.db2.gz VJURPIXPVFPVPN-ROUUACIJSA-N 1 2 323.440 4.546 20 0 DJADLO Cc1cc(NC(=O)Nc2ccccc2)ccc1Oc1cc[nH+]cc1 ZINC000485505724 339704672 /nfs/dbraw/zinc/70/46/72/339704672.db2.gz MVBKZHJBOYVQHU-UHFFFAOYSA-N 1 2 319.364 4.826 20 0 DJADLO CCC1(CC)CCCN(C(=O)Nc2c(C)cc[nH+]c2C)CC1 ZINC000485567022 339705890 /nfs/dbraw/zinc/70/58/90/339705890.db2.gz GBDXBGNKFQJGMZ-UHFFFAOYSA-N 1 2 303.450 4.523 20 0 DJADLO Cc1nc(N2CCCC[C@H]2c2ccccc2C(F)(F)F)cc[nH+]1 ZINC000487194500 339745942 /nfs/dbraw/zinc/74/59/42/339745942.db2.gz FCBHOROLFYZCCR-HNNXBMFYSA-N 1 2 321.346 4.535 20 0 DJADLO Fc1ccc(C2=CC[C@@H]([NH2+][C@@H](C3CC3)C(F)(F)F)CC2)cc1 ZINC000489762279 339817937 /nfs/dbraw/zinc/81/79/37/339817937.db2.gz CPPUDFCEIYJMHE-CVEARBPZSA-N 1 2 313.338 4.692 20 0 DJADLO CC(C)(C)c1nc(C[NH2+]C(C)(C)c2ccccc2F)cs1 ZINC000492391554 339899317 /nfs/dbraw/zinc/89/93/17/339899317.db2.gz ADICILMDPHBOAM-UHFFFAOYSA-N 1 2 306.450 4.605 20 0 DJADLO CCCCn1cc[nH+]c1-c1cccc(N[C@H](C)COC(C)C)c1 ZINC000500369182 340055788 /nfs/dbraw/zinc/05/57/88/340055788.db2.gz NLXPCVZIZYVNNB-MRXNPFEDSA-N 1 2 315.461 4.576 20 0 DJADLO CC(C)c1nc(C[NH2+][C@]2(c3ccc(Cl)cc3)C[C@@H]2C)cs1 ZINC000500414722 340057561 /nfs/dbraw/zinc/05/75/61/340057561.db2.gz INKUBBZQTYTTEW-YVEFUNNKSA-N 1 2 320.889 4.945 20 0 DJADLO C[C@@H]1C[C@@]1([NH2+]Cc1csc(C2CC2)n1)c1ccc(Cl)cc1 ZINC000500414217 340057569 /nfs/dbraw/zinc/05/75/69/340057569.db2.gz GLTQZDJRRUJVMY-DIFFPNOSSA-N 1 2 318.873 4.699 20 0 DJADLO Cc1cc([C@@H](C)[NH2+]Cc2ccc(-c3ccccc3)cc2F)no1 ZINC000500503452 340060848 /nfs/dbraw/zinc/06/08/48/340060848.db2.gz ZHJXXHIETCZTHE-CQSZACIVSA-N 1 2 310.372 4.640 20 0 DJADLO Cc1cc([C@H](C)[NH2+]Cc2ccc(-c3ccccc3)cc2F)no1 ZINC000500503451 340060892 /nfs/dbraw/zinc/06/08/92/340060892.db2.gz ZHJXXHIETCZTHE-AWEZNQCLSA-N 1 2 310.372 4.640 20 0 DJADLO C[C@H](c1ccccc1F)[N@H+](C)Cc1nc2ccccc2s1 ZINC000501425891 340080793 /nfs/dbraw/zinc/08/07/93/340080793.db2.gz QIFNSIKIFHQMIQ-GFCCVEGCSA-N 1 2 300.402 4.628 20 0 DJADLO C[C@H](c1ccccc1F)[N@@H+](C)Cc1nc2ccccc2s1 ZINC000501425891 340080794 /nfs/dbraw/zinc/08/07/94/340080794.db2.gz QIFNSIKIFHQMIQ-GFCCVEGCSA-N 1 2 300.402 4.628 20 0 DJADLO CC[C@H]1C[C@]1([NH2+]Cc1ncc(C(C)(C)C)o1)c1cccc(C)c1 ZINC000502483807 340105710 /nfs/dbraw/zinc/10/57/10/340105710.db2.gz KNYRCSGVZSXZKH-MGPUTAFESA-N 1 2 312.457 4.696 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1cnn(C2CCCC2)c1 ZINC000502696784 340111178 /nfs/dbraw/zinc/11/11/78/340111178.db2.gz FZZACTUUULBPRA-STQMWFEESA-N 1 2 319.399 4.688 20 0 DJADLO Cc1cc([C@@H](C)[NH2+][C@H](COCC(C)C)c2ccco2)oc1C ZINC000502700694 340111267 /nfs/dbraw/zinc/11/12/67/340111267.db2.gz QYEUBNWUMGTWSK-GDBMZVCRSA-N 1 2 305.418 4.554 20 0 DJADLO Cc1cc([C@H](C)[NH2+][C@@H](COCC(C)C)c2ccco2)oc1C ZINC000502700696 340111295 /nfs/dbraw/zinc/11/12/95/340111295.db2.gz QYEUBNWUMGTWSK-HOCLYGCPSA-N 1 2 305.418 4.554 20 0 DJADLO Clc1cccc(Cl)c1C[N@@H+]1CCC[C@H]1c1ccncc1 ZINC000503180124 340122703 /nfs/dbraw/zinc/12/27/03/340122703.db2.gz GPYYCDUANLIQDA-INIZCTEOSA-N 1 2 307.224 4.726 20 0 DJADLO Clc1cccc(Cl)c1C[N@H+]1CCC[C@H]1c1ccncc1 ZINC000503180124 340122704 /nfs/dbraw/zinc/12/27/04/340122704.db2.gz GPYYCDUANLIQDA-INIZCTEOSA-N 1 2 307.224 4.726 20 0 DJADLO CCOc1cccc2cc([C@H](C)[NH2+][C@H](C)c3cc(C)on3)oc21 ZINC000503856062 340135249 /nfs/dbraw/zinc/13/52/49/340135249.db2.gz MSTMAAYOPBUDIL-OLZOCXBDSA-N 1 2 314.385 4.540 20 0 DJADLO Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]C1(C(F)F)CC1 ZINC000503927316 340137217 /nfs/dbraw/zinc/13/72/17/340137217.db2.gz IREDACPSOSVBOK-GFCCVEGCSA-N 1 2 322.424 4.875 20 0 DJADLO C[C@@H]([NH2+]C1(C(F)F)CC1)[C@@H](C)Oc1ccc(Cl)cc1Cl ZINC000503937762 340137549 /nfs/dbraw/zinc/13/75/49/340137549.db2.gz OZDBUIKBTFAJNN-RKDXNWHRSA-N 1 2 324.198 4.537 20 0 DJADLO C/C(=C/c1ccccc1C(F)(F)F)C[N@@H+](C)Cc1cc(C)on1 ZINC000503957938 340138740 /nfs/dbraw/zinc/13/87/40/340138740.db2.gz NMXHBBQUCOCKJJ-WQLSENKSSA-N 1 2 324.346 4.537 20 0 DJADLO C/C(=C/c1ccccc1C(F)(F)F)C[N@H+](C)Cc1cc(C)on1 ZINC000503957938 340138741 /nfs/dbraw/zinc/13/87/41/340138741.db2.gz NMXHBBQUCOCKJJ-WQLSENKSSA-N 1 2 324.346 4.537 20 0 DJADLO c1ccc(NCc2ccc(-c3ccc4c(c3)CCCO4)cc2)[nH+]c1 ZINC000504179617 340142567 /nfs/dbraw/zinc/14/25/67/340142567.db2.gz AJOHRLJYENJQSF-UHFFFAOYSA-N 1 2 316.404 4.686 20 0 DJADLO CC(C)(C)c1n[nH]cc1C[N@H+](Cc1ccco1)Cc1ccccc1 ZINC000506086350 340185223 /nfs/dbraw/zinc/18/52/23/340185223.db2.gz QWKNNAPPOUQAJU-UHFFFAOYSA-N 1 2 323.440 4.503 20 0 DJADLO CC(C)(C)c1n[nH]cc1C[N@@H+](Cc1ccco1)Cc1ccccc1 ZINC000506086350 340185224 /nfs/dbraw/zinc/18/52/24/340185224.db2.gz QWKNNAPPOUQAJU-UHFFFAOYSA-N 1 2 323.440 4.503 20 0 DJADLO CC(C)[N@@H+](Cc1csc(-c2ccsc2)n1)Cc1ccco1 ZINC000506446675 340194789 /nfs/dbraw/zinc/19/47/89/340194789.db2.gz XOGHFSINRACGGU-UHFFFAOYSA-N 1 2 318.467 4.875 20 0 DJADLO CC(C)[N@H+](Cc1csc(-c2ccsc2)n1)Cc1ccco1 ZINC000506446675 340194790 /nfs/dbraw/zinc/19/47/90/340194790.db2.gz XOGHFSINRACGGU-UHFFFAOYSA-N 1 2 318.467 4.875 20 0 DJADLO Clc1ccc(C[N@H+](Cc2ccccn2)C2CC2)c(Cl)c1 ZINC000506585252 340197166 /nfs/dbraw/zinc/19/71/66/340197166.db2.gz QHADZFMHIFIESA-UHFFFAOYSA-N 1 2 307.224 4.553 20 0 DJADLO Clc1ccc(C[N@@H+](Cc2ccccn2)C2CC2)c(Cl)c1 ZINC000506585252 340197167 /nfs/dbraw/zinc/19/71/67/340197167.db2.gz QHADZFMHIFIESA-UHFFFAOYSA-N 1 2 307.224 4.553 20 0 DJADLO Cc1nc(C[N@H+](C)Cc2ccc(-c3ccccc3)s2)cs1 ZINC000506675206 340199396 /nfs/dbraw/zinc/19/93/96/340199396.db2.gz NNMZTMXWHDMVAS-UHFFFAOYSA-N 1 2 314.479 4.812 20 0 DJADLO Cc1nc(C[N@@H+](C)Cc2ccc(-c3ccccc3)s2)cs1 ZINC000506675206 340199397 /nfs/dbraw/zinc/19/93/97/340199397.db2.gz NNMZTMXWHDMVAS-UHFFFAOYSA-N 1 2 314.479 4.812 20 0 DJADLO C[C@H]1c2ccsc2CC[N@H+]1Cc1csc(C(C)(C)C)n1 ZINC000506726295 340200184 /nfs/dbraw/zinc/20/01/84/340200184.db2.gz MMNWTDOPDJGDKX-NSHDSACASA-N 1 2 306.500 4.621 20 0 DJADLO C[C@H]1c2ccsc2CC[N@@H+]1Cc1csc(C(C)(C)C)n1 ZINC000506726295 340200185 /nfs/dbraw/zinc/20/01/85/340200185.db2.gz MMNWTDOPDJGDKX-NSHDSACASA-N 1 2 306.500 4.621 20 0 DJADLO C[C@H]1C[C@@H]1c1ccc(C[N@H+](C)Cc2nc3ccccc3s2)o1 ZINC000506732217 340200310 /nfs/dbraw/zinc/20/03/10/340200310.db2.gz VBSFKJQQSGEWAH-JSGCOSHPSA-N 1 2 312.438 4.645 20 0 DJADLO C[C@H]1C[C@@H]1c1ccc(C[N@@H+](C)Cc2nc3ccccc3s2)o1 ZINC000506732217 340200311 /nfs/dbraw/zinc/20/03/11/340200311.db2.gz VBSFKJQQSGEWAH-JSGCOSHPSA-N 1 2 312.438 4.645 20 0 DJADLO CCc1cccc2c1OCC[C@H]2Nc1ccc2ccccc2[nH+]1 ZINC000506754676 340200993 /nfs/dbraw/zinc/20/09/93/340200993.db2.gz QHNIFBNRRCUSSI-GOSISDBHSA-N 1 2 304.393 4.733 20 0 DJADLO CCCCc1nc(C[NH2+][C@@H](c2ccc(Cl)cc2)C(C)C)no1 ZINC000506946159 340204174 /nfs/dbraw/zinc/20/41/74/340204174.db2.gz RHRLWIFMPRLMRO-QGZVFWFLSA-N 1 2 321.852 4.553 20 0 DJADLO CSCc1cnc(C[N@H+](C)Cc2ccc(C(C)C)cc2)s1 ZINC000506945115 340204192 /nfs/dbraw/zinc/20/41/92/340204192.db2.gz NAUULHPBJOGHIT-UHFFFAOYSA-N 1 2 320.527 4.762 20 0 DJADLO CSCc1cnc(C[N@@H+](C)Cc2ccc(C(C)C)cc2)s1 ZINC000506945115 340204193 /nfs/dbraw/zinc/20/41/93/340204193.db2.gz NAUULHPBJOGHIT-UHFFFAOYSA-N 1 2 320.527 4.762 20 0 DJADLO CCCc1ccc([C@@H]([NH2+]Cc2noc(C(C)C)n2)C(C)C)cc1 ZINC000506961533 340204477 /nfs/dbraw/zinc/20/44/77/340204477.db2.gz HRYURPCHKVUTSK-SFHVURJKSA-N 1 2 315.461 4.632 20 0 DJADLO CC(C)[N@@H+](Cc1csc(C(C)(C)C)n1)Cc1cccs1 ZINC000507012044 340205290 /nfs/dbraw/zinc/20/52/90/340205290.db2.gz GFEDAFRERFAGDH-UHFFFAOYSA-N 1 2 308.516 4.913 20 0 DJADLO CC(C)[N@H+](Cc1csc(C(C)(C)C)n1)Cc1cccs1 ZINC000507012044 340205291 /nfs/dbraw/zinc/20/52/91/340205291.db2.gz GFEDAFRERFAGDH-UHFFFAOYSA-N 1 2 308.516 4.913 20 0 DJADLO Cc1csc(C[N@H+](Cc2ccco2)Cc2cccc(C)c2)n1 ZINC000507193899 340212359 /nfs/dbraw/zinc/21/23/59/340212359.db2.gz VMOLVVGRYJSJMA-UHFFFAOYSA-N 1 2 312.438 4.555 20 0 DJADLO Cc1csc(C[N@@H+](Cc2ccco2)Cc2cccc(C)c2)n1 ZINC000507193899 340212360 /nfs/dbraw/zinc/21/23/60/340212360.db2.gz VMOLVVGRYJSJMA-UHFFFAOYSA-N 1 2 312.438 4.555 20 0 DJADLO C[C@H](c1c(F)cccc1F)[N@H+](C)Cc1ccc2ccccc2n1 ZINC000507206085 340213241 /nfs/dbraw/zinc/21/32/41/340213241.db2.gz YMBSTTCGKHPVKD-CYBMUJFWSA-N 1 2 312.363 4.706 20 0 DJADLO C[C@H](c1c(F)cccc1F)[N@@H+](C)Cc1ccc2ccccc2n1 ZINC000507206085 340213242 /nfs/dbraw/zinc/21/32/42/340213242.db2.gz YMBSTTCGKHPVKD-CYBMUJFWSA-N 1 2 312.363 4.706 20 0 DJADLO C[C@@H](c1ccco1)[N@H+](C)Cc1cc(C(F)(F)F)ccc1F ZINC000507210243 340213548 /nfs/dbraw/zinc/21/35/48/340213548.db2.gz KCCPOSQXIIHHLP-JTQLQIEISA-N 1 2 301.283 4.631 20 0 DJADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1cc(C(F)(F)F)ccc1F ZINC000507210243 340213549 /nfs/dbraw/zinc/21/35/49/340213549.db2.gz KCCPOSQXIIHHLP-JTQLQIEISA-N 1 2 301.283 4.631 20 0 DJADLO Cc1ccc(-c2nc(C[N@@H+](C)[C@@H](C)c3ccco3)cs2)cc1 ZINC000507221885 340214387 /nfs/dbraw/zinc/21/43/87/340214387.db2.gz PEEHCGWCJNYAMM-AWEZNQCLSA-N 1 2 312.438 4.905 20 0 DJADLO Cc1ccc(-c2nc(C[N@H+](C)[C@@H](C)c3ccco3)cs2)cc1 ZINC000507221885 340214388 /nfs/dbraw/zinc/21/43/88/340214388.db2.gz PEEHCGWCJNYAMM-AWEZNQCLSA-N 1 2 312.438 4.905 20 0 DJADLO CCc1cccnc1[C@@H](C)[NH2+][C@@H](C)c1c(F)cccc1Cl ZINC000507508581 340223264 /nfs/dbraw/zinc/22/32/64/340223264.db2.gz JPJBEZOHXGTSFT-NWDGAFQWSA-N 1 2 306.812 4.848 20 0 DJADLO CSc1ccc([C@@H](C)[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)cc1 ZINC000507511720 340223430 /nfs/dbraw/zinc/22/34/30/340223430.db2.gz OLKAJJKQGADYCB-NEPJUHHUSA-N 1 2 319.474 4.501 20 0 DJADLO CCc1cccnc1[C@@H](C)[NH2+][C@H](c1ccco1)c1ccccc1 ZINC000507520810 340224142 /nfs/dbraw/zinc/22/41/42/340224142.db2.gz UBBCWJGDEIXGIC-QRWLVFNGSA-N 1 2 306.409 4.677 20 0 DJADLO CC[C@H]1c2ccsc2CC[N@H+]1Cc1ncc(CSC)s1 ZINC000507524406 340224418 /nfs/dbraw/zinc/22/44/18/340224418.db2.gz CLLKNSQGNRTHBV-ZDUSSCGKSA-N 1 2 324.540 4.577 20 0 DJADLO CC[C@H]1c2ccsc2CC[N@@H+]1Cc1ncc(CSC)s1 ZINC000507524406 340224419 /nfs/dbraw/zinc/22/44/19/340224419.db2.gz CLLKNSQGNRTHBV-ZDUSSCGKSA-N 1 2 324.540 4.577 20 0 DJADLO C[C@@H](c1cccc(F)c1)[N@@H+]1CCO[C@@H](c2ccccc2Cl)C1 ZINC000507786806 340231391 /nfs/dbraw/zinc/23/13/91/340231391.db2.gz BLNFRURUNVLQOZ-SCLBCKFNSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@@H](c1cccc(F)c1)[N@H+]1CCO[C@@H](c2ccccc2Cl)C1 ZINC000507786806 340231392 /nfs/dbraw/zinc/23/13/92/340231392.db2.gz BLNFRURUNVLQOZ-SCLBCKFNSA-N 1 2 319.807 4.614 20 0 DJADLO CC1CCC(N(C)C(=O)c2ccccc2Oc2cc[nH+]cc2)CC1 ZINC000509060088 340259906 /nfs/dbraw/zinc/25/99/06/340259906.db2.gz HZYKIYVIDAGABW-UHFFFAOYSA-N 1 2 324.424 4.525 20 0 DJADLO CC[N@H+](Cc1csc(C(C)C)n1)[C@H](C)c1cccc(OC)c1 ZINC000516616582 340270041 /nfs/dbraw/zinc/27/00/41/340270041.db2.gz FIGCMGFZGFPADI-CQSZACIVSA-N 1 2 318.486 4.858 20 0 DJADLO CC[N@@H+](Cc1csc(C(C)C)n1)[C@H](C)c1cccc(OC)c1 ZINC000516616582 340270042 /nfs/dbraw/zinc/27/00/42/340270042.db2.gz FIGCMGFZGFPADI-CQSZACIVSA-N 1 2 318.486 4.858 20 0 DJADLO Cc1ccc(CNc2cc(-c3cncc(F)c3)ccc2C)c(C)[nH+]1 ZINC000509495612 340271413 /nfs/dbraw/zinc/27/14/13/340271413.db2.gz OVYSQHCLRNTLLF-UHFFFAOYSA-N 1 2 321.399 4.820 20 0 DJADLO C[N@H+](Cc1nc2ccccc2s1)Cc1ccc(F)cc1Cl ZINC000302744470 340280866 /nfs/dbraw/zinc/28/08/66/340280866.db2.gz VYDSCFSASYULLZ-UHFFFAOYSA-N 1 2 320.820 4.721 20 0 DJADLO C[N@@H+](Cc1nc2ccccc2s1)Cc1ccc(F)cc1Cl ZINC000302744470 340280867 /nfs/dbraw/zinc/28/08/67/340280867.db2.gz VYDSCFSASYULLZ-UHFFFAOYSA-N 1 2 320.820 4.721 20 0 DJADLO C[C@@H]1CCC[C@H](C)CN1C(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000509936038 340283184 /nfs/dbraw/zinc/28/31/84/340283184.db2.gz ZVYPKYSJIBFFKE-JKSUJKDBSA-N 1 2 324.424 4.525 20 0 DJADLO Cn1c(CCSc2ccc(Cl)cc2)[nH+]c2ccccc21 ZINC000509984586 340284614 /nfs/dbraw/zinc/28/46/14/340284614.db2.gz VMUWACMKUIXZGM-UHFFFAOYSA-N 1 2 302.830 4.562 20 0 DJADLO CC(C)Sc1ccc(C[N@@H+]2CCCC[C@@H]2c2cc[nH]n2)cc1 ZINC000510136627 340290097 /nfs/dbraw/zinc/29/00/97/340290097.db2.gz XMKKEDRDAZCVOE-GOSISDBHSA-N 1 2 315.486 4.637 20 0 DJADLO CC(C)Sc1ccc(C[N@H+]2CCCC[C@@H]2c2cc[nH]n2)cc1 ZINC000510136627 340290098 /nfs/dbraw/zinc/29/00/98/340290098.db2.gz XMKKEDRDAZCVOE-GOSISDBHSA-N 1 2 315.486 4.637 20 0 DJADLO c1ccc(N2Cc3cccc(N[C@H]4CC[C@@H]4C4CCC4)c3C2)[nH+]c1 ZINC000510701269 340307194 /nfs/dbraw/zinc/30/71/94/340307194.db2.gz HGNPCRBKOHEPRZ-XLIONFOSSA-N 1 2 319.452 4.592 20 0 DJADLO CCc1ccc([C@H](C)[NH2+]Cc2ccsc2Br)o1 ZINC000510991599 340317352 /nfs/dbraw/zinc/31/73/52/340317352.db2.gz JCEISLLPCJUKEV-VIFPVBQESA-N 1 2 314.248 4.517 20 0 DJADLO CC[N@H+](Cc1nc(C)cs1)Cc1ccc(Cl)c(Cl)c1 ZINC000511491375 340328465 /nfs/dbraw/zinc/32/84/65/340328465.db2.gz YQOJQAXLYACNSA-UHFFFAOYSA-N 1 2 315.269 4.780 20 0 DJADLO CC[N@@H+](Cc1nc(C)cs1)Cc1ccc(Cl)c(Cl)c1 ZINC000511491375 340328466 /nfs/dbraw/zinc/32/84/66/340328466.db2.gz YQOJQAXLYACNSA-UHFFFAOYSA-N 1 2 315.269 4.780 20 0 DJADLO Cc1cc([NH+]2CCCC2)ccc1Nc1nc2cc(F)ccc2o1 ZINC000511658980 340334150 /nfs/dbraw/zinc/33/41/50/340334150.db2.gz NRHLRTBBACSUGM-UHFFFAOYSA-N 1 2 311.360 4.619 20 0 DJADLO C[N@H+](CCC(F)(F)F)Cc1cc(C(F)(F)F)ccc1Cl ZINC000511776165 340338062 /nfs/dbraw/zinc/33/80/62/340338062.db2.gz TXYJDWCZKSMDGT-UHFFFAOYSA-N 1 2 319.676 4.743 20 0 DJADLO C[N@@H+](CCC(F)(F)F)Cc1cc(C(F)(F)F)ccc1Cl ZINC000511776165 340338063 /nfs/dbraw/zinc/33/80/63/340338063.db2.gz TXYJDWCZKSMDGT-UHFFFAOYSA-N 1 2 319.676 4.743 20 0 DJADLO CCn1c2ccccc2nc1[C@@H]1CCC[N@@H+]1Cc1ccccc1F ZINC000512604059 340368532 /nfs/dbraw/zinc/36/85/32/340368532.db2.gz CTHDZCBGJOESHU-IBGZPJMESA-N 1 2 323.415 4.532 20 0 DJADLO CCn1c2ccccc2nc1[C@@H]1CCC[N@H+]1Cc1ccccc1F ZINC000512604059 340368533 /nfs/dbraw/zinc/36/85/33/340368533.db2.gz CTHDZCBGJOESHU-IBGZPJMESA-N 1 2 323.415 4.532 20 0 DJADLO Cc1ccc(C[NH2+][C@H](C)c2nc(C3CCCCC3)no2)cc1C ZINC000173866027 340376341 /nfs/dbraw/zinc/37/63/41/340376341.db2.gz DONOVKIPTPTWKU-OAHLLOKOSA-N 1 2 313.445 4.585 20 0 DJADLO FC(F)(F)c1ccccc1C1(F)CCN(c2cccc[nH+]2)CC1 ZINC000513056388 340391317 /nfs/dbraw/zinc/39/13/17/340391317.db2.gz GJHSCXYFAYIQMU-UHFFFAOYSA-N 1 2 324.321 4.566 20 0 DJADLO C[C@H]([NH2+]Cc1cccc(Cl)c1Cl)c1c(F)cncc1F ZINC000513118116 340393991 /nfs/dbraw/zinc/39/39/91/340393991.db2.gz YCFYJIQOCAJVFI-QMMMGPOBSA-N 1 2 317.166 4.517 20 0 DJADLO C[C@@H]([NH2+]C1c2ccccc2-c2ccccc21)c1c(F)cncc1F ZINC000513236489 340398892 /nfs/dbraw/zinc/39/88/92/340398892.db2.gz MDJJGRXQDFLVKA-GFCCVEGCSA-N 1 2 322.358 4.780 20 0 DJADLO C(=C\c1ccc2ccccc2n1)\c1[nH+]ccn1Cc1ccccc1 ZINC000513470789 340409141 /nfs/dbraw/zinc/40/91/41/340409141.db2.gz XHGDBSLUMVEELY-SEYXRHQNSA-N 1 2 311.388 4.650 20 0 DJADLO CC[C@]1(C)CCCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000513838981 340427690 /nfs/dbraw/zinc/42/76/90/340427690.db2.gz AWOZKHZLOVQTMR-HXUWFJFHSA-N 1 2 324.424 4.526 20 0 DJADLO Cc1ccc(C)c([C@H]2CCCN2C(=O)Nc2ccc(C)[nH+]c2C)c1 ZINC000178222256 340447892 /nfs/dbraw/zinc/44/78/92/340447892.db2.gz AXNQAJXWRYFDME-LJQANCHMSA-N 1 2 323.440 4.684 20 0 DJADLO CC(C)COC[C@@H]([NH2+][C@H](C)c1ccc(F)cc1F)c1ccco1 ZINC000152578915 340528685 /nfs/dbraw/zinc/52/86/85/340528685.db2.gz QNWLNZWMODCPPQ-CXAGYDPISA-N 1 2 323.383 4.622 20 0 DJADLO Cc1cncc(C(=O)Nc2c3ccccc3[nH+]c(C)c2C(C)C)c1 ZINC000191956793 340560577 /nfs/dbraw/zinc/56/05/77/340560577.db2.gz SFHYHKLTNCVNQG-UHFFFAOYSA-N 1 2 319.408 4.622 20 0 DJADLO C[C@@H]([NH2+]Cc1nc2ccccc2[nH]1)c1cccc(Cl)c1Cl ZINC000227530236 340600056 /nfs/dbraw/zinc/60/00/56/340600056.db2.gz INNCRSZKBZEDFX-SNVBAGLBSA-N 1 2 320.223 4.721 20 0 DJADLO c1cc2c(ncnc2Nc2ccc(Nc3ccccc3)[nH+]c2)s1 ZINC000522624273 340605840 /nfs/dbraw/zinc/60/58/40/340605840.db2.gz KMHUSJQRYZRIRU-UHFFFAOYSA-N 1 2 319.393 4.574 20 0 DJADLO C[C@H](Nc1ccc(N2CCCC2)[nH+]c1)c1csc(Cl)c1 ZINC000230412087 340620074 /nfs/dbraw/zinc/62/00/74/340620074.db2.gz CERSPDMSQRJZOR-NSHDSACASA-N 1 2 307.850 4.570 20 0 DJADLO Cc1[nH+]cccc1NCc1ccc(-c2nc3ccccc3s2)o1 ZINC000237620242 340672740 /nfs/dbraw/zinc/67/27/40/340672740.db2.gz OPWNDCYYFUUBJD-UHFFFAOYSA-N 1 2 321.405 4.872 20 0 DJADLO CC[C@H]1CCC[C@@H](NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000524845368 340682376 /nfs/dbraw/zinc/68/23/76/340682376.db2.gz VOGSZGKPWWAFSE-DOTOQJQBSA-N 1 2 324.424 4.573 20 0 DJADLO FC(F)(F)c1cccc(CNc2cc(C(F)(F)F)cc[nH+]2)c1 ZINC000317094615 340702153 /nfs/dbraw/zinc/70/21/53/340702153.db2.gz KLOHZNYUEYYOCV-UHFFFAOYSA-N 1 2 320.236 4.731 20 0 DJADLO C[C@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1cccc(F)c1F ZINC000322575316 340705349 /nfs/dbraw/zinc/70/53/49/340705349.db2.gz ZZDJACMSYNYUPE-ZDUSSCGKSA-N 1 2 317.383 4.523 20 0 DJADLO Nc1ccc(SCc2cn3cc(Cl)ccc3[nH+]2)c(Cl)c1 ZINC000037204523 340773227 /nfs/dbraw/zinc/77/32/27/340773227.db2.gz BJJWQDSZDHYDMN-UHFFFAOYSA-N 1 2 324.236 4.516 20 0 DJADLO CC[C@@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1cccc(Cl)c1 ZINC000125288814 340803362 /nfs/dbraw/zinc/80/33/62/340803362.db2.gz IPBXKWXACJXCNO-CQSZACIVSA-N 1 2 306.837 4.866 20 0 DJADLO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1csc(C(C)(C)C)n1 ZINC000067184843 340855563 /nfs/dbraw/zinc/85/55/63/340855563.db2.gz FUCOFHBJKHQKJQ-CYBMUJFWSA-N 1 2 318.486 4.608 20 0 DJADLO C[C@@H]([NH2+][C@@H](COc1ccccc1)c1ccccc1)c1nccs1 ZINC000539069120 340870422 /nfs/dbraw/zinc/87/04/22/340870422.db2.gz OKWDNQZLKSOAJG-QAPCUYQASA-N 1 2 324.449 4.614 20 0 DJADLO C[C@@H]([NH2+]Cc1cc(-c2cccs2)on1)c1c(F)cccc1F ZINC000539234912 340877729 /nfs/dbraw/zinc/87/77/29/340877729.db2.gz WLEUCTOWWHNNFU-SNVBAGLBSA-N 1 2 320.364 4.532 20 0 DJADLO CC(C)[C@H]([NH2+]Cc1ncc(C2CC2)o1)c1ccccc1Cl ZINC000540386747 340929091 /nfs/dbraw/zinc/92/90/91/340929091.db2.gz YRNUCQZNMCYVDE-KRWDZBQOSA-N 1 2 304.821 4.692 20 0 DJADLO CCC(C)(C)OCc1ccccc1NCc1cccc2[nH+]ccn21 ZINC000541757587 340982664 /nfs/dbraw/zinc/98/26/64/340982664.db2.gz IUHFNRMNDKZMGY-UHFFFAOYSA-N 1 2 323.440 4.652 20 0 DJADLO CC(C)c1cnc(C[NH2+]Cc2cccc(Cl)c2Cl)s1 ZINC000542318749 341004722 /nfs/dbraw/zinc/00/47/22/341004722.db2.gz DTKWJHDMOGTBJA-UHFFFAOYSA-N 1 2 315.269 4.863 20 0 DJADLO CC1(C)CC[C@@H](Nc2cccc3c2CN(c2cccc[nH+]2)C3)C1 ZINC000542500822 341010696 /nfs/dbraw/zinc/01/06/96/341010696.db2.gz ZNKMESLEWDCGKQ-MRXNPFEDSA-N 1 2 307.441 4.592 20 0 DJADLO CCc1cccnc1[C@@H](C)[NH2+]Cc1c(Cl)cccc1Cl ZINC000542811822 341021652 /nfs/dbraw/zinc/02/16/52/341021652.db2.gz HZBVLJONEJLAPI-LLVKDONJSA-N 1 2 309.240 4.802 20 0 DJADLO Fc1ccccc1C1([NH2+]Cc2csc(-c3ccccc3)n2)CC1 ZINC000130541690 341027190 /nfs/dbraw/zinc/02/71/90/341027190.db2.gz VJKPHACCDREUIJ-UHFFFAOYSA-N 1 2 324.424 4.728 20 0 DJADLO CCc1cnc(C[NH2+][C@H](C)c2ccc(-c3ccccc3)o2)s1 ZINC000130649841 341036958 /nfs/dbraw/zinc/03/69/58/341036958.db2.gz IVJFHDMULSIUNH-CYBMUJFWSA-N 1 2 312.438 4.816 20 0 DJADLO CCc1cnc(C[NH2+][C@H](c2ccc(Cl)cc2F)C(C)C)o1 ZINC000543847697 341061442 /nfs/dbraw/zinc/06/14/42/341061442.db2.gz ZLQDZSODVAAWCM-INIZCTEOSA-N 1 2 310.800 4.516 20 0 DJADLO C(=C/c1ccc2ccccc2n1)\c1cc(-n2cc[nH+]c2)cs1 ZINC000544046174 341067873 /nfs/dbraw/zinc/06/78/73/341067873.db2.gz PBQQQJQGSUKMDS-BQYQJAHWSA-N 1 2 303.390 4.652 20 0 DJADLO CC(C)Oc1ccccc1[C@@H](C)[NH2+]Cc1nc(C2CC2)cs1 ZINC000544122472 341071179 /nfs/dbraw/zinc/07/11/79/341071179.db2.gz XKTQERLOPRBRPN-CYBMUJFWSA-N 1 2 316.470 4.659 20 0 DJADLO CC(C)Oc1cccc(C[N@H+](C)Cc2ncc(C(C)C)s2)c1 ZINC000544348756 341077199 /nfs/dbraw/zinc/07/71/99/341077199.db2.gz OVSFUXUHIXJCFD-UHFFFAOYSA-N 1 2 318.486 4.686 20 0 DJADLO CC(C)Oc1cccc(C[N@@H+](C)Cc2ncc(C(C)C)s2)c1 ZINC000544348756 341077200 /nfs/dbraw/zinc/07/72/00/341077200.db2.gz OVSFUXUHIXJCFD-UHFFFAOYSA-N 1 2 318.486 4.686 20 0 DJADLO CC(C)c1cnc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)s1 ZINC000544351147 341077573 /nfs/dbraw/zinc/07/75/73/341077573.db2.gz LXHYMBRFFNXMRN-OAHLLOKOSA-N 1 2 304.434 4.743 20 0 DJADLO CC(C)c1cnc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)s1 ZINC000544351147 341077574 /nfs/dbraw/zinc/07/75/74/341077574.db2.gz LXHYMBRFFNXMRN-OAHLLOKOSA-N 1 2 304.434 4.743 20 0 DJADLO Cc1[nH+]c2ccccn2c1CNc1cccc(C(F)F)c1Cl ZINC000544598655 341087973 /nfs/dbraw/zinc/08/79/73/341087973.db2.gz HMQVHWBSCBDILW-UHFFFAOYSA-N 1 2 321.758 4.846 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1ccccc1OCc1ccccc1)c1ccon1 ZINC000544607218 341088550 /nfs/dbraw/zinc/08/85/50/341088550.db2.gz RPZMSXNRKSKPFI-HOTGVXAUSA-N 1 2 322.408 4.665 20 0 DJADLO CC[C@@](C)([NH2+]Cc1cc(Cl)ccc1Cl)c1nccs1 ZINC000072685006 341098072 /nfs/dbraw/zinc/09/80/72/341098072.db2.gz AQZAWWNHRUFIOM-CQSZACIVSA-N 1 2 315.269 4.865 20 0 DJADLO CC(C)[N@H+](Cc1nc(C(F)(F)F)cs1)Cc1ccccc1 ZINC000131716915 341109744 /nfs/dbraw/zinc/10/97/44/341109744.db2.gz XHAOHGLNOSVPKR-UHFFFAOYSA-N 1 2 314.376 4.573 20 0 DJADLO CC(C)[N@@H+](Cc1nc(C(F)(F)F)cs1)Cc1ccccc1 ZINC000131716915 341109745 /nfs/dbraw/zinc/10/97/45/341109745.db2.gz XHAOHGLNOSVPKR-UHFFFAOYSA-N 1 2 314.376 4.573 20 0 DJADLO C[C@@H](c1cccc(Cl)c1)[N@H+](C)Cc1nc(C2CCCC2)no1 ZINC000132613299 341131743 /nfs/dbraw/zinc/13/17/43/341131743.db2.gz WFWJUFOQGKCKBM-LBPRGKRZSA-N 1 2 319.836 4.574 20 0 DJADLO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)Cc1nc(C2CCCC2)no1 ZINC000132613299 341131744 /nfs/dbraw/zinc/13/17/44/341131744.db2.gz WFWJUFOQGKCKBM-LBPRGKRZSA-N 1 2 319.836 4.574 20 0 DJADLO C[C@H](c1cccc(Cl)c1)[N@H+](C)Cc1nc(C2CCCC2)no1 ZINC000132613488 341131773 /nfs/dbraw/zinc/13/17/73/341131773.db2.gz WFWJUFOQGKCKBM-GFCCVEGCSA-N 1 2 319.836 4.574 20 0 DJADLO C[C@H](c1cccc(Cl)c1)[N@@H+](C)Cc1nc(C2CCCC2)no1 ZINC000132613488 341131774 /nfs/dbraw/zinc/13/17/74/341131774.db2.gz WFWJUFOQGKCKBM-GFCCVEGCSA-N 1 2 319.836 4.574 20 0 DJADLO O=C(Nc1ccc(-c2c[nH]c[nH+]2)cc1)c1cccc2ccsc21 ZINC000545927042 341146583 /nfs/dbraw/zinc/14/65/83/341146583.db2.gz HWTKDHOYQPSZSA-UHFFFAOYSA-N 1 2 319.389 4.544 20 0 DJADLO Cc1cc(C[N@@H+]2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)on1 ZINC000545974540 341149162 /nfs/dbraw/zinc/14/91/62/341149162.db2.gz AZEOVRRWDKCZBW-MRXNPFEDSA-N 1 2 324.346 4.729 20 0 DJADLO Cc1cc(C[N@H+]2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)on1 ZINC000545974540 341149163 /nfs/dbraw/zinc/14/91/63/341149163.db2.gz AZEOVRRWDKCZBW-MRXNPFEDSA-N 1 2 324.346 4.729 20 0 DJADLO Cc1cnc(C[N@H+](Cc2ccc(Cl)c(Cl)c2)C(C)C)o1 ZINC000075642601 341180311 /nfs/dbraw/zinc/18/03/11/341180311.db2.gz ZLYIKEYTLUEJOL-UHFFFAOYSA-N 1 2 313.228 4.700 20 0 DJADLO Cc1cnc(C[N@@H+](Cc2ccc(Cl)c(Cl)c2)C(C)C)o1 ZINC000075642601 341180312 /nfs/dbraw/zinc/18/03/12/341180312.db2.gz ZLYIKEYTLUEJOL-UHFFFAOYSA-N 1 2 313.228 4.700 20 0 DJADLO C[N@H+](Cc1cscn1)[C@H]1CCc2c1cc(Cl)cc2Cl ZINC000133721029 341183202 /nfs/dbraw/zinc/18/32/02/341183202.db2.gz PKHGRVNMFTUQOO-AWEZNQCLSA-N 1 2 313.253 4.569 20 0 DJADLO C[N@@H+](Cc1cscn1)[C@H]1CCc2c1cc(Cl)cc2Cl ZINC000133721029 341183203 /nfs/dbraw/zinc/18/32/03/341183203.db2.gz PKHGRVNMFTUQOO-AWEZNQCLSA-N 1 2 313.253 4.569 20 0 DJADLO CCCC[C@H](CC)[NH2+][C@H](c1noc(C)n1)c1ccc(Cl)cc1 ZINC000547312723 341204875 /nfs/dbraw/zinc/20/48/75/341204875.db2.gz QTUATZOAPOZBRB-HOTGVXAUSA-N 1 2 321.852 4.679 20 0 DJADLO CC(C)c1nc(C[NH2+][C@@H](C)c2ccc(F)cc2Cl)cs1 ZINC000076761884 341213702 /nfs/dbraw/zinc/21/37/02/341213702.db2.gz GBHNMEKJPBSTRT-JTQLQIEISA-N 1 2 312.841 4.910 20 0 DJADLO C[C@@H]([NH2+]Cc1csc(C2CC2)n1)c1ccc(F)cc1Cl ZINC000076761746 341213712 /nfs/dbraw/zinc/21/37/12/341213712.db2.gz RMLNOEVBASTNCN-SECBINFHSA-N 1 2 310.825 4.664 20 0 DJADLO CC(C)c1nc(C[NH2+][C@H](C)c2ccc(F)cc2Cl)cs1 ZINC000076761887 341213764 /nfs/dbraw/zinc/21/37/64/341213764.db2.gz GBHNMEKJPBSTRT-SNVBAGLBSA-N 1 2 312.841 4.910 20 0 DJADLO c1c[nH]c([C@H]2CCC[N@H+]2Cc2csc(-c3ccsc3)n2)c1 ZINC000077170985 341219854 /nfs/dbraw/zinc/21/98/54/341219854.db2.gz SSAYNPZEYVYXOU-OAHLLOKOSA-N 1 2 315.467 4.537 20 0 DJADLO c1c[nH]c([C@H]2CCC[N@@H+]2Cc2csc(-c3ccsc3)n2)c1 ZINC000077170985 341219855 /nfs/dbraw/zinc/21/98/55/341219855.db2.gz SSAYNPZEYVYXOU-OAHLLOKOSA-N 1 2 315.467 4.537 20 0 DJADLO Cc1cnc([C@H](C)[NH2+]Cc2cccc(Cl)c2Cl)s1 ZINC000134909621 341226472 /nfs/dbraw/zinc/22/64/72/341226472.db2.gz APGBAFARZFYHIQ-VIFPVBQESA-N 1 2 301.242 4.609 20 0 DJADLO c1coc(C[N@H+](Cc2csc(C3CC3)n2)C2CCCC2)c1 ZINC000135061822 341230226 /nfs/dbraw/zinc/23/02/26/341230226.db2.gz ZDBBXDWQOJMWFV-UHFFFAOYSA-N 1 2 302.443 4.558 20 0 DJADLO c1coc(C[N@@H+](Cc2csc(C3CC3)n2)C2CCCC2)c1 ZINC000135061822 341230227 /nfs/dbraw/zinc/23/02/27/341230227.db2.gz ZDBBXDWQOJMWFV-UHFFFAOYSA-N 1 2 302.443 4.558 20 0 DJADLO C[C@@H]([NH2+]Cc1csc(-c2ccco2)n1)c1ccccc1Cl ZINC000078622727 341245220 /nfs/dbraw/zinc/24/52/20/341245220.db2.gz SIZSVPLMUHILOC-LLVKDONJSA-N 1 2 318.829 4.907 20 0 DJADLO CCCCc1noc([C@@H](C)[NH2+][C@H](C)c2cccc3ccccc32)n1 ZINC000079287797 341256264 /nfs/dbraw/zinc/25/62/64/341256264.db2.gz OJFHTFOWJBZDNJ-HUUCEWRRSA-N 1 2 323.440 4.977 20 0 DJADLO C[C@@H]([NH2+]Cc1c(Cl)cccc1Cl)c1ccc(Cl)cn1 ZINC000548483670 341263144 /nfs/dbraw/zinc/26/31/44/341263144.db2.gz HSHBFKUICFOTEE-SECBINFHSA-N 1 2 315.631 4.893 20 0 DJADLO CC1(C(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)CCCCC1 ZINC000548688217 341269351 /nfs/dbraw/zinc/26/93/51/341269351.db2.gz VIUUEQOXGJGKOE-UHFFFAOYSA-N 1 2 310.397 4.783 20 0 DJADLO Cc1nc(-c2cc([C@H](C)[NH2+][C@H](C)c3ccon3)cs2)cs1 ZINC000564354955 341271807 /nfs/dbraw/zinc/27/18/07/341271807.db2.gz HQDUYECFLOGMGE-VHSXEESVSA-N 1 2 319.455 4.580 20 0 DJADLO Cc1cnc(C(C)(C)[NH2+]Cc2cccc(Cl)c2Cl)s1 ZINC000080346575 341273019 /nfs/dbraw/zinc/27/30/19/341273019.db2.gz KMWOYSJQYVNWLQ-UHFFFAOYSA-N 1 2 315.269 4.783 20 0 DJADLO Cc1[nH+]c(C(C)C)ccc1COc1cccc(C(F)(F)F)n1 ZINC000549378518 341292734 /nfs/dbraw/zinc/29/27/34/341292734.db2.gz QOFSBTFATMEJIL-UHFFFAOYSA-N 1 2 310.319 4.506 20 0 DJADLO C[C@H]([NH2+]Cc1c[nH]c(-c2ccccc2)n1)c1ccccc1Cl ZINC000550287534 341314447 /nfs/dbraw/zinc/31/44/47/341314447.db2.gz WPZRXPGMUNVEAN-ZDUSSCGKSA-N 1 2 311.816 4.581 20 0 DJADLO Cc1cc([C@H](C)[NH2+][C@H](c2ccccc2)c2ccc(F)cc2)no1 ZINC000550932904 341327099 /nfs/dbraw/zinc/32/70/99/341327099.db2.gz XOEKJHFDEHYQAH-IFXJQAMLSA-N 1 2 310.372 4.562 20 0 DJADLO CC(C)c1ncc(C[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)s1 ZINC000552104138 341370082 /nfs/dbraw/zinc/37/00/82/341370082.db2.gz WRIHXICSGJSJTE-OAHLLOKOSA-N 1 2 306.862 4.867 20 0 DJADLO CC(C)c1ncc(C[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)s1 ZINC000552104138 341370083 /nfs/dbraw/zinc/37/00/83/341370083.db2.gz WRIHXICSGJSJTE-OAHLLOKOSA-N 1 2 306.862 4.867 20 0 DJADLO COCc1ccc([C@@H]2CCC[N@@H+]2[C@H](C)c2c(F)cccc2F)o1 ZINC000248630236 341382140 /nfs/dbraw/zinc/38/21/40/341382140.db2.gz RLCHTGYFKZBIIF-WBMJQRKESA-N 1 2 321.367 4.602 20 0 DJADLO COCc1ccc([C@@H]2CCC[N@H+]2[C@H](C)c2c(F)cccc2F)o1 ZINC000248630236 341382141 /nfs/dbraw/zinc/38/21/41/341382141.db2.gz RLCHTGYFKZBIIF-WBMJQRKESA-N 1 2 321.367 4.602 20 0 DJADLO CCc1nc2cc(N[C@@H](c3[nH]cc[nH+]3)C3CCCCC3)ccc2o1 ZINC000552275289 341383155 /nfs/dbraw/zinc/38/31/55/341383155.db2.gz QSFRIUGXCDSZBO-GOSISDBHSA-N 1 2 324.428 4.847 20 0 DJADLO C[C@@H]1C[C@]1([NH2+]Cc1cc(C(C)(C)C)on1)c1ccc(Cl)cc1 ZINC000564392642 341396924 /nfs/dbraw/zinc/39/69/24/341396924.db2.gz ACIUYKQZXSQSBV-KZULUSFZSA-N 1 2 318.848 4.650 20 0 DJADLO Cc1cc(N2CC[C@H]2c2ccc(Cl)cc2)nc(C(C)C)[nH+]1 ZINC000553263108 341422423 /nfs/dbraw/zinc/42/24/23/341422423.db2.gz DYHKYRHHNOOORM-HNNXBMFYSA-N 1 2 301.821 4.513 20 0 DJADLO CCSCCC[NH2+][C@H](c1cccc(OC(C)C)c1)C(F)F ZINC000556254445 341499529 /nfs/dbraw/zinc/49/95/29/341499529.db2.gz USPUMTXUHDNSOD-OAHLLOKOSA-N 1 2 317.445 4.513 20 0 DJADLO CCOc1cccc(Cl)c1C[NH2+]C(C)(C)c1ncc(C)s1 ZINC000565958688 341543753 /nfs/dbraw/zinc/54/37/53/341543753.db2.gz CSDNBVQDGQGWQE-UHFFFAOYSA-N 1 2 324.877 4.529 20 0 DJADLO FC(F)(F)Oc1cccc([C@@H](Nc2cccc[nH+]2)C2CC2)c1 ZINC000567187998 341585076 /nfs/dbraw/zinc/58/50/76/341585076.db2.gz FZHOUEIBEFFRNX-HNNXBMFYSA-N 1 2 308.303 4.543 20 0 DJADLO CC(C)c1nc(C[NH2+][C@H](c2ccc(C(C)C)cc2)C(C)C)no1 ZINC000154356020 341588346 /nfs/dbraw/zinc/58/83/46/341588346.db2.gz IALZOOYCCNQOBT-SFHVURJKSA-N 1 2 315.461 4.803 20 0 DJADLO CCc1ccc(C[NH2+][C@H](C)c2nc(C3CCCCC3)no2)cc1 ZINC000173863319 341820477 /nfs/dbraw/zinc/82/04/77/341820477.db2.gz JUEHBFOJDJGVQV-CQSZACIVSA-N 1 2 313.445 4.531 20 0 DJADLO Cc1cc[nH+]cc1CCCNc1ccc(-c2nccs2)cc1 ZINC000576194131 341832276 /nfs/dbraw/zinc/83/22/76/341832276.db2.gz VJNPPTULZYSXBY-UHFFFAOYSA-N 1 2 309.438 4.558 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1ccc(C2CC2)cc1)c1nc(C(C)(C)C)no1 ZINC000576966543 341872564 /nfs/dbraw/zinc/87/25/64/341872564.db2.gz ULTLESGKLONBQC-CHWSQXEVSA-N 1 2 313.445 4.656 20 0 DJADLO Cc1cnc(C2CCN(c3[nH+]c4ccccc4cc3C)CC2)s1 ZINC000580613571 341885981 /nfs/dbraw/zinc/88/59/81/341885981.db2.gz DKWPIYPWNQKSIX-UHFFFAOYSA-N 1 2 323.465 4.692 20 0 DJADLO C[C@H]1[C@@H](C(F)(F)F)CCN1c1cc[nH+]c2c(Cl)cccc12 ZINC000577783168 341936548 /nfs/dbraw/zinc/93/65/48/341936548.db2.gz HKEMUALKVSEFCT-ONGXEEELSA-N 1 2 314.738 4.665 20 0 DJADLO Cc1nc(C[NH2+][C@H](C)c2cc3ccccc3o2)nc2ccccc12 ZINC000178461499 341955189 /nfs/dbraw/zinc/95/51/89/341955189.db2.gz LAARYMPPSZBMDA-CQSZACIVSA-N 1 2 317.392 4.535 20 0 DJADLO CC(C)n1ccnc1C[N@H+](Cc1cccc(Cl)c1)C(C)C ZINC000337351851 519663236 /nfs/dbraw/zinc/66/32/36/519663236.db2.gz XEGDXSNNNJPUHV-UHFFFAOYSA-N 1 2 305.853 4.528 20 0 DJADLO CC(C)n1ccnc1C[N@@H+](Cc1cccc(Cl)c1)C(C)C ZINC000337351851 519663238 /nfs/dbraw/zinc/66/32/38/519663238.db2.gz XEGDXSNNNJPUHV-UHFFFAOYSA-N 1 2 305.853 4.528 20 0 DJADLO CC(C)n1ccnc1C[NH2+][C@H](c1ccc(F)cc1F)C(C)(C)C ZINC000181621192 520031438 /nfs/dbraw/zinc/03/14/38/520031438.db2.gz FMKIMKMJLCFNGU-QGZVFWFLSA-N 1 2 321.415 4.619 20 0 DJADLO CCO[C@@H](C)c1nc(C[N@H+](Cc2cccs2)C(C)C)cs1 ZINC000336839377 520267456 /nfs/dbraw/zinc/26/74/56/520267456.db2.gz SUEITERTJYPKPK-ZDUSSCGKSA-N 1 2 324.515 4.713 20 0 DJADLO CCO[C@@H](C)c1nc(C[N@@H+](Cc2cccs2)C(C)C)cs1 ZINC000336839377 520267461 /nfs/dbraw/zinc/26/74/61/520267461.db2.gz SUEITERTJYPKPK-ZDUSSCGKSA-N 1 2 324.515 4.713 20 0 DJADLO CCC[C@H]([NH2+]Cc1nc([C@@H](C)SCC)no1)c1ccccc1 ZINC000181762901 521166613 /nfs/dbraw/zinc/16/66/13/521166613.db2.gz CXFDTFHHCFCIHI-HIFRSBDPSA-N 1 2 319.474 4.515 20 0 DJADLO CC[N@H+](Cc1csc([C@H](C)OC)n1)Cc1ccc(Cl)cc1 ZINC000267056410 521444955 /nfs/dbraw/zinc/44/49/55/521444955.db2.gz SCWHFMNUKKKBQD-LBPRGKRZSA-N 1 2 324.877 4.526 20 0 DJADLO CC[N@@H+](Cc1csc([C@H](C)OC)n1)Cc1ccc(Cl)cc1 ZINC000267056410 521444958 /nfs/dbraw/zinc/44/49/58/521444958.db2.gz SCWHFMNUKKKBQD-LBPRGKRZSA-N 1 2 324.877 4.526 20 0 DJADLO CC[N@H+](Cc1nnc(C(C)C)o1)[C@H](C)c1cc2ccccc2o1 ZINC000171145785 521465489 /nfs/dbraw/zinc/46/54/89/521465489.db2.gz FISVVMBFQWFXAY-CYBMUJFWSA-N 1 2 313.401 4.522 20 0 DJADLO CC[N@@H+](Cc1nnc(C(C)C)o1)[C@H](C)c1cc2ccccc2o1 ZINC000171145785 521465490 /nfs/dbraw/zinc/46/54/90/521465490.db2.gz FISVVMBFQWFXAY-CYBMUJFWSA-N 1 2 313.401 4.522 20 0 DJADLO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2csc(Cl)c2)cs1 ZINC000191280728 522422321 /nfs/dbraw/zinc/42/23/21/522422321.db2.gz XRXYOYBPMZFSCU-DTWKUNHWSA-N 1 2 300.880 4.832 20 0 DJADLO CCc1nc([C@@H](C)[NH2+][C@H]2CCSc3ccc(F)cc32)cs1 ZINC000162270474 522426236 /nfs/dbraw/zinc/42/62/36/522426236.db2.gz CYRSFHCZCSJWEU-MFKMUULPSA-N 1 2 322.474 4.732 20 0 DJADLO CO[C@H](C)c1nc(C[N@H+]([C@H](C)c2ccccc2)C2CC2)cs1 ZINC000267007543 523912206 /nfs/dbraw/zinc/91/22/06/523912206.db2.gz KONNLAKKGRZJAA-ZIAGYGMSSA-N 1 2 316.470 4.576 20 0 DJADLO CO[C@H](C)c1nc(C[N@@H+]([C@H](C)c2ccccc2)C2CC2)cs1 ZINC000267007543 523912209 /nfs/dbraw/zinc/91/22/09/523912209.db2.gz KONNLAKKGRZJAA-ZIAGYGMSSA-N 1 2 316.470 4.576 20 0 DJADLO COc1ccccc1-c1ccc([C@H](C)[N@H+](C)Cc2ccon2)cc1 ZINC000265979092 524272393 /nfs/dbraw/zinc/27/23/93/524272393.db2.gz AYFCZXCQRNDVMY-HNNXBMFYSA-N 1 2 322.408 4.543 20 0 DJADLO COc1ccccc1-c1ccc([C@H](C)[N@@H+](C)Cc2ccon2)cc1 ZINC000265979092 524272395 /nfs/dbraw/zinc/27/23/95/524272395.db2.gz AYFCZXCQRNDVMY-HNNXBMFYSA-N 1 2 322.408 4.543 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1F)c1ncc(C(C)(C)C)o1 ZINC000177411704 525530397 /nfs/dbraw/zinc/53/03/97/525530397.db2.gz VQWOLWQNGCHBJA-QWRGUYRKSA-N 1 2 308.372 4.662 20 0 DJADLO C[C@H](Nc1cccc([NH+]2CCCCCC2)c1)c1nccs1 ZINC000179959051 525670558 /nfs/dbraw/zinc/67/05/58/525670558.db2.gz ZBGQCJNXUJKJIA-AWEZNQCLSA-N 1 2 301.459 4.697 20 0 DJADLO Cc1ccc([C@@H]([NH2+]Cc2cc(F)ccc2F)c2ccccn2)cc1 ZINC000366341054 525774715 /nfs/dbraw/zinc/77/47/15/525774715.db2.gz RLCGGUHOZZMLHU-HXUWFJFHSA-N 1 2 324.374 4.547 20 0 DJADLO Cc1ccc([C@@H]([NH2+][C@@H](C)c2ccccc2F)c2ccccn2)cc1 ZINC000366425610 525775387 /nfs/dbraw/zinc/77/53/87/525775387.db2.gz CPYILRJLHROOAK-HRAATJIYSA-N 1 2 320.411 4.969 20 0 DJADLO c1csc(C[N@H+](Cc2csc(-c3ccoc3)n2)C2CC2)c1 ZINC000108358090 526579671 /nfs/dbraw/zinc/57/96/71/526579671.db2.gz KTHISWIIOAETAR-UHFFFAOYSA-N 1 2 316.451 4.629 20 0 DJADLO c1csc(C[N@@H+](Cc2csc(-c3ccoc3)n2)C2CC2)c1 ZINC000108358090 526579675 /nfs/dbraw/zinc/57/96/75/526579675.db2.gz KTHISWIIOAETAR-UHFFFAOYSA-N 1 2 316.451 4.629 20 0 DJADLO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2csc(C(C)(C)C)n2)s1 ZINC000106875403 526742127 /nfs/dbraw/zinc/74/21/27/526742127.db2.gz GYTTZBXWYPPPOU-LLVKDONJSA-N 1 2 323.531 4.707 20 0 DJADLO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2csc(C(C)(C)C)n2)s1 ZINC000106875403 526742131 /nfs/dbraw/zinc/74/21/31/526742131.db2.gz GYTTZBXWYPPPOU-LLVKDONJSA-N 1 2 323.531 4.707 20 0 DJADLO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2csc(C(C)C)n2)s1 ZINC000106877174 526742545 /nfs/dbraw/zinc/74/25/45/526742545.db2.gz JJZMHFQDOOXEQR-LLVKDONJSA-N 1 2 309.504 4.533 20 0 DJADLO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2csc(C(C)C)n2)s1 ZINC000106877174 526742549 /nfs/dbraw/zinc/74/25/49/526742549.db2.gz JJZMHFQDOOXEQR-LLVKDONJSA-N 1 2 309.504 4.533 20 0 DJADLO Cc1nc(C2([NH2+][C@H](C)c3ccc(Cl)cc3)CCCCC2)no1 ZINC000264898308 526770161 /nfs/dbraw/zinc/77/01/61/526770161.db2.gz VJCINCHFWOIBGT-GFCCVEGCSA-N 1 2 319.836 4.542 20 0 DJADLO CC(C)c1nc([C@@H](C)[NH2+][C@@H]2CCOc3ccc(F)cc32)cs1 ZINC000090048809 185279828 /nfs/dbraw/zinc/27/98/28/185279828.db2.gz CGLVFQVJRCRZAY-BXUZGUMPSA-N 1 2 320.433 4.580 20 0 DJADLO COc1ccccc1[C@H]([NH2+][C@@H](C)c1ccc(C)o1)c1ccco1 ZINC000090534410 185301345 /nfs/dbraw/zinc/30/13/45/185301345.db2.gz RNRMVDCFHMIVDQ-LIRRHRJNSA-N 1 2 311.381 4.630 20 0 DJADLO COc1ccccc1[C@@H]([NH2+][C@H](C)c1ccc(C)o1)c1ccco1 ZINC000090534412 185301460 /nfs/dbraw/zinc/30/14/60/185301460.db2.gz RNRMVDCFHMIVDQ-AUUYWEPGSA-N 1 2 311.381 4.630 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1Cl)c1nccs1 ZINC000080266454 192019677 /nfs/dbraw/zinc/01/96/77/192019677.db2.gz QHFULOKPYVRMLD-DTWKUNHWSA-N 1 2 301.242 4.862 20 0 DJADLO CC(=O)Nc1ccc(Nc2cc[nH+]c3cc(Cl)ccc23)cc1 ZINC000018901406 182103032 /nfs/dbraw/zinc/10/30/32/182103032.db2.gz BZUYNVDQPFBPAA-UHFFFAOYSA-N 1 2 311.772 4.590 20 0 DJADLO Cc1sc2ncnc(Nc3ccc([NH+]4CCCC4)cc3)c2c1C ZINC000019975052 182172289 /nfs/dbraw/zinc/17/22/89/182172289.db2.gz LYZGGGMNQQQADC-UHFFFAOYSA-N 1 2 324.453 4.652 20 0 DJADLO Cc1ccc(N[C@@H](Cc2cccnc2)c2cccc(Cl)c2)c[nH+]1 ZINC000426039803 335043657 /nfs/dbraw/zinc/04/36/57/335043657.db2.gz PUAQPGOGANHMCY-IBGZPJMESA-N 1 2 323.827 4.834 20 0 DJADLO COc1ccccc1C[N@H+](Cc1ccccc1Cl)C1CC1 ZINC000059389928 184138147 /nfs/dbraw/zinc/13/81/47/184138147.db2.gz ZXLRBUKGGCHBNT-UHFFFAOYSA-N 1 2 301.817 4.513 20 0 DJADLO COc1ccccc1C[N@@H+](Cc1ccccc1Cl)C1CC1 ZINC000059389928 184138148 /nfs/dbraw/zinc/13/81/48/184138148.db2.gz ZXLRBUKGGCHBNT-UHFFFAOYSA-N 1 2 301.817 4.513 20 0 DJADLO Cc1ccc(NC(=O)N(C)[C@@H](C)c2ccccc2Cl)c(C)[nH+]1 ZINC000152408740 335057650 /nfs/dbraw/zinc/05/76/50/335057650.db2.gz CAVUSJYWKWBKHW-ZDUSSCGKSA-N 1 2 317.820 4.577 20 0 DJADLO C[C@H]([NH2+]C1(c2c(Cl)cccc2Cl)CC1)c1ccncc1 ZINC000272172916 130004614 /nfs/dbraw/zinc/00/46/14/130004614.db2.gz DLHAOHCCWBABSA-NSHDSACASA-N 1 2 307.224 4.728 20 0 DJADLO C[C@@H]([NH2+]C1(c2c(Cl)cccc2Cl)CC1)c1ccncc1 ZINC000272172912 130004620 /nfs/dbraw/zinc/00/46/20/130004620.db2.gz DLHAOHCCWBABSA-LLVKDONJSA-N 1 2 307.224 4.728 20 0 DJADLO C[C@H]([NH2+]C1(c2c(Cl)cccc2Cl)CC1)c1ccccn1 ZINC000272206814 130007346 /nfs/dbraw/zinc/00/73/46/130007346.db2.gz JZFRBORDLKROND-NSHDSACASA-N 1 2 307.224 4.728 20 0 DJADLO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)c(C)o1 ZINC000274544207 130243664 /nfs/dbraw/zinc/24/36/64/130243664.db2.gz CGNUYPOCEVOABP-BDAKNGLRSA-N 1 2 318.364 4.784 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1ccccc1F)c1nc(C(F)(F)F)cs1 ZINC000274586948 130247741 /nfs/dbraw/zinc/24/77/41/130247741.db2.gz JKOUZBKTOXGMNA-RKDXNWHRSA-N 1 2 318.339 4.713 20 0 DJADLO C[C@H]([NH2+]Cc1ccccc1Cl)c1nc(C(F)(F)F)cs1 ZINC000274611406 130248630 /nfs/dbraw/zinc/24/86/30/130248630.db2.gz NNSBUDGLUVBHSF-QMMMGPOBSA-N 1 2 320.767 4.666 20 0 DJADLO Cc1nccnc1[C@@H](C)[NH2+][C@H](C)c1cc(Cl)ccc1Cl ZINC000275669908 130358603 /nfs/dbraw/zinc/35/86/03/130358603.db2.gz HCJVAQPBTGYJTL-MWLCHTKSSA-N 1 2 310.228 4.504 20 0 DJADLO C[C@@H]([NH2+]C1(c2c(Cl)cccc2Cl)CCC1)c1cnccn1 ZINC000278527577 130698292 /nfs/dbraw/zinc/69/82/92/130698292.db2.gz SZRBRYRGUXBKLN-LLVKDONJSA-N 1 2 322.239 4.513 20 0 DJADLO C[C@H]([NH2+][C@H](c1ccccc1)C1CC1)c1noc(-c2ccccc2)n1 ZINC000283959795 131036049 /nfs/dbraw/zinc/03/60/49/131036049.db2.gz DWKWKIZVSBWPBV-KBXCAEBGSA-N 1 2 319.408 4.539 20 0 DJADLO Cc1cc([C@H](C)[NH2+]C2(c3ccc(Cl)c(Cl)c3)CC2)no1 ZINC000285310358 131156942 /nfs/dbraw/zinc/15/69/42/131156942.db2.gz SMZIQVQHAMEEHQ-JTQLQIEISA-N 1 2 311.212 4.630 20 0 DJADLO Cc1c2ccccc2oc1[C@H](C)[NH2+][C@@H](C)c1c(F)cncc1F ZINC000285698663 131194280 /nfs/dbraw/zinc/19/42/80/131194280.db2.gz OSYYCIZQKIAGMO-RYUDHWBXSA-N 1 2 316.351 4.826 20 0 DJADLO Cc1ccnc([C@@H](C)[NH2+][C@H](C)c2nc(-c3ccccc3)cs2)c1 ZINC000286279429 131228271 /nfs/dbraw/zinc/22/82/71/131228271.db2.gz VQTQZLDLWNKOJD-HUUCEWRRSA-N 1 2 323.465 4.925 20 0 DJADLO Cc1cccc([C@@H]2CCCN2C(=O)Nc2c(C)cc[nH+]c2C)c1C ZINC000287492832 131283499 /nfs/dbraw/zinc/28/34/99/131283499.db2.gz KZLDPGJIADSCOF-SFHVURJKSA-N 1 2 323.440 4.684 20 0 DJADLO CN(Cc1nc2ccccc2s1)c1[nH+]ccc2ccc(F)cc21 ZINC000340261381 131298991 /nfs/dbraw/zinc/29/89/91/131298991.db2.gz UILQHAFFAMRNLC-UHFFFAOYSA-N 1 2 323.396 4.620 20 0 DJADLO Cc1nc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)c3ccccc32)no1 ZINC000289307874 131372571 /nfs/dbraw/zinc/37/25/71/131372571.db2.gz CIVFVPYBPFUNRQ-QWRGUYRKSA-N 1 2 315.804 4.596 20 0 DJADLO Clc1cccc(Cl)c1[C@H]([NH2+]Cc1nccs1)C1CC1 ZINC000289363902 131378803 /nfs/dbraw/zinc/37/88/03/131378803.db2.gz ADCCKQYMTDHDMO-CQSZACIVSA-N 1 2 313.253 4.691 20 0 DJADLO CC(C)Oc1cccc([C@H](C)[NH2+]Cc2cc(C(C)(C)C)on2)c1 ZINC000289412283 131384731 /nfs/dbraw/zinc/38/47/31/131384731.db2.gz VAQKUUPJQIVYTM-AWEZNQCLSA-N 1 2 316.445 4.610 20 0 DJADLO Cc1cc([C@@H](C)[NH2+][C@@H](CC(F)(F)F)c2ccccc2C)no1 ZINC000340495709 131888443 /nfs/dbraw/zinc/88/84/43/131888443.db2.gz CJHSUPCFPROVSK-DOMZBBRYSA-N 1 2 312.335 4.636 20 0 DJADLO C[C@@H]([NH2+][C@@H]1C[C@H](C)n2ccnc21)c1ccc(Cl)cc1Cl ZINC000296327227 131956510 /nfs/dbraw/zinc/95/65/10/131956510.db2.gz GCEYPPMDNIXIQE-IMSIIYSGSA-N 1 2 310.228 4.547 20 0 DJADLO CCn1ccnc1[C@H](C)[NH2+][C@@H](c1ccc(F)cc1F)C(C)(C)C ZINC000297588784 132024227 /nfs/dbraw/zinc/02/42/27/132024227.db2.gz HMVIIJOUDGJXCB-LRDDRELGSA-N 1 2 321.415 4.619 20 0 DJADLO CCn1ccnc1[C@H](C)[NH2+][C@H](c1ccc(F)cc1F)C(C)(C)C ZINC000297588779 132024461 /nfs/dbraw/zinc/02/44/61/132024461.db2.gz HMVIIJOUDGJXCB-BLLLJJGKSA-N 1 2 321.415 4.619 20 0 DJADLO Cc1[nH+]c(C(C)C)ccc1CNc1ccc([C@H]2CCOC2)cc1 ZINC000297603728 132025012 /nfs/dbraw/zinc/02/50/12/132025012.db2.gz ICUTUHMNIPXWEQ-SFHVURJKSA-N 1 2 310.441 4.629 20 0 DJADLO C[C@@H]1C[C@H]([NH2+][C@@H](c2ccc(F)cc2F)C(C)(C)C)c2nccn21 ZINC000297948335 132041734 /nfs/dbraw/zinc/04/17/34/132041734.db2.gz YMQPRCVHGUQJJK-RLCCDNCMSA-N 1 2 319.399 4.544 20 0 DJADLO C[C@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1cc(F)ccc1F ZINC000324827673 132133175 /nfs/dbraw/zinc/13/31/75/132133175.db2.gz HJVISYRUAXTEHI-XOBRGWDASA-N 1 2 324.374 4.800 20 0 DJADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2csc(C)n2)o1 ZINC000340691966 132158538 /nfs/dbraw/zinc/15/85/38/132158538.db2.gz URWWIGKVQHJYHQ-BLLLJJGKSA-N 1 2 304.459 4.580 20 0 DJADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2csc(C)n2)o1 ZINC000340691966 132158540 /nfs/dbraw/zinc/15/85/40/132158540.db2.gz URWWIGKVQHJYHQ-BLLLJJGKSA-N 1 2 304.459 4.580 20 0 DJADLO COc1cccc(F)c1[C@@H](C)[NH2+][C@H](C)c1ccc(F)cc1F ZINC000174231344 332849727 /nfs/dbraw/zinc/84/97/27/332849727.db2.gz XWPZCKXIEUIMPJ-GHMZBOCLSA-N 1 2 309.331 4.524 20 0 DJADLO CC(C)n1cc([C@H](C)Nc2cc[nH+]c3c(Cl)cccc23)cn1 ZINC000557568249 331800143 /nfs/dbraw/zinc/80/01/43/331800143.db2.gz DFKBZXOZDIQGNJ-LBPRGKRZSA-N 1 2 314.820 4.839 20 0 DJADLO CC(C)n1cc([C@@H](C)Nc2cc[nH+]c3c(Cl)cccc23)cn1 ZINC000557568248 331800177 /nfs/dbraw/zinc/80/01/77/331800177.db2.gz DFKBZXOZDIQGNJ-GFCCVEGCSA-N 1 2 314.820 4.839 20 0 DJADLO C[C@@H](c1ccco1)[N@H+](Cc1ncc(-c2ccccc2)o1)C1CC1 ZINC000086233371 332019413 /nfs/dbraw/zinc/01/94/13/332019413.db2.gz YTZCBEWFSJSEME-AWEZNQCLSA-N 1 2 308.381 4.660 20 0 DJADLO C[C@@H](c1ccco1)[N@@H+](Cc1ncc(-c2ccccc2)o1)C1CC1 ZINC000086233371 332019414 /nfs/dbraw/zinc/01/94/14/332019414.db2.gz YTZCBEWFSJSEME-AWEZNQCLSA-N 1 2 308.381 4.660 20 0 DJADLO Cc1nc(C[N@@H+]2CCc3ccccc3[C@@H]2c2ccccc2)cs1 ZINC000559368376 332134200 /nfs/dbraw/zinc/13/42/00/332134200.db2.gz GOLQTJXCZXRHDK-FQEVSTJZSA-N 1 2 320.461 4.599 20 0 DJADLO Cc1nc(C[N@H+]2CCc3ccccc3[C@@H]2c2ccccc2)cs1 ZINC000559368376 332134201 /nfs/dbraw/zinc/13/42/01/332134201.db2.gz GOLQTJXCZXRHDK-FQEVSTJZSA-N 1 2 320.461 4.599 20 0 DJADLO Fc1ccc(F)c(SCc2c[nH+]cn2Cc2ccccc2)c1 ZINC000445597017 332147345 /nfs/dbraw/zinc/14/73/45/332147345.db2.gz MNGZNNSPMOVWSN-UHFFFAOYSA-N 1 2 316.376 4.502 20 0 DJADLO C[C@H]1C[C@@H](C(F)(F)F)CC[N@@H+]1Cc1csc(C(C)(C)C)n1 ZINC000449463308 332234700 /nfs/dbraw/zinc/23/47/00/332234700.db2.gz VVUDJWOHDLMTII-QWRGUYRKSA-N 1 2 320.424 4.603 20 0 DJADLO C[C@H]1C[C@@H](C(F)(F)F)CC[N@H+]1Cc1csc(C(C)(C)C)n1 ZINC000449463308 332234701 /nfs/dbraw/zinc/23/47/01/332234701.db2.gz VVUDJWOHDLMTII-QWRGUYRKSA-N 1 2 320.424 4.603 20 0 DJADLO CSc1cccc(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)c1 ZINC000560542754 332355681 /nfs/dbraw/zinc/35/56/81/332355681.db2.gz GUGLVTQDKVSDOC-MRXNPFEDSA-N 1 2 301.459 4.865 20 0 DJADLO FC(F)Oc1cccc(N[C@H](c2[nH]cc[nH+]2)C2CCCCC2)c1 ZINC000560543407 332355982 /nfs/dbraw/zinc/35/59/82/332355982.db2.gz KFIIMFNPVYINJD-HNNXBMFYSA-N 1 2 321.371 4.745 20 0 DJADLO Cn1ccc2ccc(N[C@H](c3[nH]cc[nH+]3)C3CCCCC3)cc21 ZINC000560549042 332357295 /nfs/dbraw/zinc/35/72/95/332357295.db2.gz MGBHZQKKPCNXLD-SFHVURJKSA-N 1 2 308.429 4.635 20 0 DJADLO Cc1[nH]ncc1C[NH2+][C@@H](C)c1ccc(SC2CCCC2)cc1 ZINC000560904937 332393734 /nfs/dbraw/zinc/39/37/34/332393734.db2.gz XVVUEBNIEZRFRY-ZDUSSCGKSA-N 1 2 315.486 4.604 20 0 DJADLO CC(C)Oc1ccccc1[C@@H](C)[NH2+]Cc1c(F)cccc1F ZINC000387570457 332396265 /nfs/dbraw/zinc/39/62/65/332396265.db2.gz WRCGXBKYZCBEFB-CYBMUJFWSA-N 1 2 305.368 4.603 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000425583504 335106733 /nfs/dbraw/zinc/10/67/33/335106733.db2.gz ATCYNVUGPIMREE-SNVBAGLBSA-N 1 2 323.223 4.747 20 0 DJADLO CN(C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1)c1ccccc1 ZINC000562477682 332597308 /nfs/dbraw/zinc/59/73/08/332597308.db2.gz NIYTVHZQRXSLDV-UHFFFAOYSA-N 1 2 319.364 4.542 20 0 DJADLO CSc1ccc(CNc2c[nH+]ccc2OC(C)(C)C)s1 ZINC000570049143 332705728 /nfs/dbraw/zinc/70/57/28/332705728.db2.gz CMEWUINMTXLZOM-UHFFFAOYSA-N 1 2 308.472 4.654 20 0 DJADLO C[C@@H]([NH2+]CC(C)(F)F)c1cc2cc(Br)ccc2o1 ZINC000570231088 332728232 /nfs/dbraw/zinc/72/82/32/332728232.db2.gz VZQFHYSIFYPNIX-MRVPVSSYSA-N 1 2 318.161 4.501 20 0 DJADLO Cc1nc([C@@H](C)[N@@H+]2CCC[C@H]2CF)oc1-c1ccc(Cl)cc1 ZINC000580219564 333020044 /nfs/dbraw/zinc/02/00/44/333020044.db2.gz RBYNPJNVJOKXER-DOMZBBRYSA-N 1 2 322.811 4.798 20 0 DJADLO Cc1nc([C@@H](C)[N@H+]2CCC[C@H]2CF)oc1-c1ccc(Cl)cc1 ZINC000580219564 333020046 /nfs/dbraw/zinc/02/00/46/333020046.db2.gz RBYNPJNVJOKXER-DOMZBBRYSA-N 1 2 322.811 4.798 20 0 DJADLO CC(C)c1cnc(CNc2[nH+]cccc2-c2ccccc2)s1 ZINC000466634095 333038563 /nfs/dbraw/zinc/03/85/63/333038563.db2.gz IWFBNXDLSXUEOC-UHFFFAOYSA-N 1 2 309.438 4.941 20 0 DJADLO CCc1noc(C)c1C[N@H+]([C@@H](C)c1ccccc1Cl)C1CC1 ZINC000466822660 333088843 /nfs/dbraw/zinc/08/88/43/333088843.db2.gz CRUREBPUONJLGT-LBPRGKRZSA-N 1 2 318.848 4.924 20 0 DJADLO CCc1noc(C)c1C[N@@H+]([C@@H](C)c1ccccc1Cl)C1CC1 ZINC000466822660 333088844 /nfs/dbraw/zinc/08/88/44/333088844.db2.gz CRUREBPUONJLGT-LBPRGKRZSA-N 1 2 318.848 4.924 20 0 DJADLO CC(C)n1ccc(C[NH2+][C@H](C)c2cccc(Cl)c2Cl)n1 ZINC000178509122 333139979 /nfs/dbraw/zinc/13/99/79/333139979.db2.gz PQNFWUUSSZZDCS-LLVKDONJSA-N 1 2 312.244 4.622 20 0 DJADLO Cc1cccc([C@H](C)[NH2+][C@H](C)c2nc(C3CCCCC3)no2)c1 ZINC000185266493 335124504 /nfs/dbraw/zinc/12/45/04/335124504.db2.gz BKHKYUBGSIXKDV-LSDHHAIUSA-N 1 2 313.445 4.838 20 0 DJADLO CCCCc1noc([C@H](C)[NH2+][C@@H](CC)c2ccc(C)cc2)n1 ZINC000181694744 333171464 /nfs/dbraw/zinc/17/14/64/333171464.db2.gz WMHXGECXZASTDO-HOCLYGCPSA-N 1 2 301.434 4.523 20 0 DJADLO C[C@H]1C[C@H](Nc2cccc(Oc3ccccc3)c2)c2[nH+]ccn21 ZINC000379073685 333182006 /nfs/dbraw/zinc/18/20/06/333182006.db2.gz BUTBAZUSXAVFDF-KSSFIOAISA-N 1 2 305.381 4.793 20 0 DJADLO Cc1cc(N2CCC[C@H]2c2ccc(Cl)cc2)nc(C2CC2)[nH+]1 ZINC000582084356 333205511 /nfs/dbraw/zinc/20/55/11/333205511.db2.gz OPIASLXCDUXZQJ-INIZCTEOSA-N 1 2 313.832 4.657 20 0 DJADLO C[C@@H](c1cccc(Cl)c1)[N@@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000497590742 333266612 /nfs/dbraw/zinc/26/66/12/333266612.db2.gz MXZGLSWHQLJSLM-SCLBCKFNSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@@H](c1cccc(Cl)c1)[N@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000497590742 333266614 /nfs/dbraw/zinc/26/66/14/333266614.db2.gz MXZGLSWHQLJSLM-SCLBCKFNSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@@H](c1ccc(Cl)cc1)[N@@H+]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000497590738 333266617 /nfs/dbraw/zinc/26/66/17/333266617.db2.gz MVCGJMCUVSLJQW-UGSOOPFHSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@@H](c1ccc(Cl)cc1)[N@H+]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000497590738 333266619 /nfs/dbraw/zinc/26/66/19/333266619.db2.gz MVCGJMCUVSLJQW-UGSOOPFHSA-N 1 2 319.807 4.614 20 0 DJADLO Cc1nc([C@@H](C)[N@@H+]2CC[C@@](C)(F)C2)oc1-c1ccc(Cl)cc1 ZINC000501422761 333273599 /nfs/dbraw/zinc/27/35/99/333273599.db2.gz NJCACWOSCGRVDD-SJKOYZFVSA-N 1 2 322.811 4.798 20 0 DJADLO Cc1nc([C@@H](C)[N@H+]2CC[C@@](C)(F)C2)oc1-c1ccc(Cl)cc1 ZINC000501422761 333273601 /nfs/dbraw/zinc/27/36/01/333273601.db2.gz NJCACWOSCGRVDD-SJKOYZFVSA-N 1 2 322.811 4.798 20 0 DJADLO COc1ccccc1[C@H](C)[NH2+][C@H](c1ccco1)c1ccccc1 ZINC000120217177 333276240 /nfs/dbraw/zinc/27/62/40/333276240.db2.gz YMOUWFSKHHDDNF-YWZLYKJASA-N 1 2 307.393 4.728 20 0 DJADLO CCn1ccnc1C[N@H+](C)[C@H](C)c1ccc(-c2ccccc2)cc1 ZINC000525779144 333299852 /nfs/dbraw/zinc/29/98/52/333299852.db2.gz CGQHXPDUTDRLOX-QGZVFWFLSA-N 1 2 319.452 4.763 20 0 DJADLO CCn1ccnc1C[N@@H+](C)[C@H](C)c1ccc(-c2ccccc2)cc1 ZINC000525779144 333299854 /nfs/dbraw/zinc/29/98/54/333299854.db2.gz CGQHXPDUTDRLOX-QGZVFWFLSA-N 1 2 319.452 4.763 20 0 DJADLO Cc1nc(C[N@@H+](C)[C@@H](C)c2ccc(Cl)c(Cl)c2)cs1 ZINC000525782237 333307029 /nfs/dbraw/zinc/30/70/29/333307029.db2.gz UMESKQHKGLJUSC-VIFPVBQESA-N 1 2 315.269 4.951 20 0 DJADLO Cc1nc(C[N@H+](C)[C@@H](C)c2ccc(Cl)c(Cl)c2)cs1 ZINC000525782237 333307031 /nfs/dbraw/zinc/30/70/31/333307031.db2.gz UMESKQHKGLJUSC-VIFPVBQESA-N 1 2 315.269 4.951 20 0 DJADLO CCC[C@H](Nc1cc(C)[nH+]cn1)c1cccc(C(F)(F)F)c1 ZINC000498901034 333311380 /nfs/dbraw/zinc/31/13/80/333311380.db2.gz LIVQFZKLHHAKLO-AWEZNQCLSA-N 1 2 309.335 4.757 20 0 DJADLO CCc1nc(C[N@@H+]2CCCC[C@@H]2c2ccc(F)cc2)cs1 ZINC000531449117 333354385 /nfs/dbraw/zinc/35/43/85/333354385.db2.gz YHTFWGGKPKPPNZ-MRXNPFEDSA-N 1 2 304.434 4.572 20 0 DJADLO CCc1nc(C[N@H+]2CCCC[C@@H]2c2ccc(F)cc2)cs1 ZINC000531449117 333354386 /nfs/dbraw/zinc/35/43/86/333354386.db2.gz YHTFWGGKPKPPNZ-MRXNPFEDSA-N 1 2 304.434 4.572 20 0 DJADLO CCOc1ccc(C(C)=O)cc1C[N@H+](C)[C@@H](C)c1cccs1 ZINC000185400594 333369874 /nfs/dbraw/zinc/36/98/74/333369874.db2.gz NSIAEPMPKGUOSF-ZDUSSCGKSA-N 1 2 317.454 4.542 20 0 DJADLO CCOc1ccc(C(C)=O)cc1C[N@@H+](C)[C@@H](C)c1cccs1 ZINC000185400594 333369875 /nfs/dbraw/zinc/36/98/75/333369875.db2.gz NSIAEPMPKGUOSF-ZDUSSCGKSA-N 1 2 317.454 4.542 20 0 DJADLO CC(C)c1nnc(C[NH2+]Cc2ccc(-c3ccccc3)cc2)s1 ZINC000531564674 333537163 /nfs/dbraw/zinc/53/71/63/333537163.db2.gz JTYYZHHJNQLVSL-UHFFFAOYSA-N 1 2 323.465 4.618 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1cc2n(n1)CCC2)c1ccc(Cl)cc1Cl ZINC000414059527 333888893 /nfs/dbraw/zinc/88/88/93/333888893.db2.gz WLCHRGXLAKOOKH-MNOVXSKESA-N 1 2 324.255 4.548 20 0 DJADLO CC[C@H]([NH2+][C@@H](C)c1nc(C(C)C)no1)c1ccc(Cl)s1 ZINC000273466560 334047598 /nfs/dbraw/zinc/04/75/98/334047598.db2.gz DVLAAOLRNGHMBE-UWVGGRQHSA-N 1 2 313.854 4.710 20 0 DJADLO Cc1nn(C(C)C)cc1C[N@H+](Cc1ccco1)Cc1ccccc1 ZINC000343554796 335171914 /nfs/dbraw/zinc/17/19/14/335171914.db2.gz RNKNDIMIMYIRSD-UHFFFAOYSA-N 1 2 323.440 4.568 20 0 DJADLO Cc1nn(C(C)C)cc1C[N@@H+](Cc1ccco1)Cc1ccccc1 ZINC000343554796 335171915 /nfs/dbraw/zinc/17/19/15/335171915.db2.gz RNKNDIMIMYIRSD-UHFFFAOYSA-N 1 2 323.440 4.568 20 0 DJADLO C[C@@H](c1nc2ccccc2n1C(F)F)[N@H+](C)Cc1cccs1 ZINC000298078122 334246177 /nfs/dbraw/zinc/24/61/77/334246177.db2.gz LGIOIYQKDPZGHF-NSHDSACASA-N 1 2 321.396 4.686 20 0 DJADLO C[C@@H](c1nc2ccccc2n1C(F)F)[N@@H+](C)Cc1cccs1 ZINC000298078122 334246178 /nfs/dbraw/zinc/24/61/78/334246178.db2.gz LGIOIYQKDPZGHF-NSHDSACASA-N 1 2 321.396 4.686 20 0 DJADLO CC(C)c1nc([C@@H](C)[NH2+]Cc2ccc(Cl)cc2F)cs1 ZINC000187579437 334265480 /nfs/dbraw/zinc/26/54/80/334265480.db2.gz GXHIFWZWEPHLNU-SNVBAGLBSA-N 1 2 312.841 4.910 20 0 DJADLO C[C@H](c1nc2ccccc2s1)[N@H+](C)Cc1ccccc1F ZINC000302608081 334287486 /nfs/dbraw/zinc/28/74/86/334287486.db2.gz XFLXOZWYWPOKHX-GFCCVEGCSA-N 1 2 300.402 4.628 20 0 DJADLO C[C@H](c1nc2ccccc2s1)[N@@H+](C)Cc1ccccc1F ZINC000302608081 334287487 /nfs/dbraw/zinc/28/74/87/334287487.db2.gz XFLXOZWYWPOKHX-GFCCVEGCSA-N 1 2 300.402 4.628 20 0 DJADLO C[C@H]([NH2+]Cc1cn2ccsc2n1)c1ccc(-c2ccccc2)o1 ZINC000531949244 334303609 /nfs/dbraw/zinc/30/36/09/334303609.db2.gz OYOLCLNKVGVGSU-ZDUSSCGKSA-N 1 2 323.421 4.507 20 0 DJADLO CC[C@H]1c2ccsc2CC[N@H+]1Cc1nc(C)c2ccccc2n1 ZINC000303336946 334312370 /nfs/dbraw/zinc/31/23/70/334312370.db2.gz XPMIFSANFVNECB-KRWDZBQOSA-N 1 2 323.465 4.509 20 0 DJADLO CC[C@H]1c2ccsc2CC[N@@H+]1Cc1nc(C)c2ccccc2n1 ZINC000303336946 334312371 /nfs/dbraw/zinc/31/23/71/334312371.db2.gz XPMIFSANFVNECB-KRWDZBQOSA-N 1 2 323.465 4.509 20 0 DJADLO CCc1cc(C[NH2+][C@H](C)c2cc(F)c(Cl)cc2Cl)on1 ZINC000531976645 334347092 /nfs/dbraw/zinc/34/70/92/334347092.db2.gz FAAHNGHVBAKQHD-MRVPVSSYSA-N 1 2 317.191 4.534 20 0 DJADLO CCc1cc(C[NH2+][C@@H](C)c2cc(F)c(Cl)cc2Cl)on1 ZINC000531976646 334347272 /nfs/dbraw/zinc/34/72/72/334347272.db2.gz FAAHNGHVBAKQHD-QMMMGPOBSA-N 1 2 317.191 4.534 20 0 DJADLO CC(C)[N@H+](Cc1nc(-c2ccccc2)cs1)Cc1ccccn1 ZINC000535082719 334366460 /nfs/dbraw/zinc/36/64/60/334366460.db2.gz GWEVOPIAAIUIHV-UHFFFAOYSA-N 1 2 323.465 4.616 20 0 DJADLO CC(C)[N@@H+](Cc1nc(-c2ccccc2)cs1)Cc1ccccn1 ZINC000535082719 334366462 /nfs/dbraw/zinc/36/64/62/334366462.db2.gz GWEVOPIAAIUIHV-UHFFFAOYSA-N 1 2 323.465 4.616 20 0 DJADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)Nc1ccccc1F ZINC000112204361 334371534 /nfs/dbraw/zinc/37/15/34/334371534.db2.gz IFCPMFBVZKLVLM-UHFFFAOYSA-N 1 2 323.327 4.657 20 0 DJADLO Cc1ccsc1CNc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000535244691 334382179 /nfs/dbraw/zinc/38/21/79/334382179.db2.gz AERYPKYIFJAMAJ-UHFFFAOYSA-N 1 2 321.449 4.584 20 0 DJADLO C[C@H](CNc1cc[nH+]c2c(Cl)cccc12)c1nccs1 ZINC000342837524 334586384 /nfs/dbraw/zinc/58/63/84/334586384.db2.gz YBTHJIFYESMQQM-SNVBAGLBSA-N 1 2 303.818 4.560 20 0 DJADLO Cc1cc(C)c(NC(=O)C2CCC(c3ccccc3)CC2)c(C)[nH+]1 ZINC000443842236 338461347 /nfs/dbraw/zinc/46/13/47/338461347.db2.gz POYKOXMCEODZRN-UHFFFAOYSA-N 1 2 322.452 4.919 20 0 DJADLO CC(C)n1c[nH+]cc1CN1CC[C@@H](C(F)(F)F)c2ccccc21 ZINC000425374584 334857059 /nfs/dbraw/zinc/85/70/59/334857059.db2.gz XJPFPHFZZUGVRX-OAHLLOKOSA-N 1 2 323.362 4.520 20 0 DJADLO Cc1csc(C2([NH2+]Cc3cc(F)ccc3Cl)CCCC2)n1 ZINC000189200511 334886129 /nfs/dbraw/zinc/88/61/29/334886129.db2.gz UYVYNDSZIMDMKQ-UHFFFAOYSA-N 1 2 324.852 4.803 20 0 DJADLO C[C@@H]([NH2+]Cc1nc2ccccc2o1)c1cc(Cl)ccc1Cl ZINC000190003351 334920950 /nfs/dbraw/zinc/92/09/50/334920950.db2.gz GGQOUDBDAIKEJV-SNVBAGLBSA-N 1 2 321.207 4.985 20 0 DJADLO COc1cccc2cc([C@H](C)[NH2+][C@@H](C)c3csc(C)n3)oc21 ZINC000344099349 335217984 /nfs/dbraw/zinc/21/79/84/335217984.db2.gz KCMQBJCODPESFH-QWRGUYRKSA-N 1 2 316.426 4.618 20 0 DJADLO CCc1c[nH+]ccc1[C@@H](C)[C@H](Cc1ccccn1)c1cccnc1 ZINC000345843080 335354867 /nfs/dbraw/zinc/35/48/67/335354867.db2.gz TVCKBXGSUMKRSF-IERDGZPVSA-N 1 2 317.436 4.564 20 0 DJADLO CCc1cnc(C[N@H+](C)[C@@H](C)c2sc(C(C)C)nc2C)s1 ZINC000346173882 335377724 /nfs/dbraw/zinc/37/77/24/335377724.db2.gz QATBWYGDCAVMCQ-LBPRGKRZSA-N 1 2 323.531 4.787 20 0 DJADLO CCc1cnc(C[N@@H+](C)[C@@H](C)c2sc(C(C)C)nc2C)s1 ZINC000346173882 335377726 /nfs/dbraw/zinc/37/77/26/335377726.db2.gz QATBWYGDCAVMCQ-LBPRGKRZSA-N 1 2 323.531 4.787 20 0 DJADLO CC(C)c1nc([C@@H](C)[NH2+]Cc2ccc3ccccc3n2)cs1 ZINC000347831695 335531031 /nfs/dbraw/zinc/53/10/31/335531031.db2.gz MNURHOQXEIDKDH-CYBMUJFWSA-N 1 2 311.454 4.666 20 0 DJADLO Cc1csc([C@@H](C)[NH2+]Cc2csc(C3CCCCC3)n2)n1 ZINC000348108390 335554130 /nfs/dbraw/zinc/55/41/30/335554130.db2.gz JMTOXVYQEAGTDX-GFCCVEGCSA-N 1 2 321.515 4.807 20 0 DJADLO Cc1cc2[nH+]cn(CC(=O)c3ccc4ccccc4c3)c2cc1C ZINC000583569638 335734197 /nfs/dbraw/zinc/73/41/97/335734197.db2.gz HMVMBIMTNUKQIN-UHFFFAOYSA-N 1 2 314.388 4.689 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H](CC(C)C)c1ccccc1 ZINC000351944609 336182137 /nfs/dbraw/zinc/18/21/37/336182137.db2.gz VIZFGEWUHHEEIC-KRWDZBQOSA-N 1 2 311.429 4.607 20 0 DJADLO CC(C)c1[nH]ccc1C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000351960394 336183394 /nfs/dbraw/zinc/18/33/94/336183394.db2.gz UGDIAVLHTLODCY-UHFFFAOYSA-N 1 2 321.380 4.578 20 0 DJADLO CCc1nc(C[N@H+](C)[C@@H](C)c2ccc(F)c(Cl)c2)cs1 ZINC000532487995 336251911 /nfs/dbraw/zinc/25/19/11/336251911.db2.gz WDVJRHORAHEYKG-JTQLQIEISA-N 1 2 312.841 4.691 20 0 DJADLO CCc1nc(C[N@@H+](C)[C@@H](C)c2ccc(F)c(Cl)c2)cs1 ZINC000532487995 336251912 /nfs/dbraw/zinc/25/19/12/336251912.db2.gz WDVJRHORAHEYKG-JTQLQIEISA-N 1 2 312.841 4.691 20 0 DJADLO COc1ccccc1[C@H]([NH2+]Cc1ccc(C)c(C)c1)c1ccco1 ZINC000532675619 336266288 /nfs/dbraw/zinc/26/62/88/336266288.db2.gz URRZQNFHCYOOCY-NRFANRHFSA-N 1 2 321.420 4.784 20 0 DJADLO Cc1cc(C[N@@H+]2CCCC[C@H]2c2ccccc2C(F)(F)F)no1 ZINC000532691930 336266812 /nfs/dbraw/zinc/26/68/12/336266812.db2.gz DHGGXUCCFLVFSE-INIZCTEOSA-N 1 2 324.346 4.729 20 0 DJADLO Cc1cc(C[N@H+]2CCCC[C@H]2c2ccccc2C(F)(F)F)no1 ZINC000532691930 336266813 /nfs/dbraw/zinc/26/68/13/336266813.db2.gz DHGGXUCCFLVFSE-INIZCTEOSA-N 1 2 324.346 4.729 20 0 DJADLO CC(C)CCn1cccc1CNc1cccc(-c2[nH+]ccn2C)c1 ZINC000532747990 336269655 /nfs/dbraw/zinc/26/96/55/336269655.db2.gz AMSMDTIRYVGSJH-UHFFFAOYSA-N 1 2 322.456 4.547 20 0 DJADLO C[C@H](c1ncc(-c2ccccc2)o1)[N@H+](C)Cc1cccc(F)c1 ZINC000532760745 336270069 /nfs/dbraw/zinc/27/00/69/336270069.db2.gz NDAJAPBHDGCTBG-CQSZACIVSA-N 1 2 310.372 4.674 20 0 DJADLO C[C@H](c1ncc(-c2ccccc2)o1)[N@@H+](C)Cc1cccc(F)c1 ZINC000532760745 336270070 /nfs/dbraw/zinc/27/00/70/336270070.db2.gz NDAJAPBHDGCTBG-CQSZACIVSA-N 1 2 310.372 4.674 20 0 DJADLO CSc1cccc(N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000192899446 336282453 /nfs/dbraw/zinc/28/24/53/336282453.db2.gz OICQJBACRULHGT-AWEZNQCLSA-N 1 2 309.438 4.767 20 0 DJADLO Cc1cc(N[C@H](C)c2cccc(Cl)c2)nc(-c2cccnc2)[nH+]1 ZINC000301084274 336289139 /nfs/dbraw/zinc/28/91/39/336289139.db2.gz GMUNXKWMRBIOOY-CYBMUJFWSA-N 1 2 324.815 4.674 20 0 DJADLO Cc1cc(N[C@@H](C)c2ccc(Cl)cc2)nc(-c2cccnc2)[nH+]1 ZINC000301114892 336290678 /nfs/dbraw/zinc/29/06/78/336290678.db2.gz PGIWMOKPASXYPR-ZDUSSCGKSA-N 1 2 324.815 4.674 20 0 DJADLO COc1cc(C)c([C@@H](C)Nc2ccc3ccccc3[nH+]2)cc1OC ZINC000301121816 336291098 /nfs/dbraw/zinc/29/10/98/336291098.db2.gz SYSGCTPTYGCKHD-CQSZACIVSA-N 1 2 322.408 4.734 20 0 DJADLO Fc1ccc([C@@H](Nc2cc[nH+]c(C3CC3)n2)c2ccccc2)cc1 ZINC000301254791 336297115 /nfs/dbraw/zinc/29/71/15/336297115.db2.gz QTWSUGHNFZYAOY-IBGZPJMESA-N 1 2 319.383 4.695 20 0 DJADLO Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)Nc1cc(C)[nH+]cn1 ZINC000301277629 336298294 /nfs/dbraw/zinc/29/82/94/336298294.db2.gz SIRRRHJIUPUVQT-ZDUSSCGKSA-N 1 2 324.453 4.698 20 0 DJADLO Cc1cc(N2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)nc[nH+]1 ZINC000301599947 336317447 /nfs/dbraw/zinc/31/74/47/336317447.db2.gz UTMYASLXZIZQTF-HNNXBMFYSA-N 1 2 321.346 4.535 20 0 DJADLO Cc1cc2ccccc2[nH+]c1NCc1coc(-c2cccs2)n1 ZINC000301678474 336322919 /nfs/dbraw/zinc/32/29/19/336322919.db2.gz DLMNVLJFLKKOCM-UHFFFAOYSA-N 1 2 321.405 4.872 20 0 DJADLO Cc1cc2ccccc2[nH+]c1N1CCC(OC2CCCCC2)CC1 ZINC000301709866 336324905 /nfs/dbraw/zinc/32/49/05/336324905.db2.gz HKHJOILFURRISF-UHFFFAOYSA-N 1 2 324.468 4.861 20 0 DJADLO Cc1cc2ccccc2[nH+]c1NC1CCN(c2cccs2)CC1 ZINC000301715865 336325302 /nfs/dbraw/zinc/32/53/02/336325302.db2.gz JZDSRUXTCSKAIV-UHFFFAOYSA-N 1 2 323.465 4.686 20 0 DJADLO Cc1cc2ccccc2[nH+]c1N[C@@H](C)C[C@@H](O)c1cccs1 ZINC000301788623 336329915 /nfs/dbraw/zinc/32/99/15/336329915.db2.gz MGWBYAVBNVUPHR-XJKSGUPXSA-N 1 2 312.438 4.529 20 0 DJADLO CC(C)c1cc(NCc2ncc(C(C)(C)C)o2)nc(C(C)C)[nH+]1 ZINC000301872205 336335385 /nfs/dbraw/zinc/33/53/85/336335385.db2.gz QEKWLEOBLZTRBO-UHFFFAOYSA-N 1 2 316.449 4.621 20 0 DJADLO Cc1cc2ccccc2[nH+]c1N1C[C@H](C)C[C@@H]1c1cccnc1 ZINC000302124393 336349736 /nfs/dbraw/zinc/34/97/36/336349736.db2.gz HSOOLLABSZILCA-AUUYWEPGSA-N 1 2 303.409 4.526 20 0 DJADLO CC(C)c1cc(N2C[C@H](C)C[C@H]2c2cccnc2)nc(C(C)C)[nH+]1 ZINC000302164539 336351856 /nfs/dbraw/zinc/35/18/56/336351856.db2.gz ZLQNSGJYLRZCBO-QAPCUYQASA-N 1 2 324.472 4.706 20 0 DJADLO CCOc1ccc2c(c1)[C@@H](Nc1ccc3ccccc3[nH+]1)CCO2 ZINC000302471806 336359449 /nfs/dbraw/zinc/35/94/49/336359449.db2.gz WOXUJYWRFMUSCG-SFHVURJKSA-N 1 2 320.392 4.569 20 0 DJADLO Cc1nc(CNc2cc(C(C)(C)C)[nH+]c(C(C)C)n2)sc1C ZINC000302886251 336373193 /nfs/dbraw/zinc/37/31/93/336373193.db2.gz LIROVYYVQJIFAN-UHFFFAOYSA-N 1 2 318.490 4.583 20 0 DJADLO CCc1ccc([C@H]2COCC[N@@H+]2Cc2ccc3ccccc3c2)o1 ZINC000514594598 336385327 /nfs/dbraw/zinc/38/53/27/336385327.db2.gz UJERWBFDKWQBIX-HXUWFJFHSA-N 1 2 321.420 4.569 20 0 DJADLO CCc1ccc([C@H]2COCC[N@H+]2Cc2ccc3ccccc3c2)o1 ZINC000514594598 336385328 /nfs/dbraw/zinc/38/53/28/336385328.db2.gz UJERWBFDKWQBIX-HXUWFJFHSA-N 1 2 321.420 4.569 20 0 DJADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1nnc(C(C)C)s1 ZINC000358298450 336622547 /nfs/dbraw/zinc/62/25/47/336622547.db2.gz MVSIFLOOCMKNRR-GFCCVEGCSA-N 1 2 315.442 4.567 20 0 DJADLO CC(C)[C@@H]([NH2+][C@@H](c1nccs1)c1ccccc1)c1cccnc1 ZINC000359371249 336669846 /nfs/dbraw/zinc/66/98/46/336669846.db2.gz KNRGWBWAGVFSMX-QZTJIDSGSA-N 1 2 323.465 4.614 20 0 DJADLO C[C@@H](Nc1cccc2c1CN(c1cccc[nH+]1)C2)c1cccs1 ZINC000371485813 336906117 /nfs/dbraw/zinc/90/61/17/336906117.db2.gz QDBQWAJTDXCGBR-CQSZACIVSA-N 1 2 321.449 4.836 20 0 DJADLO C[C@H]([NH2+][C@@H](c1ccsc1)c1ccc(Cl)cc1)c1ncc[nH]1 ZINC000375895873 337022412 /nfs/dbraw/zinc/02/24/12/337022412.db2.gz QNWVPZGAPUYTGC-XHDPSFHLSA-N 1 2 317.845 4.565 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1cccs1)c1ccc(Cl)cc1)c1ncc[nH]1 ZINC000375898425 337022614 /nfs/dbraw/zinc/02/26/14/337022614.db2.gz SKFINIVAHKEYBD-IAQYHMDHSA-N 1 2 317.845 4.565 20 0 DJADLO Cc1ccccc1[C@@H](C)[NH2+][C@H](c1nccs1)c1ccccc1 ZINC000123262982 337041655 /nfs/dbraw/zinc/04/16/55/337041655.db2.gz ZWKUCDCEANEHGY-QAPCUYQASA-N 1 2 308.450 4.892 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1cc2ccccc2o1)c1ccccc1)c1ncc[nH]1 ZINC000377126770 337047246 /nfs/dbraw/zinc/04/72/46/337047246.db2.gz LGSVFOAKQPWONT-AUUYWEPGSA-N 1 2 317.392 4.596 20 0 DJADLO C[C@@H](N[C@@H](c1cc2ccccc2o1)c1ccccc1)c1[nH]cc[nH+]1 ZINC000377126770 337047247 /nfs/dbraw/zinc/04/72/47/337047247.db2.gz LGSVFOAKQPWONT-AUUYWEPGSA-N 1 2 317.392 4.596 20 0 DJADLO Cc1cccc([C@@H](C)[NH2+][C@H](c2nccs2)c2ccccc2)c1 ZINC000173266754 337133935 /nfs/dbraw/zinc/13/39/35/337133935.db2.gz IHHWJVZYZSFFRV-QAPCUYQASA-N 1 2 308.450 4.892 20 0 DJADLO Cc1csc([C@@H](C)[NH2+][C@@H](C)c2ncc(-c3ccccc3)o2)n1 ZINC000184274528 337197702 /nfs/dbraw/zinc/19/77/02/337197702.db2.gz YLPQWABQVLDSKV-QWHCGFSZSA-N 1 2 313.426 4.518 20 0 DJADLO Cc1csc([C@H](C)[NH2+][C@@H](C)c2ncc(-c3ccccc3)o2)n1 ZINC000184274544 337197708 /nfs/dbraw/zinc/19/77/08/337197708.db2.gz YLPQWABQVLDSKV-STQMWFEESA-N 1 2 313.426 4.518 20 0 DJADLO Cc1ccc(CSCc2nc(C(F)(F)F)cs2)c(C)[nH+]1 ZINC000184831638 337200375 /nfs/dbraw/zinc/20/03/75/337200375.db2.gz AMCNTPPPSFUULM-UHFFFAOYSA-N 1 2 318.389 4.607 20 0 DJADLO Cc1cc(C)c(NC(=O)c2cc3sccc3s2)c(C)[nH+]1 ZINC000583158144 337247930 /nfs/dbraw/zinc/24/79/30/337247930.db2.gz JGDLTSHULZUZSV-UHFFFAOYSA-N 1 2 302.424 4.535 20 0 DJADLO CC[C@@H]([NH2+]Cc1ncc(-c2ccccc2)cn1)c1ccc(F)cc1 ZINC000185825801 337250522 /nfs/dbraw/zinc/25/05/22/337250522.db2.gz UMIXDWGNCJMWTK-LJQANCHMSA-N 1 2 321.399 4.524 20 0 DJADLO C[C@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)c1nc2c(s1)CCCC2 ZINC000584486156 337349819 /nfs/dbraw/zinc/34/98/19/337349819.db2.gz RSTIJZDNFWVMPD-DYEKYZERSA-N 1 2 316.470 4.589 20 0 DJADLO Cc1cc([C@@H](C)[NH2+][C@@H](COCC(C)C)c2ccco2)c(C)o1 ZINC000584569551 337363462 /nfs/dbraw/zinc/36/34/62/337363462.db2.gz LHEMXUJIGOHNJV-PBHICJAKSA-N 1 2 305.418 4.554 20 0 DJADLO c1csc([C@H]([NH2+][C@@H]2CCc3ccccc32)c2ccccc2)n1 ZINC000123146872 337397879 /nfs/dbraw/zinc/39/78/79/337397879.db2.gz QAQWDLSOHLOIDB-QZTJIDSGSA-N 1 2 306.434 4.510 20 0 DJADLO Cn1c(CCSCCCCC(F)(F)F)[nH+]c2ccccc21 ZINC000564111459 337455340 /nfs/dbraw/zinc/45/53/40/337455340.db2.gz YBBSUMWQLIIDLK-UHFFFAOYSA-N 1 2 316.392 4.582 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1nccs1)c1ccccc1)c1ccc(F)cc1 ZINC000195052741 337464741 /nfs/dbraw/zinc/46/47/41/337464741.db2.gz VWZIXXPHAWEFNH-CXAGYDPISA-N 1 2 312.413 4.722 20 0 DJADLO C[C@H]([NH2+][C@@H](c1nccs1)c1ccccc1)c1ccccc1F ZINC000195069809 337464892 /nfs/dbraw/zinc/46/48/92/337464892.db2.gz LKXANAFDHQXESC-SUMWQHHRSA-N 1 2 312.413 4.722 20 0 DJADLO Cc1[nH]c(CNc2cc(Cl)c(Cl)c(Cl)c2)[nH+]c1C ZINC000572424922 337636219 /nfs/dbraw/zinc/63/62/19/337636219.db2.gz XFYGIJWWCDUCME-UHFFFAOYSA-N 1 2 304.608 4.599 20 0 DJADLO Clc1ccc2c(c1)[C@H](Nc1ccc3c(c1)CC[NH2+]3)CCCO2 ZINC000423211361 337704509 /nfs/dbraw/zinc/70/45/09/337704509.db2.gz GZBZSIBAIVKOFG-QGZVFWFLSA-N 1 2 314.816 4.634 20 0 DJADLO C[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccccc1Br ZINC000423215232 337704793 /nfs/dbraw/zinc/70/47/93/337704793.db2.gz MPEDNXGUJBWZBA-LLVKDONJSA-N 1 2 317.230 4.590 20 0 DJADLO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2cc(F)c(Cl)cc2F)o1 ZINC000433195351 337718854 /nfs/dbraw/zinc/71/88/54/337718854.db2.gz UDTNKQOOQMUVCM-CABZTGNLSA-N 1 2 311.759 4.624 20 0 DJADLO C[C@H]([NH2+][C@H](c1cccs1)c1ccc(F)cc1)c1nccs1 ZINC000536864463 337747143 /nfs/dbraw/zinc/74/71/43/337747143.db2.gz SFSJBLIWGPSDTF-NHYWBVRUSA-N 1 2 318.442 4.784 20 0 DJADLO COc1ccc([C@H](C)[NH2+]Cc2nc(C(C)C)cs2)c(Cl)c1 ZINC000424307546 337818361 /nfs/dbraw/zinc/81/83/61/337818361.db2.gz XTLSGUIHDTZONT-NSHDSACASA-N 1 2 324.877 4.779 20 0 DJADLO Cc1cc(NC(=O)Nc2ccc(CCC(F)(F)F)cc2)cc[nH+]1 ZINC000119594154 337862158 /nfs/dbraw/zinc/86/21/58/337862158.db2.gz DYTNKESHKSYXMD-UHFFFAOYSA-N 1 2 323.318 4.529 20 0 DJADLO Cc1cccc([C@@H]([NH2+][C@H](C)c2ccccc2F)c2ccccn2)c1 ZINC000090946611 337887216 /nfs/dbraw/zinc/88/72/16/337887216.db2.gz MEFSPXPRJHGXLI-IIBYNOLFSA-N 1 2 320.411 4.969 20 0 DJADLO Cc1cccc([C@H]([NH2+][C@H](C)c2ccccc2F)c2ccccn2)c1 ZINC000090946610 337887254 /nfs/dbraw/zinc/88/72/54/337887254.db2.gz MEFSPXPRJHGXLI-IERDGZPVSA-N 1 2 320.411 4.969 20 0 DJADLO C[C@H]1CCC[C@H](Nc2cccc3c2CN(c2cccc[nH+]2)C3)C1 ZINC000537326222 337931094 /nfs/dbraw/zinc/93/10/94/337931094.db2.gz SDXYWLBDNGNCMS-RDJZCZTQSA-N 1 2 307.441 4.592 20 0 DJADLO CC[C@H]([NH2+]Cc1ncc(C)s1)c1ccc(Cl)cc1Cl ZINC000122976415 337934149 /nfs/dbraw/zinc/93/41/49/337934149.db2.gz HKWNPFKUYFZRBC-ZDUSSCGKSA-N 1 2 315.269 4.999 20 0 DJADLO Clc1cccc2c(NCc3ccc4c(c3)COC4)cc[nH+]c12 ZINC000516170115 338007010 /nfs/dbraw/zinc/00/70/10/338007010.db2.gz BGYCCQLZKODEGV-UHFFFAOYSA-N 1 2 310.784 4.531 20 0 DJADLO C[C@@H](c1ccco1)[N@H+](Cc1coc(-c2ccccc2)n1)C1CC1 ZINC000086232598 338013686 /nfs/dbraw/zinc/01/36/86/338013686.db2.gz MVCLMACIRQGNFS-AWEZNQCLSA-N 1 2 308.381 4.660 20 0 DJADLO C[C@@H](c1ccco1)[N@@H+](Cc1coc(-c2ccccc2)n1)C1CC1 ZINC000086232598 338013687 /nfs/dbraw/zinc/01/36/87/338013687.db2.gz MVCLMACIRQGNFS-AWEZNQCLSA-N 1 2 308.381 4.660 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)c1ccc([C@@H](C)C(F)(F)F)cc1 ZINC000425594270 338015766 /nfs/dbraw/zinc/01/57/66/338015766.db2.gz GLHCVSLYEVGGJC-LLVKDONJSA-N 1 2 322.330 4.617 20 0 DJADLO Cc1nc(C(C)C)oc1C[N@@H+]1CCc2c(F)cc(F)cc2[C@H]1C ZINC000428247837 338044347 /nfs/dbraw/zinc/04/43/47/338044347.db2.gz OLPPZHQOUJTXKW-GFCCVEGCSA-N 1 2 320.383 4.504 20 0 DJADLO Cc1nc(C(C)C)oc1C[N@H+]1CCc2c(F)cc(F)cc2[C@H]1C ZINC000428247837 338044348 /nfs/dbraw/zinc/04/43/48/338044348.db2.gz OLPPZHQOUJTXKW-GFCCVEGCSA-N 1 2 320.383 4.504 20 0 DJADLO Cc1nc([C@H]2CCC[N@@H+]2Cc2ccc(Cl)c(C)c2)cs1 ZINC000428396834 338050277 /nfs/dbraw/zinc/05/02/77/338050277.db2.gz ATIODFFNYRMWBH-MRXNPFEDSA-N 1 2 306.862 4.750 20 0 DJADLO Cc1nc([C@H]2CCC[N@H+]2Cc2ccc(Cl)c(C)c2)cs1 ZINC000428396834 338050278 /nfs/dbraw/zinc/05/02/78/338050278.db2.gz ATIODFFNYRMWBH-MRXNPFEDSA-N 1 2 306.862 4.750 20 0 DJADLO CC[N@H+](Cc1oc(C(C)C)nc1C)Cc1ccccc1Cl ZINC000428466075 338053693 /nfs/dbraw/zinc/05/36/93/338053693.db2.gz VADWGQJDPKRLOG-UHFFFAOYSA-N 1 2 306.837 4.782 20 0 DJADLO CC[N@@H+](Cc1oc(C(C)C)nc1C)Cc1ccccc1Cl ZINC000428466075 338053694 /nfs/dbraw/zinc/05/36/94/338053694.db2.gz VADWGQJDPKRLOG-UHFFFAOYSA-N 1 2 306.837 4.782 20 0 DJADLO Cc1cccc(C[N@@H+](C)[C@@H](C)c2noc(-c3ccccc3)n2)c1C ZINC000428715930 338059373 /nfs/dbraw/zinc/05/93/73/338059373.db2.gz ACWFOSJBKUAVKC-INIZCTEOSA-N 1 2 321.424 4.546 20 0 DJADLO Cc1cccc(C[N@H+](C)[C@@H](C)c2noc(-c3ccccc3)n2)c1C ZINC000428715930 338059374 /nfs/dbraw/zinc/05/93/74/338059374.db2.gz ACWFOSJBKUAVKC-INIZCTEOSA-N 1 2 321.424 4.546 20 0 DJADLO Cc1cccc(C[N@H+](C)Cc2csc(-c3ccco3)n2)c1C ZINC000428715984 338059388 /nfs/dbraw/zinc/05/93/88/338059388.db2.gz XRDXIUXTDBNSFQ-UHFFFAOYSA-N 1 2 312.438 4.652 20 0 DJADLO Cc1cccc(C[N@@H+](C)Cc2csc(-c3ccco3)n2)c1C ZINC000428715984 338059389 /nfs/dbraw/zinc/05/93/89/338059389.db2.gz XRDXIUXTDBNSFQ-UHFFFAOYSA-N 1 2 312.438 4.652 20 0 DJADLO Cc1ccoc1C[N@H+](C)Cc1ncc(-c2cccc(Cl)c2)o1 ZINC000429359265 338078318 /nfs/dbraw/zinc/07/83/18/338078318.db2.gz CGKRBWLREPPKGP-UHFFFAOYSA-N 1 2 316.788 4.528 20 0 DJADLO Cc1ccoc1C[N@@H+](C)Cc1ncc(-c2cccc(Cl)c2)o1 ZINC000429359265 338078319 /nfs/dbraw/zinc/07/83/19/338078319.db2.gz CGKRBWLREPPKGP-UHFFFAOYSA-N 1 2 316.788 4.528 20 0 DJADLO CC(C)(C)c1cc(C[NH2+]C(c2ccccc2)c2ccccc2)no1 ZINC000429682885 338087218 /nfs/dbraw/zinc/08/72/18/338087218.db2.gz HLCSZSPMAOIAGY-UHFFFAOYSA-N 1 2 320.436 4.851 20 0 DJADLO CC1(C)C[N@H+](Cc2cccc(C(F)(F)F)c2)[C@H]1c1cccnc1 ZINC000430085005 338095348 /nfs/dbraw/zinc/09/53/48/338095348.db2.gz LOVHUUUWYSTRII-INIZCTEOSA-N 1 2 320.358 4.684 20 0 DJADLO CC1(C)C[N@@H+](Cc2cccc(C(F)(F)F)c2)[C@H]1c1cccnc1 ZINC000430085005 338095349 /nfs/dbraw/zinc/09/53/49/338095349.db2.gz LOVHUUUWYSTRII-INIZCTEOSA-N 1 2 320.358 4.684 20 0 DJADLO COCC[C@H]([NH2+]Cc1csc(Cl)c1Cl)c1ccco1 ZINC000432255371 338151392 /nfs/dbraw/zinc/15/13/92/338151392.db2.gz BJPWWUZYAFALMC-JTQLQIEISA-N 1 2 320.241 4.515 20 0 DJADLO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1csc(Cl)c1Cl ZINC000432738679 338165204 /nfs/dbraw/zinc/16/52/04/338165204.db2.gz LXEUIAUFFFPDMU-VIFPVBQESA-N 1 2 316.253 4.954 20 0 DJADLO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1csc(Cl)c1Cl ZINC000432738679 338165205 /nfs/dbraw/zinc/16/52/05/338165205.db2.gz LXEUIAUFFFPDMU-VIFPVBQESA-N 1 2 316.253 4.954 20 0 DJADLO Clc1scc(CN2CCCC[C@@H]2c2[nH]cc[nH+]2)c1Cl ZINC000432746028 338165793 /nfs/dbraw/zinc/16/57/93/338165793.db2.gz AGFLAZMNUSCMJV-SNVBAGLBSA-N 1 2 316.257 4.505 20 0 DJADLO Clc1scc(CN2CCCC[C@H]2c2[nH]cc[nH+]2)c1Cl ZINC000432746026 338165813 /nfs/dbraw/zinc/16/58/13/338165813.db2.gz AGFLAZMNUSCMJV-JTQLQIEISA-N 1 2 316.257 4.505 20 0 DJADLO C[C@@H](CC[NH2+][C@@H](c1ccccc1)C(F)F)OCc1ccccc1 ZINC000433055714 338178936 /nfs/dbraw/zinc/17/89/36/338178936.db2.gz BKGXNJQQTNJUEU-YJBOKZPZSA-N 1 2 319.395 4.578 20 0 DJADLO Cc1ccc([C@@H]([NH2+]Cc2nccs2)c2ccccc2)c(C)c1 ZINC000194293918 338190946 /nfs/dbraw/zinc/19/09/46/338190946.db2.gz HWFVTGNFZIZGOK-IBGZPJMESA-N 1 2 308.450 4.639 20 0 DJADLO CC(C)c1noc([C@H](C)[NH2+][C@@H](c2ccc(Cl)cc2)C(C)C)n1 ZINC000433781676 338201772 /nfs/dbraw/zinc/20/17/72/338201772.db2.gz FRKQCHGDXGLELD-SWLSCSKDSA-N 1 2 321.852 4.894 20 0 DJADLO CC[C@H](Nc1[nH+]c(C)nc2[nH]ccc21)c1ccc(Cl)s1 ZINC000433790354 338201982 /nfs/dbraw/zinc/20/19/82/338201982.db2.gz WGOGGLIIMBICJD-JTQLQIEISA-N 1 2 306.822 4.544 20 0 DJADLO CC(C)c1cc(N2CC[C@H](CC(F)(F)F)C2)nc(C(C)C)[nH+]1 ZINC000433798147 338202224 /nfs/dbraw/zinc/20/22/24/338202224.db2.gz DKDCJRNBJXFSPJ-GFCCVEGCSA-N 1 2 315.383 4.502 20 0 DJADLO CCOc1ccc(Cl)cc1[C@@H](C)[NH2+][C@@H](C)c1nccs1 ZINC000153346673 338222880 /nfs/dbraw/zinc/22/28/80/338222880.db2.gz ZWVWJXLGDSEIOC-MNOVXSKESA-N 1 2 310.850 4.607 20 0 DJADLO Cc1cc(C)c(NC(=O)N[C@@H](c2ccccc2)C(C)C)c(C)[nH+]1 ZINC000436495429 338274273 /nfs/dbraw/zinc/27/42/73/338274273.db2.gz PEJDSSYUMLRAEL-QGZVFWFLSA-N 1 2 311.429 4.526 20 0 DJADLO C[C@@H](SCc1[nH+]ccn1CC(F)(F)F)c1cccc(F)c1 ZINC000437263842 338305215 /nfs/dbraw/zinc/30/52/15/338305215.db2.gz UTGNYSUGHHRLBQ-SNVBAGLBSA-N 1 2 318.339 4.579 20 0 DJADLO Fc1cccc2[nH]c(C[NH+](Cc3ccco3)Cc3ccco3)cc21 ZINC000437575373 338314003 /nfs/dbraw/zinc/31/40/03/338314003.db2.gz HWZZQVHVKFOVDP-UHFFFAOYSA-N 1 2 324.355 4.695 20 0 DJADLO CCc1ccc(NCc2c[nH+]cn2Cc2ccccc2)cc1CC ZINC000438315825 338339424 /nfs/dbraw/zinc/33/94/24/338339424.db2.gz UEVLDRGBEZHKJI-UHFFFAOYSA-N 1 2 319.452 4.668 20 0 DJADLO CC(C)(C)c1nc(CSCc2cn3ccccc3[nH+]2)cs1 ZINC000439542892 338372825 /nfs/dbraw/zinc/37/28/25/338372825.db2.gz QICWNVJGVMZPJF-UHFFFAOYSA-N 1 2 317.483 4.522 20 0 DJADLO CC(C)c1ncc(C[N@H+](C)Cc2ccc(Cl)cc2Cl)cn1 ZINC000440482443 338387899 /nfs/dbraw/zinc/38/78/99/338387899.db2.gz WJNGOQBSCJRYHY-UHFFFAOYSA-N 1 2 324.255 4.539 20 0 DJADLO CC(C)c1ncc(C[N@@H+](C)Cc2ccc(Cl)cc2Cl)cn1 ZINC000440482443 338387900 /nfs/dbraw/zinc/38/79/00/338387900.db2.gz WJNGOQBSCJRYHY-UHFFFAOYSA-N 1 2 324.255 4.539 20 0 DJADLO Cc1ccc(NC(=O)c2ccc3c(c2)Cc2ccccc2-3)c(C)[nH+]1 ZINC000446438484 338528084 /nfs/dbraw/zinc/52/80/84/338528084.db2.gz JNIJRLVENCFYTP-UHFFFAOYSA-N 1 2 314.388 4.522 20 0 DJADLO Cc1c2ccccc2oc1[C@H](C)NC(=O)Nc1ccc(C)[nH+]c1C ZINC000447166518 338546640 /nfs/dbraw/zinc/54/66/40/338546640.db2.gz LBYJUXIDIFWQBF-AWEZNQCLSA-N 1 2 323.396 4.636 20 0 DJADLO Cc1ccc([C@H](C)N(C)C(=O)Nc2ccc(C)[nH+]c2C)c(C)c1 ZINC000447179269 338547022 /nfs/dbraw/zinc/54/70/22/338547022.db2.gz WPBIYJMJHOLIQM-INIZCTEOSA-N 1 2 311.429 4.540 20 0 DJADLO Cc1ccc(NC(=O)N(Cc2ccccc2)CC2CCC2)c(C)[nH+]1 ZINC000447180566 338547046 /nfs/dbraw/zinc/54/70/46/338547046.db2.gz JLTJNMUTICZBRM-UHFFFAOYSA-N 1 2 323.440 4.533 20 0 DJADLO CC[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1Cl)c1ccn(C)n1 ZINC000447559656 338556823 /nfs/dbraw/zinc/55/68/23/338556823.db2.gz UTHGKXQEOIPMGG-HZMBPMFUSA-N 1 2 312.244 4.529 20 0 DJADLO Clc1cc(CN2CCCC[C@H]2c2[nH]cc[nH+]2)c(Cl)s1 ZINC000449018440 338584014 /nfs/dbraw/zinc/58/40/14/338584014.db2.gz NKNYPKHOAKSASK-JTQLQIEISA-N 1 2 316.257 4.505 20 0 DJADLO Clc1cc(CN2CCCC[C@@H]2c2[nH]cc[nH+]2)c(Cl)s1 ZINC000449018441 338584084 /nfs/dbraw/zinc/58/40/84/338584084.db2.gz NKNYPKHOAKSASK-SNVBAGLBSA-N 1 2 316.257 4.505 20 0 DJADLO Fc1cc2c(c(F)c1F)[C@H]([NH2+]Cc1ccsc1Cl)CC2 ZINC000449584734 338639855 /nfs/dbraw/zinc/63/98/55/338639855.db2.gz JZPRQQZGALLVBS-SNVBAGLBSA-N 1 2 317.763 4.596 20 0 DJADLO CCC(CC)n1ccc(C[NH2+][C@H](C)c2ccc(F)cc2Cl)n1 ZINC000451107926 338721312 /nfs/dbraw/zinc/72/13/12/338721312.db2.gz KCHGTGWMNCWJFI-GFCCVEGCSA-N 1 2 323.843 4.888 20 0 DJADLO Cc1ccc([C@H]([NH2+][C@@H]2C[C@@H](C)n3ccnc32)c2ccccc2)cc1 ZINC000453056392 338788379 /nfs/dbraw/zinc/78/83/79/338788379.db2.gz KYEXFIOGNPEZQI-NSISKUIASA-N 1 2 317.436 4.577 20 0 DJADLO c1cn2c([nH+]1)[C@@H](Nc1ccc(CCCc3ccccc3)cc1)CC2 ZINC000453185383 338804367 /nfs/dbraw/zinc/80/43/67/338804367.db2.gz LAILHDIDVBPTIX-FQEVSTJZSA-N 1 2 317.436 4.615 20 0 DJADLO Clc1cc2c(c(Cl)c1)[C@@H]([NH2+]Cc1cnc(C3CC3)o1)CC2 ZINC000453340990 338827723 /nfs/dbraw/zinc/82/77/23/338827723.db2.gz DOUHEBSKMGPANG-AWEZNQCLSA-N 1 2 323.223 4.636 20 0 DJADLO CCn1ccnc1[C@@H](C)[NH2+][C@@H](C)c1cc(Cl)sc1Cl ZINC000453373251 338833791 /nfs/dbraw/zinc/83/37/91/338833791.db2.gz XAWGPEVYIZFXNZ-DTWKUNHWSA-N 1 2 318.273 4.683 20 0 DJADLO COc1ccc(-c2ccccc2C)cc1C[NH2+][C@@H](C)c1ccon1 ZINC000459494006 339032427 /nfs/dbraw/zinc/03/24/27/339032427.db2.gz ZUOIKWJMXQNUIV-HNNXBMFYSA-N 1 2 322.408 4.509 20 0 DJADLO CCCCc1nc(C[NH2+][C@@H](C)c2cc(C)ccc2OC)cs1 ZINC000459690029 339043164 /nfs/dbraw/zinc/04/31/64/339043164.db2.gz IZJNGMRAPSDZND-AWEZNQCLSA-N 1 2 318.486 4.654 20 0 DJADLO Cc1cc(C)c(NC(=O)c2ccc(C(F)(F)F)cc2C)c(C)[nH+]1 ZINC000459936598 339050834 /nfs/dbraw/zinc/05/08/34/339050834.db2.gz WGKIVVYHKITDOC-UHFFFAOYSA-N 1 2 322.330 4.586 20 0 DJADLO Cc1nc([C@@H](C)[NH2+][C@H](C)c2nc(C(C)(C)C)cs2)cs1 ZINC000462823056 339092311 /nfs/dbraw/zinc/09/23/11/339092311.db2.gz YDWARRVCHDARDJ-NXEZZACHSA-N 1 2 309.504 4.617 20 0 DJADLO Cc1cc(Nc2ccc(CC(F)(F)F)cc2)nc(C2CC2)[nH+]1 ZINC000462869274 339095289 /nfs/dbraw/zinc/09/52/89/339095289.db2.gz WAHQMJAKFKCBRV-UHFFFAOYSA-N 1 2 307.319 4.511 20 0 DJADLO Fc1ccccc1Oc1ccc(CNc2cccc[nH+]2)cc1F ZINC000462908880 339097551 /nfs/dbraw/zinc/09/75/51/339097551.db2.gz LDQIQPWUEKHFPH-UHFFFAOYSA-N 1 2 312.319 4.764 20 0 DJADLO COc1ccccc1[C@@H](C)SCc1cn2cccc(C)c2[nH+]1 ZINC000463188583 339108635 /nfs/dbraw/zinc/10/86/35/339108635.db2.gz DAZGSDRRKFZYGP-CQSZACIVSA-N 1 2 312.438 4.646 20 0 DJADLO Cc1cc(C)c(NC(=O)c2ccc(C3CCCC3)cc2)c(C)[nH+]1 ZINC000463266354 339112607 /nfs/dbraw/zinc/11/26/07/339112607.db2.gz NIQDSHCDWWBCEI-UHFFFAOYSA-N 1 2 308.425 4.917 20 0 DJADLO CC(C)c1ncc(CNc2ccc(-c3ccccc3)c[nH+]2)s1 ZINC000466627500 339210949 /nfs/dbraw/zinc/21/09/49/339210949.db2.gz QJPZXLWTNQNFFA-UHFFFAOYSA-N 1 2 309.438 4.941 20 0 DJADLO C[C@@H](c1ccccc1Cl)[N@H+](C)Cc1nc2ccc(F)cc2o1 ZINC000466811816 339217702 /nfs/dbraw/zinc/21/77/02/339217702.db2.gz JQYVCTGSWKYBOV-NSHDSACASA-N 1 2 318.779 4.813 20 0 DJADLO C[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1nc2ccc(F)cc2o1 ZINC000466811816 339217703 /nfs/dbraw/zinc/21/77/03/339217703.db2.gz JQYVCTGSWKYBOV-NSHDSACASA-N 1 2 318.779 4.813 20 0 DJADLO CC[N@H+](Cc1ccc(Cl)s1)Cc1nc2ccc(F)cc2o1 ZINC000466815651 339217792 /nfs/dbraw/zinc/21/77/92/339217792.db2.gz VXMUSRPWHZVBAH-UHFFFAOYSA-N 1 2 324.808 4.704 20 0 DJADLO CC[N@@H+](Cc1ccc(Cl)s1)Cc1nc2ccc(F)cc2o1 ZINC000466815651 339217793 /nfs/dbraw/zinc/21/77/93/339217793.db2.gz VXMUSRPWHZVBAH-UHFFFAOYSA-N 1 2 324.808 4.704 20 0 DJADLO Cc1cccn2cc(-c3ccc(NC(=O)[C@H](C)C(C)C)cc3)[nH+]c12 ZINC000498262916 339229793 /nfs/dbraw/zinc/22/97/93/339229793.db2.gz ITILAGOEPOCSQK-OAHLLOKOSA-N 1 2 321.424 4.540 20 0 DJADLO Cc1ccc[nH+]c1[C@H]1CCC[C@H](Nc2ccccc2N(C)C)C1 ZINC000467334061 339232101 /nfs/dbraw/zinc/23/21/01/339232101.db2.gz MMMAHHZHMGCRNI-IRXDYDNUSA-N 1 2 309.457 4.594 20 0 DJADLO CC(C)(C)C[C@H]([NH2+][C@@H]1CCC[C@@H]([C@@H]2CCOC2)C1)C(F)(F)F ZINC000467346843 339232842 /nfs/dbraw/zinc/23/28/42/339232842.db2.gz QQRVUJKUGYJZLP-TUVASFSCSA-N 1 2 321.427 4.538 20 0 DJADLO C[C@H](c1cccc(Cl)c1)[N@@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000468109230 339254306 /nfs/dbraw/zinc/25/43/06/339254306.db2.gz JODZMBCJEMKISY-MLGOLLRUSA-N 1 2 307.846 4.536 20 0 DJADLO C[C@H](c1cccc(Cl)c1)[N@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000468109230 339254307 /nfs/dbraw/zinc/25/43/07/339254307.db2.gz JODZMBCJEMKISY-MLGOLLRUSA-N 1 2 307.846 4.536 20 0 DJADLO C[C@@H](c1cccc(Cl)c1)[N@@H+]1CCO[C@H](c2ccsc2)C1 ZINC000468109229 339254370 /nfs/dbraw/zinc/25/43/70/339254370.db2.gz JODZMBCJEMKISY-LRDDRELGSA-N 1 2 307.846 4.536 20 0 DJADLO C[C@@H](c1cccc(Cl)c1)[N@H+]1CCO[C@H](c2ccsc2)C1 ZINC000468109229 339254371 /nfs/dbraw/zinc/25/43/71/339254371.db2.gz JODZMBCJEMKISY-LRDDRELGSA-N 1 2 307.846 4.536 20 0 DJADLO COCc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(Cl)c(F)c2)o1 ZINC000468695578 339268843 /nfs/dbraw/zinc/26/88/43/339268843.db2.gz GFVZRUCDBJSKRJ-MRXNPFEDSA-N 1 2 323.795 4.556 20 0 DJADLO COCc1ccc([C@H]2CCC[N@H+]2Cc2ccc(Cl)c(F)c2)o1 ZINC000468695578 339268844 /nfs/dbraw/zinc/26/88/44/339268844.db2.gz GFVZRUCDBJSKRJ-MRXNPFEDSA-N 1 2 323.795 4.556 20 0 DJADLO C[C@H]1CC[C@H](CC(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000468842168 339272492 /nfs/dbraw/zinc/27/24/92/339272492.db2.gz GRFQHGIOWVZYRB-GJZGRUSLSA-N 1 2 310.397 4.639 20 0 DJADLO C[C@H]1CC[C@@H](CC(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)C1 ZINC000468924563 339274939 /nfs/dbraw/zinc/27/49/39/339274939.db2.gz KUBRCPFGRJAEDQ-LSDHHAIUSA-N 1 2 310.397 4.639 20 0 DJADLO CCCC1(C(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)CCC1 ZINC000469014321 339277567 /nfs/dbraw/zinc/27/75/67/339277567.db2.gz SJRYUIGKJRZEMA-UHFFFAOYSA-N 1 2 310.397 4.783 20 0 DJADLO CC(C)c1nc(C[N@H+](Cc2ccccc2)[C@@H](C)C(C)(C)C)no1 ZINC000469445723 339289556 /nfs/dbraw/zinc/28/95/56/339289556.db2.gz GBRQLTRIMAWIPM-HNNXBMFYSA-N 1 2 315.461 4.630 20 0 DJADLO CC(C)c1nc(C[N@@H+](Cc2ccccc2)[C@@H](C)C(C)(C)C)no1 ZINC000469445723 339289557 /nfs/dbraw/zinc/28/95/57/339289557.db2.gz GBRQLTRIMAWIPM-HNNXBMFYSA-N 1 2 315.461 4.630 20 0 DJADLO CC(C)c1nc(C[N@@H+]2CC[C@H](c3c(F)cccc3F)C2)cs1 ZINC000469461819 339290280 /nfs/dbraw/zinc/29/02/80/339290280.db2.gz YNUTUTXNPKTVHK-LBPRGKRZSA-N 1 2 322.424 4.534 20 0 DJADLO CC(C)c1nc(C[N@H+]2CC[C@H](c3c(F)cccc3F)C2)cs1 ZINC000469461819 339290281 /nfs/dbraw/zinc/29/02/81/339290281.db2.gz YNUTUTXNPKTVHK-LBPRGKRZSA-N 1 2 322.424 4.534 20 0 DJADLO C[C@@H]1CCC[C@@H]1CC(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000469485323 339291219 /nfs/dbraw/zinc/29/12/19/339291219.db2.gz FKESQSMADPYXQS-HUUCEWRRSA-N 1 2 310.397 4.639 20 0 DJADLO C[C@H]1CCC[C@H]1CC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000469508641 339292122 /nfs/dbraw/zinc/29/21/22/339292122.db2.gz NTMWMGYQILKTDY-GJZGRUSLSA-N 1 2 310.397 4.639 20 0 DJADLO Cc1cc(C[N@@H+]2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)no1 ZINC000469514743 339292220 /nfs/dbraw/zinc/29/22/20/339292220.db2.gz BJBVTVOPHLYDEY-MRXNPFEDSA-N 1 2 324.346 4.729 20 0 DJADLO Cc1cc(C[N@H+]2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)no1 ZINC000469514743 339292221 /nfs/dbraw/zinc/29/22/21/339292221.db2.gz BJBVTVOPHLYDEY-MRXNPFEDSA-N 1 2 324.346 4.729 20 0 DJADLO CSc1ccc(F)cc1C[NH2+][C@@H](C)c1csc(C(C)C)n1 ZINC000469773853 339298625 /nfs/dbraw/zinc/29/86/25/339298625.db2.gz BVGVVTCDWAWCAE-NSHDSACASA-N 1 2 324.490 4.978 20 0 DJADLO C[C@H](c1cc(F)ccc1F)[N@@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000470209930 339314299 /nfs/dbraw/zinc/31/42/99/339314299.db2.gz PHEQEWPQESRILN-QFSBIZTOSA-N 1 2 323.408 4.549 20 0 DJADLO C[C@H](c1cc(F)ccc1F)[N@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000470209930 339314300 /nfs/dbraw/zinc/31/43/00/339314300.db2.gz PHEQEWPQESRILN-QFSBIZTOSA-N 1 2 323.408 4.549 20 0 DJADLO CC(C)[C@H]([NH2+]C1CCC(c2ccc(O)cc2)CC1)C(F)(F)F ZINC000470251195 339315267 /nfs/dbraw/zinc/31/52/67/339315267.db2.gz WZYDOTNDJHHRKU-PXCJXSSVSA-N 1 2 315.379 4.595 20 0 DJADLO C[C@@H]1C[N@H+](Cc2cccc(C(F)F)c2)[C@@H](c2ccccc2)CO1 ZINC000470762035 339326984 /nfs/dbraw/zinc/32/69/84/339326984.db2.gz OCYIDHRSXPSQJC-RDTXWAMCSA-N 1 2 317.379 4.586 20 0 DJADLO C[C@@H]1C[N@@H+](Cc2cccc(C(F)F)c2)[C@@H](c2ccccc2)CO1 ZINC000470762035 339326985 /nfs/dbraw/zinc/32/69/85/339326985.db2.gz OCYIDHRSXPSQJC-RDTXWAMCSA-N 1 2 317.379 4.586 20 0 DJADLO C[C@H]1C[N@H+](Cc2cccc(C(F)F)c2)C[C@@H](c2ccsc2)O1 ZINC000470782447 339327903 /nfs/dbraw/zinc/32/79/03/339327903.db2.gz WJTBUWPJQJLVIY-LRDDRELGSA-N 1 2 323.408 4.648 20 0 DJADLO C[C@H]1C[N@@H+](Cc2cccc(C(F)F)c2)C[C@@H](c2ccsc2)O1 ZINC000470782447 339327904 /nfs/dbraw/zinc/32/79/04/339327904.db2.gz WJTBUWPJQJLVIY-LRDDRELGSA-N 1 2 323.408 4.648 20 0 DJADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1csc(C2CCCC2)n1 ZINC000470952046 339332514 /nfs/dbraw/zinc/33/25/14/339332514.db2.gz ZYWIGODDOOFYRY-GWCFXTLKSA-N 1 2 318.408 4.573 20 0 DJADLO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1csc(C2CCCC2)n1 ZINC000470952046 339332515 /nfs/dbraw/zinc/33/25/15/339332515.db2.gz ZYWIGODDOOFYRY-GWCFXTLKSA-N 1 2 318.408 4.573 20 0 DJADLO Cc1ccc(-c2nc(C[N@@H+]3CC[C@@H]3c3ccccc3)cs2)o1 ZINC000471180811 339339687 /nfs/dbraw/zinc/33/96/87/339339687.db2.gz HZTMAJJZDDRPGW-MRXNPFEDSA-N 1 2 310.422 4.659 20 0 DJADLO Cc1ccc(-c2nc(C[N@H+]3CC[C@@H]3c3ccccc3)cs2)o1 ZINC000471180811 339339688 /nfs/dbraw/zinc/33/96/88/339339688.db2.gz HZTMAJJZDDRPGW-MRXNPFEDSA-N 1 2 310.422 4.659 20 0 DJADLO Cc1cccc2[nH+]c(CNc3ccccc3SC(C)C)cn21 ZINC000471655699 339350323 /nfs/dbraw/zinc/35/03/23/339350323.db2.gz XPHQHNNCZVOMGA-UHFFFAOYSA-N 1 2 311.454 4.755 20 0 DJADLO Cc1c2ccccc2oc1[C@H](C)[NH2+]Cc1ncc(Cl)s1 ZINC000472046702 339360632 /nfs/dbraw/zinc/36/06/32/339360632.db2.gz GNCOMNLBEHUMJU-JTQLQIEISA-N 1 2 306.818 4.702 20 0 DJADLO CC(C)Sc1cccc(Cl)c1C[N@H+](C)Cc1cccnc1 ZINC000472572693 339374288 /nfs/dbraw/zinc/37/42/88/339374288.db2.gz YDWZKLPFZZWQAB-UHFFFAOYSA-N 1 2 320.889 4.868 20 0 DJADLO CC(C)Sc1cccc(Cl)c1C[N@@H+](C)Cc1cccnc1 ZINC000472572693 339374289 /nfs/dbraw/zinc/37/42/89/339374289.db2.gz YDWZKLPFZZWQAB-UHFFFAOYSA-N 1 2 320.889 4.868 20 0 DJADLO C[C@@H](c1cccc(Cl)c1)[N@@H+]1CCO[C@@H](c2cccs2)C1 ZINC000472833080 339378079 /nfs/dbraw/zinc/37/80/79/339378079.db2.gz XXPDIFMGKRPORY-SWLSCSKDSA-N 1 2 307.846 4.536 20 0 DJADLO C[C@@H](c1cccc(Cl)c1)[N@H+]1CCO[C@@H](c2cccs2)C1 ZINC000472833080 339378080 /nfs/dbraw/zinc/37/80/80/339378080.db2.gz XXPDIFMGKRPORY-SWLSCSKDSA-N 1 2 307.846 4.536 20 0 DJADLO CCc1oc2ccccc2c1C[N@H+](C)Cc1ncc(Cl)s1 ZINC000473123735 339381453 /nfs/dbraw/zinc/38/14/53/339381453.db2.gz ADBCTPGHUNGTKZ-UHFFFAOYSA-N 1 2 320.845 4.737 20 0 DJADLO CCc1oc2ccccc2c1C[N@@H+](C)Cc1ncc(Cl)s1 ZINC000473123735 339381454 /nfs/dbraw/zinc/38/14/54/339381454.db2.gz ADBCTPGHUNGTKZ-UHFFFAOYSA-N 1 2 320.845 4.737 20 0 DJADLO C[C@H](c1ccc(Cl)cc1)[N@H+](C)Cc1ncc(Cl)s1 ZINC000473143202 339382480 /nfs/dbraw/zinc/38/24/80/339382480.db2.gz LJYLWCWSCDNSQD-SECBINFHSA-N 1 2 301.242 4.643 20 0 DJADLO C[C@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1ncc(Cl)s1 ZINC000473143202 339382481 /nfs/dbraw/zinc/38/24/81/339382481.db2.gz LJYLWCWSCDNSQD-SECBINFHSA-N 1 2 301.242 4.643 20 0 DJADLO CCOc1ccc([C@H]2CCC[N@@H+]2Cc2ncc(Cl)s2)cc1 ZINC000473143375 339382647 /nfs/dbraw/zinc/38/26/47/339382647.db2.gz MNCPNPJUBGRMQK-CQSZACIVSA-N 1 2 322.861 4.532 20 0 DJADLO CCOc1ccc([C@H]2CCC[N@H+]2Cc2ncc(Cl)s2)cc1 ZINC000473143375 339382648 /nfs/dbraw/zinc/38/26/48/339382648.db2.gz MNCPNPJUBGRMQK-CQSZACIVSA-N 1 2 322.861 4.532 20 0 DJADLO C[C@@H](c1ccc(Cl)cc1)[N@H+](C)Cc1ncc(Cl)s1 ZINC000473143204 339382677 /nfs/dbraw/zinc/38/26/77/339382677.db2.gz LJYLWCWSCDNSQD-VIFPVBQESA-N 1 2 301.242 4.643 20 0 DJADLO C[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1ncc(Cl)s1 ZINC000473143204 339382678 /nfs/dbraw/zinc/38/26/78/339382678.db2.gz LJYLWCWSCDNSQD-VIFPVBQESA-N 1 2 301.242 4.643 20 0 DJADLO C[C@H](c1cc2ccccc2o1)[N@H+](C)Cc1ncc(Cl)s1 ZINC000473147803 339382824 /nfs/dbraw/zinc/38/28/24/339382824.db2.gz PEOBRWZTKOCFQT-SNVBAGLBSA-N 1 2 306.818 4.736 20 0 DJADLO C[C@H](c1cc2ccccc2o1)[N@@H+](C)Cc1ncc(Cl)s1 ZINC000473147803 339382825 /nfs/dbraw/zinc/38/28/25/339382825.db2.gz PEOBRWZTKOCFQT-SNVBAGLBSA-N 1 2 306.818 4.736 20 0 DJADLO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2ncc(Cl)s2)cc1C ZINC000473146498 339382893 /nfs/dbraw/zinc/38/28/93/339382893.db2.gz UEWGCVAXSQVVRH-AWEZNQCLSA-N 1 2 306.862 4.750 20 0 DJADLO Cc1ccc([C@@H]2CCC[N@H+]2Cc2ncc(Cl)s2)cc1C ZINC000473146498 339382894 /nfs/dbraw/zinc/38/28/94/339382894.db2.gz UEWGCVAXSQVVRH-AWEZNQCLSA-N 1 2 306.862 4.750 20 0 DJADLO Cc1ccc([C@H]([NH2+]Cc2ccc(Cl)o2)c2ccccn2)cc1 ZINC000475359614 339449100 /nfs/dbraw/zinc/44/91/00/339449100.db2.gz WMJFBHLEXSZKFN-SFHVURJKSA-N 1 2 312.800 4.516 20 0 DJADLO Cc1ccc([C@@H]([NH2+]Cc2ccc(Cl)o2)c2ccccn2)cc1 ZINC000475359431 339449107 /nfs/dbraw/zinc/44/91/07/339449107.db2.gz WMJFBHLEXSZKFN-GOSISDBHSA-N 1 2 312.800 4.516 20 0 DJADLO Cc1ccc(CSc2nc3cc(Cl)ccc3n2C)c(C)[nH+]1 ZINC000479226653 339529434 /nfs/dbraw/zinc/52/94/34/339529434.db2.gz MVWOSTWAAJBNPL-UHFFFAOYSA-N 1 2 317.845 4.531 20 0 DJADLO COc1cc(C)[nH+]c(CSCc2cccc(C(F)F)c2)c1 ZINC000479600156 339543122 /nfs/dbraw/zinc/54/31/22/339543122.db2.gz AGQYWUYSEJZEKC-UHFFFAOYSA-N 1 2 309.381 4.770 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1ccc(Cl)cn1)c1nc(C(C)(C)C)cs1 ZINC000480224331 339564035 /nfs/dbraw/zinc/56/40/35/339564035.db2.gz DTEBNAWJYPFSQW-GHMZBOCLSA-N 1 2 323.893 4.901 20 0 DJADLO Cc1cc(C)c(NC(=O)C[C@@H](c2ccccc2)C(C)C)c(C)[nH+]1 ZINC000482054606 339621210 /nfs/dbraw/zinc/62/12/10/339621210.db2.gz ROZHBTYNXJCJCR-GOSISDBHSA-N 1 2 310.441 4.775 20 0 DJADLO Cc1ccc(NC(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)cc1 ZINC000482115576 339623639 /nfs/dbraw/zinc/62/36/39/339623639.db2.gz UVFGRFYCDQORGF-UHFFFAOYSA-N 1 2 319.364 4.826 20 0 DJADLO CCCCCN(C(=O)Nc1c(C)cc[nH+]c1C)[C@H](C)CCC ZINC000485458415 339703698 /nfs/dbraw/zinc/70/36/98/339703698.db2.gz PAGNCXXBMHWDMI-OAHLLOKOSA-N 1 2 305.466 4.911 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H](C)c1cccc2ccccc21 ZINC000485568094 339705990 /nfs/dbraw/zinc/70/59/90/339705990.db2.gz JBXBXAFPSZRYPD-CQSZACIVSA-N 1 2 319.408 4.734 20 0 DJADLO Cc1cc(OCc2ncc(-c3cccs3)o2)c2ccccc2[nH+]1 ZINC000486235685 339723813 /nfs/dbraw/zinc/72/38/13/339723813.db2.gz WLLAOAKWJJLHPC-UHFFFAOYSA-N 1 2 322.389 4.839 20 0 DJADLO Cc1[nH+]c2ccccn2c1CNc1ccc(-c2ccco2)cc1F ZINC000486792170 339734589 /nfs/dbraw/zinc/73/45/89/339734589.db2.gz RPCUKLUCNZZWKB-UHFFFAOYSA-N 1 2 321.355 4.654 20 0 DJADLO CC[C@@H]([NH2+][C@H](COCC(C)C)c1ccco1)c1ccccc1F ZINC000490190551 339828323 /nfs/dbraw/zinc/82/83/23/339828323.db2.gz JUHMEFKGOKDCHC-QZTJIDSGSA-N 1 2 319.420 4.873 20 0 DJADLO CCCc1csc(C[NH2+][C@@H](C)c2c(F)cccc2Cl)n1 ZINC000494117249 339941389 /nfs/dbraw/zinc/94/13/89/339941389.db2.gz RVFQEZVTCMORMU-JTQLQIEISA-N 1 2 312.841 4.739 20 0 DJADLO Cc1cc(C[NH2+][C@@H](c2ccsc2)c2ccc(Cl)cc2)no1 ZINC000495029350 339970661 /nfs/dbraw/zinc/97/06/61/339970661.db2.gz WMQDIJUVEFHVCM-MRXNPFEDSA-N 1 2 318.829 4.577 20 0 DJADLO CC(C)c1nnc(C[NH2+]C2c3ccccc3-c3ccccc32)s1 ZINC000498775589 340023012 /nfs/dbraw/zinc/02/30/12/340023012.db2.gz UZEDGKLKJXUSSB-UHFFFAOYSA-N 1 2 321.449 4.521 20 0 DJADLO C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)c1cc[nH+]c(C2CC2)n1 ZINC000498954097 340026927 /nfs/dbraw/zinc/02/69/27/340026927.db2.gz FZBFGSJIXLGFBG-NSHDSACASA-N 1 2 321.346 4.570 20 0 DJADLO CC(C)[C@H](c1ccccc1Cl)[N@H+](C)Cc1nccn1C(C)C ZINC000500236559 340053556 /nfs/dbraw/zinc/05/35/56/340053556.db2.gz NZLTUMQYLFUHPP-GOSISDBHSA-N 1 2 319.880 4.947 20 0 DJADLO CC(C)[C@H](c1ccccc1Cl)[N@@H+](C)Cc1nccn1C(C)C ZINC000500236559 340053557 /nfs/dbraw/zinc/05/35/57/340053557.db2.gz NZLTUMQYLFUHPP-GOSISDBHSA-N 1 2 319.880 4.947 20 0 DJADLO CSc1ccc([C@H](C)[NH2+][C@H](C)c2nc(C(C)(C)C)no2)cc1 ZINC000500251745 340054114 /nfs/dbraw/zinc/05/41/14/340054114.db2.gz OLKAJJKQGADYCB-NWDGAFQWSA-N 1 2 319.474 4.501 20 0 DJADLO C[C@@H]1C[C@]1([NH2+]Cc1csc(C2CC2)n1)c1ccc(Cl)cc1 ZINC000500414219 340057519 /nfs/dbraw/zinc/05/75/19/340057519.db2.gz GLTQZDJRRUJVMY-PIGZYNQJSA-N 1 2 318.873 4.699 20 0 DJADLO Cc1ccc(C[N@H+]2CCCCC[C@@H]2c2noc(C(C)C)n2)s1 ZINC000501701023 340086879 /nfs/dbraw/zinc/08/68/79/340086879.db2.gz AFSNCQFQESYQPV-OAHLLOKOSA-N 1 2 319.474 4.680 20 0 DJADLO Cc1ccc(C[N@@H+]2CCCCC[C@@H]2c2noc(C(C)C)n2)s1 ZINC000501701023 340086880 /nfs/dbraw/zinc/08/68/80/340086880.db2.gz AFSNCQFQESYQPV-OAHLLOKOSA-N 1 2 319.474 4.680 20 0 DJADLO Cn1cc[nH+]c1CS[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000516586196 340097071 /nfs/dbraw/zinc/09/70/71/340097071.db2.gz NQIBXBIKLFKGKC-GOSISDBHSA-N 1 2 312.413 4.582 20 0 DJADLO Cc1cc([C@@H](C)[NH2+]Cc2coc(-c3ccc(C)cc3)n2)oc1C ZINC000502411442 340102353 /nfs/dbraw/zinc/10/23/53/340102353.db2.gz AMELIVJJWNYZSL-CQSZACIVSA-N 1 2 310.397 4.711 20 0 DJADLO c1[nH+]c(-c2ccc(N[C@H]3CCC34CCC4)cc2)n2c1CCCC2 ZINC000502455459 340104260 /nfs/dbraw/zinc/10/42/60/340104260.db2.gz WMMDNMMEIHYWAJ-SFHVURJKSA-N 1 2 307.441 4.631 20 0 DJADLO Cc1cc([C@@H](C)[NH2+][C@@H](COCC(C)C)c2ccco2)oc1C ZINC000502700697 340111222 /nfs/dbraw/zinc/11/12/22/340111222.db2.gz QYEUBNWUMGTWSK-ZBFHGGJFSA-N 1 2 305.418 4.554 20 0 DJADLO CCCc1nc(C[NH2+][C@]2(c3ccc(Cl)cc3)C[C@@H]2C)cs1 ZINC000503412444 340127637 /nfs/dbraw/zinc/12/76/37/340127637.db2.gz URRDTOYQKREUBR-YVEFUNNKSA-N 1 2 320.889 4.774 20 0 DJADLO CCOc1cccc2cc([C@H](C)[NH2+][C@@H](C)c3cc(C)on3)oc21 ZINC000503856064 340135276 /nfs/dbraw/zinc/13/52/76/340135276.db2.gz MSTMAAYOPBUDIL-STQMWFEESA-N 1 2 314.385 4.540 20 0 DJADLO COc1ccccc1-c1ccc([C@@H](C)[NH2+]C2(C(F)F)CC2)cc1 ZINC000503926716 340137054 /nfs/dbraw/zinc/13/70/54/340137054.db2.gz OFCCBWNQNNDSGK-CYBMUJFWSA-N 1 2 317.379 4.811 20 0 DJADLO CC(C)(C)Oc1cc[nH+]cc1NC(=O)c1cccc2ccccc21 ZINC000504619375 340150258 /nfs/dbraw/zinc/15/02/58/340150258.db2.gz DVZACUMQHOASDZ-UHFFFAOYSA-N 1 2 320.392 4.664 20 0 DJADLO Fc1cc(C[N@@H+]2CCCCC[C@H]2c2ccncc2)cc(F)c1F ZINC000505252886 340164851 /nfs/dbraw/zinc/16/48/51/340164851.db2.gz AKYYOANKHZGDCD-KRWDZBQOSA-N 1 2 320.358 4.616 20 0 DJADLO Fc1cc(C[N@H+]2CCCCC[C@H]2c2ccncc2)cc(F)c1F ZINC000505252886 340164852 /nfs/dbraw/zinc/16/48/52/340164852.db2.gz AKYYOANKHZGDCD-KRWDZBQOSA-N 1 2 320.358 4.616 20 0 DJADLO COc1ccsc1C[N@H+](Cc1ccco1)Cc1cccs1 ZINC000505564501 340171186 /nfs/dbraw/zinc/17/11/86/340171186.db2.gz NWIVCBXHZILAHN-UHFFFAOYSA-N 1 2 319.451 4.614 20 0 DJADLO COc1ccsc1C[N@@H+](Cc1ccco1)Cc1cccs1 ZINC000505564501 340171187 /nfs/dbraw/zinc/17/11/87/340171187.db2.gz NWIVCBXHZILAHN-UHFFFAOYSA-N 1 2 319.451 4.614 20 0 DJADLO c1ccc([C@H](Nc2ccc3ccccc3[nH+]2)[C@@H]2CCCO2)cc1 ZINC000505779583 340177763 /nfs/dbraw/zinc/17/77/63/340177763.db2.gz YHEJKNIZAVSGCS-ICSRJNTNSA-N 1 2 304.393 4.567 20 0 DJADLO Cc1cc2[nH+]cn(Cc3cc(Cl)cc4cccnc43)c2cc1C ZINC000506069413 340184900 /nfs/dbraw/zinc/18/49/00/340184900.db2.gz BGWHCGJYOCJZHF-UHFFFAOYSA-N 1 2 321.811 4.903 20 0 DJADLO C[N@H+](Cc1ncc(C(C)(C)C)o1)Cc1ccc2ccccc2c1 ZINC000506096758 340185478 /nfs/dbraw/zinc/18/54/78/340185478.db2.gz VWGZCZYKBOCWLD-UHFFFAOYSA-N 1 2 308.425 4.757 20 0 DJADLO C[N@@H+](Cc1ncc(C(C)(C)C)o1)Cc1ccc2ccccc2c1 ZINC000506096758 340185479 /nfs/dbraw/zinc/18/54/79/340185479.db2.gz VWGZCZYKBOCWLD-UHFFFAOYSA-N 1 2 308.425 4.757 20 0 DJADLO COc1ccc(Cl)cc1C[N@H+](C)Cc1cnc(C(C)C)s1 ZINC000506137391 340186547 /nfs/dbraw/zinc/18/65/47/340186547.db2.gz NKCOHNDLVALBAB-UHFFFAOYSA-N 1 2 324.877 4.561 20 0 DJADLO COc1ccc(Cl)cc1C[N@@H+](C)Cc1cnc(C(C)C)s1 ZINC000506137391 340186548 /nfs/dbraw/zinc/18/65/48/340186548.db2.gz NKCOHNDLVALBAB-UHFFFAOYSA-N 1 2 324.877 4.561 20 0 DJADLO COc1ccc([C@H](C)[N@H+](C)Cc2csc(C(C)(C)C)n2)cc1 ZINC000506328412 340192465 /nfs/dbraw/zinc/19/24/65/340192465.db2.gz XWUUTFHPLRLNOO-ZDUSSCGKSA-N 1 2 318.486 4.642 20 0 DJADLO COc1ccc([C@H](C)[N@@H+](C)Cc2csc(C(C)(C)C)n2)cc1 ZINC000506328412 340192466 /nfs/dbraw/zinc/19/24/66/340192466.db2.gz XWUUTFHPLRLNOO-ZDUSSCGKSA-N 1 2 318.486 4.642 20 0 DJADLO CC(C)n1cc(C[N@H+]([C@H](C)c2ccccc2Cl)C2CC2)cn1 ZINC000506614138 340197671 /nfs/dbraw/zinc/19/76/71/340197671.db2.gz UMRSXSIAHNQNOE-CQSZACIVSA-N 1 2 317.864 4.843 20 0 DJADLO CC(C)n1cc(C[N@@H+]([C@H](C)c2ccccc2Cl)C2CC2)cn1 ZINC000506614138 340197672 /nfs/dbraw/zinc/19/76/72/340197672.db2.gz UMRSXSIAHNQNOE-CQSZACIVSA-N 1 2 317.864 4.843 20 0 DJADLO C[C@H]1C[C@H]1c1ccc(C[N@H+](C)Cc2nc3ccccc3s2)o1 ZINC000506732216 340200275 /nfs/dbraw/zinc/20/02/75/340200275.db2.gz VBSFKJQQSGEWAH-GXTWGEPZSA-N 1 2 312.438 4.645 20 0 DJADLO C[C@H]1C[C@H]1c1ccc(C[N@@H+](C)Cc2nc3ccccc3s2)o1 ZINC000506732216 340200276 /nfs/dbraw/zinc/20/02/76/340200276.db2.gz VBSFKJQQSGEWAH-GXTWGEPZSA-N 1 2 312.438 4.645 20 0 DJADLO C[N@H+](Cc1nc2ccccc2[nH]1)Cc1ccc(Cl)c(Cl)c1 ZINC000506752360 340200939 /nfs/dbraw/zinc/20/09/39/340200939.db2.gz MQDZEQMKMGPWCZ-UHFFFAOYSA-N 1 2 320.223 4.502 20 0 DJADLO C[N@@H+](Cc1nc2ccccc2[nH]1)Cc1ccc(Cl)c(Cl)c1 ZINC000506752360 340200940 /nfs/dbraw/zinc/20/09/40/340200940.db2.gz MQDZEQMKMGPWCZ-UHFFFAOYSA-N 1 2 320.223 4.502 20 0 DJADLO C[N@H+](Cc1ccc2ncccc2c1)Cc1c(F)cccc1Cl ZINC000506774058 340201541 /nfs/dbraw/zinc/20/15/41/340201541.db2.gz FUUBFGXDJXVYSN-UHFFFAOYSA-N 1 2 314.791 4.659 20 0 DJADLO C[N@@H+](Cc1ccc2ncccc2c1)Cc1c(F)cccc1Cl ZINC000506774058 340201542 /nfs/dbraw/zinc/20/15/42/340201542.db2.gz FUUBFGXDJXVYSN-UHFFFAOYSA-N 1 2 314.791 4.659 20 0 DJADLO CN(CCCCCc1cc(-c2ccccc2)no1)c1cccc[nH+]1 ZINC000507015286 340205508 /nfs/dbraw/zinc/20/55/08/340205508.db2.gz OCJZRRGMUIDBNI-UHFFFAOYSA-N 1 2 321.424 4.586 20 0 DJADLO C[C@@H](c1cc(F)ccc1F)[N@H+](C)Cc1cccc(O)c1Cl ZINC000507190628 340212245 /nfs/dbraw/zinc/21/22/45/340212245.db2.gz DYHJDGNUSUGGBB-JTQLQIEISA-N 1 2 311.759 4.517 20 0 DJADLO C[C@@H](c1cc(F)ccc1F)[N@@H+](C)Cc1cccc(O)c1Cl ZINC000507190628 340212246 /nfs/dbraw/zinc/21/22/46/340212246.db2.gz DYHJDGNUSUGGBB-JTQLQIEISA-N 1 2 311.759 4.517 20 0 DJADLO Cc1ncsc1C[N@@H+](C)[C@H](C)c1ccc(Cl)cc1Cl ZINC000507241900 340215210 /nfs/dbraw/zinc/21/52/10/340215210.db2.gz BYUNIZWQVSSWPG-SNVBAGLBSA-N 1 2 315.269 4.951 20 0 DJADLO Cc1ncsc1C[N@H+](C)[C@H](C)c1ccc(Cl)cc1Cl ZINC000507241900 340215211 /nfs/dbraw/zinc/21/52/11/340215211.db2.gz BYUNIZWQVSSWPG-SNVBAGLBSA-N 1 2 315.269 4.951 20 0 DJADLO CSCc1cnc(C[N@H+](Cc2ccccc2F)C(C)C)s1 ZINC000507245341 340215278 /nfs/dbraw/zinc/21/52/78/340215278.db2.gz YUODKAFDEBCDBD-UHFFFAOYSA-N 1 2 324.490 4.556 20 0 DJADLO CSCc1cnc(C[N@@H+](Cc2ccccc2F)C(C)C)s1 ZINC000507245341 340215279 /nfs/dbraw/zinc/21/52/79/340215279.db2.gz YUODKAFDEBCDBD-UHFFFAOYSA-N 1 2 324.490 4.556 20 0 DJADLO CCc1cccnc1[C@H](C)[NH2+][C@H](c1nccs1)c1ccccc1 ZINC000507486780 340222324 /nfs/dbraw/zinc/22/23/24/340222324.db2.gz PHEQKVLHMPHTMI-KSSFIOAISA-N 1 2 323.465 4.541 20 0 DJADLO Fc1ccc2c(Nc3ccc(N4CCCCC4)nc3)cc[nH+]c2c1 ZINC000507607096 340225974 /nfs/dbraw/zinc/22/59/74/340225974.db2.gz PJMZECZIVKIJAA-UHFFFAOYSA-N 1 2 322.387 4.503 20 0 DJADLO Cc1cc2[nH+]cn([C@@H](C)c3nc(C(F)F)cs3)c2cc1C ZINC000507708528 340229062 /nfs/dbraw/zinc/22/90/62/340229062.db2.gz OETOKQLJCQTQFL-JTQLQIEISA-N 1 2 307.369 4.657 20 0 DJADLO Cc1cccc(NC(=O)c2ccccc2Oc2cc[nH+]cc2)c1C ZINC000509017597 340258397 /nfs/dbraw/zinc/25/83/97/340258397.db2.gz VFQGCXBMACUPHU-UHFFFAOYSA-N 1 2 318.376 4.743 20 0 DJADLO CC[N@H+](Cc1csc(C(C)C)n1)[C@@H](C)c1cccc(OC)c1 ZINC000516616581 340270007 /nfs/dbraw/zinc/27/00/07/340270007.db2.gz FIGCMGFZGFPADI-AWEZNQCLSA-N 1 2 318.486 4.858 20 0 DJADLO CC[N@@H+](Cc1csc(C(C)C)n1)[C@@H](C)c1cccc(OC)c1 ZINC000516616581 340270008 /nfs/dbraw/zinc/27/00/08/340270008.db2.gz FIGCMGFZGFPADI-AWEZNQCLSA-N 1 2 318.486 4.858 20 0 DJADLO c1ccc([C@H]2C[C@H]3CC[C@@H](C2)N3c2cc[nH+]c3ccncc32)cc1 ZINC000509480515 340271038 /nfs/dbraw/zinc/27/10/38/340271038.db2.gz RFHOANFWZKQQBN-BCDXTJNWSA-N 1 2 315.420 4.545 20 0 DJADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2cc(Cl)ccc2Cl)on1 ZINC000509825821 340280675 /nfs/dbraw/zinc/28/06/75/340280675.db2.gz HBLNOWVBVBRERU-CQSZACIVSA-N 1 2 311.212 4.627 20 0 DJADLO Cc1cc([C@H]2CCC[N@H+]2Cc2cc(Cl)ccc2Cl)on1 ZINC000509825821 340280676 /nfs/dbraw/zinc/28/06/76/340280676.db2.gz HBLNOWVBVBRERU-CQSZACIVSA-N 1 2 311.212 4.627 20 0 DJADLO C[C@H](c1ccco1)[N@H+](Cc1nc2c(s1)C[C@H](C)CC2)C1CC1 ZINC000511758618 340337449 /nfs/dbraw/zinc/33/74/49/340337449.db2.gz DRCBUJYVPHNJMF-CHWSQXEVSA-N 1 2 316.470 4.587 20 0 DJADLO C[C@H](c1ccco1)[N@@H+](Cc1nc2c(s1)C[C@H](C)CC2)C1CC1 ZINC000511758618 340337450 /nfs/dbraw/zinc/33/74/50/340337450.db2.gz DRCBUJYVPHNJMF-CHWSQXEVSA-N 1 2 316.470 4.587 20 0 DJADLO C[C@@H](c1ccco1)[N@H+](Cc1nc2c(s1)C[C@@H](C)CC2)C1CC1 ZINC000511758622 340337454 /nfs/dbraw/zinc/33/74/54/340337454.db2.gz DRCBUJYVPHNJMF-STQMWFEESA-N 1 2 316.470 4.587 20 0 DJADLO C[C@@H](c1ccco1)[N@@H+](Cc1nc2c(s1)C[C@@H](C)CC2)C1CC1 ZINC000511758622 340337455 /nfs/dbraw/zinc/33/74/55/340337455.db2.gz DRCBUJYVPHNJMF-STQMWFEESA-N 1 2 316.470 4.587 20 0 DJADLO C[C@@H](c1ccco1)[N@H+](Cc1nc2c(s1)C[C@H](C)CC2)C1CC1 ZINC000511758619 340337485 /nfs/dbraw/zinc/33/74/85/340337485.db2.gz DRCBUJYVPHNJMF-OLZOCXBDSA-N 1 2 316.470 4.587 20 0 DJADLO C[C@@H](c1ccco1)[N@@H+](Cc1nc2c(s1)C[C@H](C)CC2)C1CC1 ZINC000511758619 340337486 /nfs/dbraw/zinc/33/74/86/340337486.db2.gz DRCBUJYVPHNJMF-OLZOCXBDSA-N 1 2 316.470 4.587 20 0 DJADLO CSc1cccc(F)c1C[NH2+]Cc1ncc(C(C)(C)C)s1 ZINC000512511520 340364859 /nfs/dbraw/zinc/36/48/59/340364859.db2.gz IMOBTRJCTXXALW-UHFFFAOYSA-N 1 2 324.490 4.591 20 0 DJADLO Cc1ccc(C[NH+]2Cc3ccccc3-c3ccccc3C2)nc1 ZINC000513111696 340393821 /nfs/dbraw/zinc/39/38/21/340393821.db2.gz KKJGIRKDDHJFGS-UHFFFAOYSA-N 1 2 300.405 4.573 20 0 DJADLO CC[N@H+](Cc1ccc2ncccc2c1)Cc1c(F)cccc1F ZINC000513116644 340394020 /nfs/dbraw/zinc/39/40/20/340394020.db2.gz IVXCWHNBZYBNCV-UHFFFAOYSA-N 1 2 312.363 4.535 20 0 DJADLO CC[N@@H+](Cc1ccc2ncccc2c1)Cc1c(F)cccc1F ZINC000513116644 340394021 /nfs/dbraw/zinc/39/40/21/340394021.db2.gz IVXCWHNBZYBNCV-UHFFFAOYSA-N 1 2 312.363 4.535 20 0 DJADLO CSCc1cnc(C[N@H+](C)C/C(C)=C\c2ccccc2)s1 ZINC000513232863 340398576 /nfs/dbraw/zinc/39/85/76/340398576.db2.gz SQMDLFYBOYTFBT-ZROIWOOFSA-N 1 2 318.511 4.541 20 0 DJADLO CSCc1cnc(C[N@@H+](C)C/C(C)=C\c2ccccc2)s1 ZINC000513232863 340398577 /nfs/dbraw/zinc/39/85/77/340398577.db2.gz SQMDLFYBOYTFBT-ZROIWOOFSA-N 1 2 318.511 4.541 20 0 DJADLO C(=C/c1[nH+]ccn1Cc1ccccc1)\c1nc2ccccc2s1 ZINC000513477377 340409504 /nfs/dbraw/zinc/40/95/04/340409504.db2.gz RQQGLDNMDRMQJF-ZHACJKMWSA-N 1 2 317.417 4.712 20 0 DJADLO CC[C@@H]([NH2+][C@@H](C)c1noc(-c2ccccc2)n1)c1cccc(C)c1 ZINC000513659390 340417699 /nfs/dbraw/zinc/41/76/99/340417699.db2.gz BXRAWQOBNXRNIA-MAUKXSAKSA-N 1 2 321.424 4.847 20 0 DJADLO Clc1ccsc1C[NH2+][C@@H](c1ccco1)c1ccccc1 ZINC000192985405 340571268 /nfs/dbraw/zinc/57/12/68/340571268.db2.gz YDOLBFMTUCAFQA-MRXNPFEDSA-N 1 2 303.814 4.874 20 0 DJADLO Cc1cc(C)c(NC(=O)c2ccc(SC(C)C)cc2)c(C)[nH+]1 ZINC000193785288 340583038 /nfs/dbraw/zinc/58/30/38/340583038.db2.gz BUSJWWYKXNUHLY-UHFFFAOYSA-N 1 2 314.454 4.760 20 0 DJADLO Cc1cc(NC(=O)C[C@@H](C)c2ccc(C(F)(F)F)cc2)cc[nH+]1 ZINC000195648840 340584349 /nfs/dbraw/zinc/58/43/49/340584349.db2.gz KFRFBRXPYIEFQM-LLVKDONJSA-N 1 2 322.330 4.541 20 0 DJADLO O=C(CCC1CC1)Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000522312531 340598571 /nfs/dbraw/zinc/59/85/71/340598571.db2.gz DLNQUQVMHCZZLV-UHFFFAOYSA-N 1 2 316.788 4.656 20 0 DJADLO Clc1ccc2[nH+]cc(/C=C\c3ccc4ccccc4n3)n2c1 ZINC000523103889 340615506 /nfs/dbraw/zinc/61/55/06/340615506.db2.gz MVMOQJAXYRULST-HJWRWDBZSA-N 1 2 305.768 4.706 20 0 DJADLO CC[C@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1cccs1 ZINC000036983269 340726296 /nfs/dbraw/zinc/72/62/96/340726296.db2.gz SUMLYLRCMRAZAN-HNNXBMFYSA-N 1 2 301.459 4.697 20 0 DJADLO CC[C@H]([NH2+]Cc1noc(-c2ccccc2)n1)c1cc(C)ccc1C ZINC000528802457 340735112 /nfs/dbraw/zinc/73/51/12/340735112.db2.gz SWWAAJJOQYJFCY-SFHVURJKSA-N 1 2 321.424 4.594 20 0 DJADLO CCc1nc(C[NH2+][C@H](C)c2cc(Cl)ccc2Cl)cs1 ZINC000124054125 340796942 /nfs/dbraw/zinc/79/69/42/340796942.db2.gz XWGVCYNLBORZEB-SECBINFHSA-N 1 2 315.269 4.863 20 0 DJADLO Cc1cc(C)cc([C@@H](C)[NH2+][C@@H](C)c2noc(-c3ccccc3)n2)c1 ZINC000124252565 340797936 /nfs/dbraw/zinc/79/79/36/340797936.db2.gz QGUGVXBKHCSDPC-CVEARBPZSA-N 1 2 321.424 4.765 20 0 DJADLO CCSc1ccc(Cl)cc1NCc1[nH+]ccn1C(C)C ZINC000124398797 340798888 /nfs/dbraw/zinc/79/88/88/340798888.db2.gz DQXMDOWSWXWDPT-UHFFFAOYSA-N 1 2 309.866 4.842 20 0 DJADLO CCCc1noc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@H](C)CC)n1 ZINC000539288355 340879442 /nfs/dbraw/zinc/87/94/42/340879442.db2.gz YCTYIMGOHZEREF-PXAZEXFGSA-N 1 2 321.852 4.553 20 0 DJADLO CCCc1noc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@@H](C)CC)n1 ZINC000539288356 340879473 /nfs/dbraw/zinc/87/94/73/340879473.db2.gz YCTYIMGOHZEREF-SJCJKPOMSA-N 1 2 321.852 4.553 20 0 DJADLO CCC(CC)n1ccc(C[NH2+][C@H](C)c2c(F)cccc2Cl)n1 ZINC000539376841 340882936 /nfs/dbraw/zinc/88/29/36/340882936.db2.gz KFSMMVKCQWSVGT-GFCCVEGCSA-N 1 2 323.843 4.888 20 0 DJADLO CC(C)c1csc(C[NH2+][C@@H](C)c2ccc(F)cc2Cl)n1 ZINC000128576335 340898579 /nfs/dbraw/zinc/89/85/79/340898579.db2.gz XRUKZEDOVBYHNY-JTQLQIEISA-N 1 2 312.841 4.910 20 0 DJADLO C[C@@H]([NH2+]Cc1csc(C2CCCC2)n1)c1c(F)cccc1F ZINC000540325498 340927048 /nfs/dbraw/zinc/92/70/48/340927048.db2.gz UXUPGPYKZIVJHW-LLVKDONJSA-N 1 2 322.424 4.930 20 0 DJADLO c1cc(-c2ccccc2)oc1C[NH2+]Cc1ccn(C2CCCC2)n1 ZINC000129083747 340943837 /nfs/dbraw/zinc/94/38/37/340943837.db2.gz GWQAPROUDKODIA-UHFFFAOYSA-N 1 2 321.424 4.548 20 0 DJADLO FC(F)c1cccc(NCc2cccc3[nH+]ccn32)c1Cl ZINC000541760638 340982816 /nfs/dbraw/zinc/98/28/16/340982816.db2.gz LCPCISLZFIUQAD-UHFFFAOYSA-N 1 2 307.731 4.537 20 0 DJADLO CCc1cnccc1[C@@H](C)[NH2+][C@@H](C)c1ncc(-c2ccccc2)o1 ZINC000542124052 340995911 /nfs/dbraw/zinc/99/59/11/340995911.db2.gz SIJVGHGNXZLCDC-CABCVRRESA-N 1 2 321.424 4.711 20 0 DJADLO CCc1cnccc1[C@H](C)[NH2+][C@H](C)c1ncc(-c2ccccc2)o1 ZINC000542124055 340996143 /nfs/dbraw/zinc/99/61/43/340996143.db2.gz SIJVGHGNXZLCDC-LSDHHAIUSA-N 1 2 321.424 4.711 20 0 DJADLO CC(C)n1cc([C@@H](C)[NH2+][C@H](C)c2ncc(-c3ccccc3)o2)cn1 ZINC000542574402 341014259 /nfs/dbraw/zinc/01/42/59/341014259.db2.gz PDDYJGOSRNBJRR-HUUCEWRRSA-N 1 2 324.428 4.531 20 0 DJADLO Cc1cccn2c(CNc3cccc(C(F)F)c3Cl)c[nH+]c12 ZINC000542692644 341017405 /nfs/dbraw/zinc/01/74/05/341017405.db2.gz DMFKJVVNGQDLOP-UHFFFAOYSA-N 1 2 321.758 4.846 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1ccon1)c1cc(F)c(Cl)cc1Cl ZINC000542699560 341017430 /nfs/dbraw/zinc/01/74/30/341017430.db2.gz JHIHQUCFSWAXII-SFYZADRCSA-N 1 2 303.164 4.532 20 0 DJADLO CCc1cnc(C[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)s1 ZINC000130541194 341027261 /nfs/dbraw/zinc/02/72/61/341027261.db2.gz DOKBWXCWJHJZHA-VIFPVBQESA-N 1 2 315.269 4.863 20 0 DJADLO C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@H+](C)Cc1ccco1 ZINC000130631109 341034708 /nfs/dbraw/zinc/03/47/08/341034708.db2.gz PGCMGPHOGWMUSG-LBPRGKRZSA-N 1 2 316.788 4.781 20 0 DJADLO C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@@H+](C)Cc1ccco1 ZINC000130631109 341034709 /nfs/dbraw/zinc/03/47/09/341034709.db2.gz PGCMGPHOGWMUSG-LBPRGKRZSA-N 1 2 316.788 4.781 20 0 DJADLO CCc1ccc([C@H]2CCCC[N@@H+]2Cc2nc(C3CC3)cs2)o1 ZINC000543206132 341036752 /nfs/dbraw/zinc/03/67/52/341036752.db2.gz HSRDUBYUXPAPSK-MRXNPFEDSA-N 1 2 316.470 4.903 20 0 DJADLO CCc1ccc([C@H]2CCCC[N@H+]2Cc2nc(C3CC3)cs2)o1 ZINC000543206132 341036753 /nfs/dbraw/zinc/03/67/53/341036753.db2.gz HSRDUBYUXPAPSK-MRXNPFEDSA-N 1 2 316.470 4.903 20 0 DJADLO CCc1cnc(C[NH2+][C@H](C)c2cc(Cl)ccc2Cl)s1 ZINC000130656385 341037062 /nfs/dbraw/zinc/03/70/62/341037062.db2.gz RRXHDFJMTMAKOT-SECBINFHSA-N 1 2 315.269 4.863 20 0 DJADLO CC(C)c1cnc(C[N@@H+]2CCSC[C@H]2c2ccccc2)s1 ZINC000543395754 341042038 /nfs/dbraw/zinc/04/20/38/341042038.db2.gz UJYZDMOARVPTHX-HNNXBMFYSA-N 1 2 318.511 4.557 20 0 DJADLO CC(C)c1cnc(C[N@H+]2CCSC[C@H]2c2ccccc2)s1 ZINC000543395754 341042039 /nfs/dbraw/zinc/04/20/39/341042039.db2.gz UJYZDMOARVPTHX-HNNXBMFYSA-N 1 2 318.511 4.557 20 0 DJADLO Cc1ccc([C@@H](Nc2ccc(N3CCCC3)[nH+]c2)C2CCC2)o1 ZINC000543625985 341051748 /nfs/dbraw/zinc/05/17/48/341051748.db2.gz ROWDCOHFRSJIQC-IBGZPJMESA-N 1 2 311.429 4.537 20 0 DJADLO COCc1ccc([C@H]2CCC[N@@H+]2[C@@H](C)c2c(F)cccc2F)o1 ZINC000131000673 341056072 /nfs/dbraw/zinc/05/60/72/341056072.db2.gz RLCHTGYFKZBIIF-BLLLJJGKSA-N 1 2 321.367 4.602 20 0 DJADLO COCc1ccc([C@H]2CCC[N@H+]2[C@@H](C)c2c(F)cccc2F)o1 ZINC000131000673 341056073 /nfs/dbraw/zinc/05/60/73/341056073.db2.gz RLCHTGYFKZBIIF-BLLLJJGKSA-N 1 2 321.367 4.602 20 0 DJADLO C[C@H](c1ccc(Cl)cc1Cl)[N@H+](C)Cc1cncs1 ZINC000131212881 341065877 /nfs/dbraw/zinc/06/58/77/341065877.db2.gz VDLOKCFPNRGDPU-SECBINFHSA-N 1 2 301.242 4.643 20 0 DJADLO C[C@H](c1ccc(Cl)cc1Cl)[N@@H+](C)Cc1cncs1 ZINC000131212881 341065878 /nfs/dbraw/zinc/06/58/78/341065878.db2.gz VDLOKCFPNRGDPU-SECBINFHSA-N 1 2 301.242 4.643 20 0 DJADLO C[C@H](c1cccc(Cl)c1)[N@H+](C)Cc1nc(C2CC2)cs1 ZINC000544070362 341069020 /nfs/dbraw/zinc/06/90/20/341069020.db2.gz UOEHMJGYOHNKKL-LLVKDONJSA-N 1 2 306.862 4.867 20 0 DJADLO C[C@H](c1cccc(Cl)c1)[N@@H+](C)Cc1nc(C2CC2)cs1 ZINC000544070362 341069021 /nfs/dbraw/zinc/06/90/21/341069021.db2.gz UOEHMJGYOHNKKL-LLVKDONJSA-N 1 2 306.862 4.867 20 0 DJADLO CCOc1cc(C)ccc1C[NH2+][C@H](c1ccco1)c1ccccc1 ZINC000544358176 341078026 /nfs/dbraw/zinc/07/80/26/341078026.db2.gz BZTHPWGRKLQWEQ-NRFANRHFSA-N 1 2 321.420 4.866 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1ccccc1OCc1ccccc1)c1ccon1 ZINC000544607219 341088495 /nfs/dbraw/zinc/08/84/95/341088495.db2.gz RPZMSXNRKSKPFI-HZPDHXFCSA-N 1 2 322.408 4.665 20 0 DJADLO CC(C)CCc1noc(C[NH2+][C@@H](c2ccccc2)C(C)(C)C)n1 ZINC000072579550 341092257 /nfs/dbraw/zinc/09/22/57/341092257.db2.gz HJVYHQIECWTWKJ-SFHVURJKSA-N 1 2 315.461 4.535 20 0 DJADLO CC[N@H+](Cc1ncc(C)o1)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000072610813 341093629 /nfs/dbraw/zinc/09/36/29/341093629.db2.gz CWIYVCRGDRGKKK-HXUWFJFHSA-N 1 2 324.399 4.734 20 0 DJADLO CC[N@@H+](Cc1ncc(C)o1)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000072610813 341093630 /nfs/dbraw/zinc/09/36/30/341093630.db2.gz CWIYVCRGDRGKKK-HXUWFJFHSA-N 1 2 324.399 4.734 20 0 DJADLO Cc1nc(C(C)(C)[NH2+]Cc2c(F)cccc2Cl)sc1C ZINC000072866037 341109563 /nfs/dbraw/zinc/10/95/63/341109563.db2.gz WUVJDZNVSKWJNH-UHFFFAOYSA-N 1 2 312.841 4.577 20 0 DJADLO C[C@@H]([NH2+]Cc1cc(-c2cccs2)on1)c1ccc(F)cc1F ZINC000131954726 341114096 /nfs/dbraw/zinc/11/40/96/341114096.db2.gz VVDRWQDLUHZTAT-SNVBAGLBSA-N 1 2 320.364 4.532 20 0 DJADLO C[C@H]([NH2+][C@H](c1ccccc1)c1ccc(F)cc1)c1nccs1 ZINC000134218967 341209746 /nfs/dbraw/zinc/20/97/46/341209746.db2.gz QIVFZBBHGLVCLI-SUMWQHHRSA-N 1 2 312.413 4.722 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccc(F)cc1)c1nccs1 ZINC000134218947 341209778 /nfs/dbraw/zinc/20/97/78/341209778.db2.gz QIVFZBBHGLVCLI-DYVFJYSZSA-N 1 2 312.413 4.722 20 0 DJADLO Cc1cnc([C@H](C)[NH2+]Cc2c(Cl)oc3ccccc32)s1 ZINC000135537517 341241520 /nfs/dbraw/zinc/24/15/20/341241520.db2.gz OXQIGOUETHLLDA-JTQLQIEISA-N 1 2 306.818 4.702 20 0 DJADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2ccc(Cl)cc2F)n1 ZINC000548066218 341245460 /nfs/dbraw/zinc/24/54/60/341245460.db2.gz NXTZYFPWEBEMDH-KRWDZBQOSA-N 1 2 304.796 4.520 20 0 DJADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2ccc(Cl)cc2F)n1 ZINC000548066218 341245461 /nfs/dbraw/zinc/24/54/61/341245461.db2.gz NXTZYFPWEBEMDH-KRWDZBQOSA-N 1 2 304.796 4.520 20 0 DJADLO C[C@H]([NH2+][C@H](c1ccco1)c1ccccc1)c1ccc(F)c(F)c1 ZINC000078971166 341250940 /nfs/dbraw/zinc/25/09/40/341250940.db2.gz JZRJSUVGUJHABJ-DJJJIMSYSA-N 1 2 313.347 4.998 20 0 DJADLO CCCCc1noc([C@H](C)[NH2+][C@@H](C)c2cccc3ccccc32)n1 ZINC000079287791 341256288 /nfs/dbraw/zinc/25/62/88/341256288.db2.gz OJFHTFOWJBZDNJ-GJZGRUSLSA-N 1 2 323.440 4.977 20 0 DJADLO CC[C@@H](CSC)[NH2+][C@H](c1cccc(OC(C)C)c1)C(F)F ZINC000564359553 341278362 /nfs/dbraw/zinc/27/83/62/341278362.db2.gz VRNCXMBXYGLYRS-DZGCQCFKSA-N 1 2 317.445 4.511 20 0 DJADLO Cc1nocc1C[NH2+][C@H](c1ccsc1)c1ccc(Cl)cc1 ZINC000550110807 341310195 /nfs/dbraw/zinc/31/01/95/341310195.db2.gz SSVFQANYLQFOGC-INIZCTEOSA-N 1 2 318.829 4.577 20 0 DJADLO FCCCCC[N@@H+]1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000551387327 341340283 /nfs/dbraw/zinc/34/02/83/341340283.db2.gz DZIAQVYOEGTTJO-OAHLLOKOSA-N 1 2 320.235 4.507 20 0 DJADLO FCCCCC[N@H+]1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000551387327 341340284 /nfs/dbraw/zinc/34/02/84/341340284.db2.gz DZIAQVYOEGTTJO-OAHLLOKOSA-N 1 2 320.235 4.507 20 0 DJADLO CCn1ncc2ccc(N[C@H](c3[nH]cc[nH+]3)C3CCCCC3)cc21 ZINC000552071124 341367464 /nfs/dbraw/zinc/36/74/64/341367464.db2.gz QPWCTMXLRIGLOF-SFHVURJKSA-N 1 2 323.444 4.513 20 0 DJADLO Cc1nc(C[N@H+](Cc2ccccc2Cl)C2CCCC2)oc1C ZINC000552523120 341397460 /nfs/dbraw/zinc/39/74/60/341397460.db2.gz WVNCFERDMZGVFQ-UHFFFAOYSA-N 1 2 318.848 4.890 20 0 DJADLO Cc1nc(C[N@@H+](Cc2ccccc2Cl)C2CCCC2)oc1C ZINC000552523120 341397461 /nfs/dbraw/zinc/39/74/61/341397461.db2.gz WVNCFERDMZGVFQ-UHFFFAOYSA-N 1 2 318.848 4.890 20 0 DJADLO COc1ccccc1[C@@H]([NH2+][C@@H](C)c1ccco1)c1ccccc1 ZINC000089554955 341405632 /nfs/dbraw/zinc/40/56/32/341405632.db2.gz XLGUDGYSNBBHQV-YWZLYKJASA-N 1 2 307.393 4.728 20 0 DJADLO CC(C)Cc1noc(C[NH2+][C@H](CC(C)(C)C)c2ccccc2)n1 ZINC000552947299 341410146 /nfs/dbraw/zinc/41/01/46/341410146.db2.gz NPVJYPGEEDHERL-MRXNPFEDSA-N 1 2 315.461 4.535 20 0 DJADLO COC[C@H](Nc1cc[nH+]c2c(Cl)cccc12)c1ccc(C)o1 ZINC000553152541 341417977 /nfs/dbraw/zinc/41/79/77/341417977.db2.gz VYYRRWPXEMNFSQ-HNNXBMFYSA-N 1 2 316.788 4.589 20 0 DJADLO CSc1cc(CNc2cc[nH+]c3c(Cl)cccc23)ccn1 ZINC000553519087 341431088 /nfs/dbraw/zinc/43/10/88/341431088.db2.gz XZZSWIXVSZPYOV-UHFFFAOYSA-N 1 2 315.829 4.617 20 0 DJADLO CCc1cc(Nc2ccc3nc(C(F)F)sc3c2)nc(C)[nH+]1 ZINC000553728502 341434990 /nfs/dbraw/zinc/43/49/90/341434990.db2.gz BFJDCQLTCPKKMZ-UHFFFAOYSA-N 1 2 320.368 4.638 20 0 DJADLO CCc1noc(C)c1C[NH2+][C@H](C)c1cc(Cl)sc1Cl ZINC000556225998 341498160 /nfs/dbraw/zinc/49/81/60/341498160.db2.gz XTLPPNVZTHFTEJ-SSDOTTSWSA-N 1 2 319.257 4.765 20 0 DJADLO Cc1ccoc1C[NH2+][C@H](c1cccc(Cl)c1)c1ccccn1 ZINC000153326912 341535239 /nfs/dbraw/zinc/53/52/39/341535239.db2.gz YHBOINYJSVPWAU-GOSISDBHSA-N 1 2 312.800 4.516 20 0 DJADLO C[C@@H](c1noc([C@H](c2ccc(Cl)cc2)[NH+](C)C)n1)C(C)(C)C ZINC000576241288 341835734 /nfs/dbraw/zinc/83/57/34/341835734.db2.gz VVLDQNIGDLCMCS-FZMZJTMJSA-N 1 2 321.852 4.524 20 0 DJADLO CCCCc1nc(C[N@H+](C)[C@H](C)c2sc(C)nc2C)cs1 ZINC000106877680 521290495 /nfs/dbraw/zinc/29/04/95/521290495.db2.gz HOYJKIHBBXECJU-GFCCVEGCSA-N 1 2 323.531 4.752 20 0 DJADLO CCCCc1nc(C[N@@H+](C)[C@H](C)c2sc(C)nc2C)cs1 ZINC000106877680 521290501 /nfs/dbraw/zinc/29/05/01/521290501.db2.gz HOYJKIHBBXECJU-GFCCVEGCSA-N 1 2 323.531 4.752 20 0 DJADLO CCCc1occc1C(=O)Nc1ccc2[nH]c(C3CCC3)[nH+]c2c1 ZINC000336955285 521611172 /nfs/dbraw/zinc/61/11/72/521611172.db2.gz UXYRDCGBZXGROV-UHFFFAOYSA-N 1 2 323.396 4.628 20 0 DJADLO CC[C@](C)([NH2+]Cc1nc(C(C)(C)C)cs1)c1nc(C)cs1 ZINC000267971641 523490847 /nfs/dbraw/zinc/49/08/47/523490847.db2.gz BRJYPAAKOHJZKT-INIZCTEOSA-N 1 2 323.531 4.621 20 0 DJADLO CC[C@@](C)([NH2+]Cc1nc(C(C)(C)C)cs1)c1nc(C)cs1 ZINC000267971643 523659530 /nfs/dbraw/zinc/65/95/30/523659530.db2.gz BRJYPAAKOHJZKT-MRXNPFEDSA-N 1 2 323.531 4.621 20 0 DJADLO COc1ccc(C)cc1[C@H](C)[NH2+][C@H](C)c1ncc(C(C)(C)C)o1 ZINC000267050074 523859681 /nfs/dbraw/zinc/85/96/81/523859681.db2.gz OWKOSWAFMILIQF-UONOGXRCSA-N 1 2 316.445 4.701 20 0 DJADLO CO[C@H](C)c1nc(C[N@H+](C)[C@@H](C)c2ccc(C)cc2C)cs1 ZINC000267071716 523910806 /nfs/dbraw/zinc/91/08/06/523910806.db2.gz VVUOVNWALJDBNX-LSDHHAIUSA-N 1 2 318.486 4.660 20 0 DJADLO CO[C@H](C)c1nc(C[N@@H+](C)[C@@H](C)c2ccc(C)cc2C)cs1 ZINC000267071716 523910815 /nfs/dbraw/zinc/91/08/15/523910815.db2.gz VVUOVNWALJDBNX-LSDHHAIUSA-N 1 2 318.486 4.660 20 0 DJADLO C[C@@H]([NH2+]Cc1ccc(Cl)cn1)c1cc(Cl)sc1Cl ZINC000182125210 525523753 /nfs/dbraw/zinc/52/37/53/525523753.db2.gz VTLKKWHRFQUZKX-SSDOTTSWSA-N 1 2 321.660 4.954 20 0 DJADLO Cc1ccc([C@@H]([NH2+][C@H](C)c2ccccc2F)c2ccccn2)cc1 ZINC000366425612 525775497 /nfs/dbraw/zinc/77/54/97/525775497.db2.gz CPYILRJLHROOAK-IIBYNOLFSA-N 1 2 320.411 4.969 20 0 DJADLO Cc1cnc(C[NH2+][C@H](c2ccc(F)cc2F)C(C)(C)C)s1 ZINC000181619751 526047838 /nfs/dbraw/zinc/04/78/38/526047838.db2.gz GONOEHQPGZOYID-OAHLLOKOSA-N 1 2 310.413 4.607 20 0 DJADLO c1coc(C[NH+](Cc2ccco2)Cc2cnc3ccccc3c2)c1 ZINC000337143980 526565554 /nfs/dbraw/zinc/56/55/54/526565554.db2.gz ZEDIEWIQQPLVNU-UHFFFAOYSA-N 1 2 318.376 4.623 20 0 DJADLO Clc1ccc(C2([NH2+]Cc3ncc(C4CC4)o3)CC2)cc1Cl ZINC000270464961 526941568 /nfs/dbraw/zinc/94/15/68/526941568.db2.gz BCPWDSWXSRHTOI-UHFFFAOYSA-N 1 2 323.223 4.638 20 0 DJADLO CCCCC[C@@H](C)CC(=O)N1CCCC[C@@H]1c1[nH+]ccn1CC ZINC000366646851 535111704 /nfs/dbraw/zinc/11/17/04/535111704.db2.gz IEVOKOLXVKKALC-IAGOWNOFSA-N 1 2 319.493 4.563 20 0 DJADLO CC(C)[C@@H]([NH2+][C@@H](C)c1cscn1)c1ccc(Cl)cc1F ZINC000272711490 535225825 /nfs/dbraw/zinc/22/58/25/535225825.db2.gz BEJIMAJRFQWFTP-ZUZCIYMTSA-N 1 2 312.841 4.984 20 0 DJADLO CCn1cc[nH+]c1[C@H](C)Nc1ccc(-c2nc(C)cs2)cc1 ZINC000296235003 536125092 /nfs/dbraw/zinc/12/50/92/536125092.db2.gz AORQBBNWXTTXNV-ZDUSSCGKSA-N 1 2 312.442 4.508 20 0 DJADLO C[C@@H]([NH2+]Cc1coc(-c2ccccc2)n1)c1ccccc1Cl ZINC000096955180 185393903 /nfs/dbraw/zinc/39/39/03/185393903.db2.gz XWULTPHHMARQAL-CYBMUJFWSA-N 1 2 312.800 4.846 20 0 DJADLO COc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1nc(C2CC2)cs1 ZINC000090458860 185297538 /nfs/dbraw/zinc/29/75/38/185297538.db2.gz QWIIJNYRZFFTSU-JTQLQIEISA-N 1 2 322.861 4.533 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1nccs1)c1ccc(Cl)cc1Cl ZINC000080266464 192019190 /nfs/dbraw/zinc/01/91/90/192019190.db2.gz SNPALJDCTMNOPT-BDAKNGLRSA-N 1 2 301.242 4.862 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1nc2c(s1)CCCC2)c1ccc(F)cc1F ZINC000093369058 193239250 /nfs/dbraw/zinc/23/92/50/193239250.db2.gz DIIXXZAAMGVLQU-MNOVXSKESA-N 1 2 322.424 4.712 20 0 DJADLO Cc1nc(C[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)cs1 ZINC000021024461 182261403 /nfs/dbraw/zinc/26/14/03/182261403.db2.gz SHQTYPZDDUNRJK-QMMMGPOBSA-N 1 2 301.242 4.609 20 0 DJADLO C[C@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1c(F)cccc1Cl ZINC000271773905 129957607 /nfs/dbraw/zinc/95/76/07/129957607.db2.gz JEFWEQPIHXCOQB-LBPRGKRZSA-N 1 2 321.827 4.642 20 0 DJADLO COc1ccc(C)cc1[C@@H](C)[NH2+][C@@H](C)c1nc2ccccc2o1 ZINC000272139604 130002405 /nfs/dbraw/zinc/00/24/05/130002405.db2.gz ZLERYLLDUNWNBM-KGLIPLIRSA-N 1 2 310.397 4.557 20 0 DJADLO CCn1cc([C@H](C)[NH2+]C2(c3c(Cl)cccc3Cl)CC2)cn1 ZINC000272152873 130003651 /nfs/dbraw/zinc/00/36/51/130003651.db2.gz ARSMFDSWTDBIBR-NSHDSACASA-N 1 2 324.255 4.550 20 0 DJADLO CC(C)[C@H]([NH2+]Cc1ncc(C2CC2)o1)c1ccc(Cl)cc1F ZINC000272829968 130067695 /nfs/dbraw/zinc/06/76/95/130067695.db2.gz GRLDFEJWOVUQBV-KRWDZBQOSA-N 1 2 322.811 4.831 20 0 DJADLO Cc1nnc([C@H](C)[NH2+][C@H](C)c2ccc(-c3ccccc3)o2)s1 ZINC000274288441 130223909 /nfs/dbraw/zinc/22/39/09/130223909.db2.gz ZUFHGFFDQGGDQR-NEPJUHHUSA-N 1 2 313.426 4.518 20 0 DJADLO Cc1cc([C@H](C)[NH2+][C@@H](C)c2nc(C(F)(F)F)cs2)c(C)o1 ZINC000274544214 130244336 /nfs/dbraw/zinc/24/43/36/130244336.db2.gz CGNUYPOCEVOABP-IUCAKERBSA-N 1 2 318.364 4.784 20 0 DJADLO Cc1cc([C@@H](C)[NH2+]Cc2c(OC(C)C)ccc3ccccc32)no1 ZINC000282674955 130935069 /nfs/dbraw/zinc/93/50/69/130935069.db2.gz JJBDUSAXGPVKPW-OAHLLOKOSA-N 1 2 324.424 4.774 20 0 DJADLO C[C@H]([NH2+][C@@H](c1ccccc1)C1CC1)c1noc(-c2ccccc2)n1 ZINC000283959803 131036103 /nfs/dbraw/zinc/03/61/03/131036103.db2.gz DWKWKIZVSBWPBV-KSSFIOAISA-N 1 2 319.408 4.539 20 0 DJADLO CCc1nnc(C[N@H+](CC(C)C)[C@H](C)c2ccccc2Cl)o1 ZINC000284339187 131071411 /nfs/dbraw/zinc/07/14/11/131071411.db2.gz CCNABOLCAMOKKM-CYBMUJFWSA-N 1 2 321.852 4.505 20 0 DJADLO CCc1nnc(C[N@@H+](CC(C)C)[C@H](C)c2ccccc2Cl)o1 ZINC000284339187 131071413 /nfs/dbraw/zinc/07/14/13/131071413.db2.gz CCNABOLCAMOKKM-CYBMUJFWSA-N 1 2 321.852 4.505 20 0 DJADLO Cc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2csc(C3CC3)n2)o1 ZINC000340194200 131121906 /nfs/dbraw/zinc/12/19/06/131121906.db2.gz GKFJEXQPBITTOA-MLGOLLRUSA-N 1 2 316.470 4.895 20 0 DJADLO Cc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2csc(C3CC3)n2)o1 ZINC000340194200 131121907 /nfs/dbraw/zinc/12/19/07/131121907.db2.gz GKFJEXQPBITTOA-MLGOLLRUSA-N 1 2 316.470 4.895 20 0 DJADLO CCCCC[C@H](C)CC(=O)N1CCCC[C@@H]1c1[nH+]ccn1CC ZINC000366646850 131267066 /nfs/dbraw/zinc/26/70/66/131267066.db2.gz IEVOKOLXVKKALC-DLBZAZTESA-N 1 2 319.493 4.563 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N(Cc1ccccc1)[C@H](C)C1CC1 ZINC000287625359 131291179 /nfs/dbraw/zinc/29/11/79/131291179.db2.gz UKTUNHHUEZLQSW-MRXNPFEDSA-N 1 2 323.440 4.531 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)[C@@H](C)c1cccc(Cl)c1 ZINC000287637412 131292209 /nfs/dbraw/zinc/29/22/09/131292209.db2.gz VKWTZSCYWMBXQJ-ZDUSSCGKSA-N 1 2 317.820 4.577 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)[C@@H](C)c1ccccc1Cl ZINC000287642596 131292263 /nfs/dbraw/zinc/29/22/63/131292263.db2.gz VVMXPJRITPZUHJ-ZDUSSCGKSA-N 1 2 317.820 4.577 20 0 DJADLO CC[C@H](c1ccccc1)N(CC)C(=O)Nc1c(C)cc[nH+]c1C ZINC000287672304 131294524 /nfs/dbraw/zinc/29/45/24/131294524.db2.gz XTISEEXDINMDFL-QGZVFWFLSA-N 1 2 311.429 4.704 20 0 DJADLO C[C@@H]([NH2+][C@H]1C[C@@H](C)n2ccnc21)c1ccc(Cl)cc1Cl ZINC000296327248 131956466 /nfs/dbraw/zinc/95/64/66/131956466.db2.gz GCEYPPMDNIXIQE-RULNRJAQSA-N 1 2 310.228 4.547 20 0 DJADLO Cc1cc(SC(C)(C)C)ccc1N[C@@H]1CCn2cc[nH+]c21 ZINC000296358227 131957659 /nfs/dbraw/zinc/95/76/59/131957659.db2.gz HVDOIZWBXYEZOM-OAHLLOKOSA-N 1 2 301.459 4.639 20 0 DJADLO C[C@H]([NH2+][C@@H]1C[C@H](C)n2ccnc21)c1cccc(Cl)c1Cl ZINC000297490351 132018831 /nfs/dbraw/zinc/01/88/31/132018831.db2.gz BIINRWXFOQPHFP-OUJBWJOFSA-N 1 2 310.228 4.547 20 0 DJADLO Cc1[nH+]c(C(C)C)ccc1CNc1ccc([C@@H]2CCOC2)cc1 ZINC000297603724 132024859 /nfs/dbraw/zinc/02/48/59/132024859.db2.gz ICUTUHMNIPXWEQ-GOSISDBHSA-N 1 2 310.441 4.629 20 0 DJADLO C[C@@H]1C[C@H]([NH2+][C@H](c2ccc(F)cc2F)C(C)(C)C)c2nccn21 ZINC000297948337 132041171 /nfs/dbraw/zinc/04/11/71/132041171.db2.gz YMQPRCVHGUQJJK-XFBWCDHKSA-N 1 2 319.399 4.544 20 0 DJADLO Cc1cccc(NCc2c[nH+]cn2Cc2ccccc2)c1Cl ZINC000525872177 335082852 /nfs/dbraw/zinc/08/28/52/335082852.db2.gz HFLLEHDZBDEFCU-UHFFFAOYSA-N 1 2 311.816 4.505 20 0 DJADLO CC(C)Oc1ccc([C@H](C)[NH2+]Cc2cc(C(C)(C)C)on2)cc1 ZINC000574945474 332858031 /nfs/dbraw/zinc/85/80/31/332858031.db2.gz KSDTVXNEEPSVFX-AWEZNQCLSA-N 1 2 316.445 4.610 20 0 DJADLO Cc1cnc([C@@H](C)[NH2+]Cc2ccc(-c3ccc(F)cc3)o2)s1 ZINC000175859204 332910993 /nfs/dbraw/zinc/91/09/93/332910993.db2.gz NOYQXXABHCTARF-GFCCVEGCSA-N 1 2 316.401 4.701 20 0 DJADLO Cc1ccc(C)c([C@H]([NH2+]Cc2ncccc2F)c2ccccc2)c1 ZINC000530530893 331574883 /nfs/dbraw/zinc/57/48/83/331574883.db2.gz RFTPTMIKPYFJLS-OAQYLSRUSA-N 1 2 320.411 4.717 20 0 DJADLO Fc1ccc([C@H]2CCCN2c2cc(C(F)(F)F)cc[nH+]2)cc1 ZINC000530934161 331637334 /nfs/dbraw/zinc/63/73/34/331637334.db2.gz BLCXBWMVQHSYCG-CQSZACIVSA-N 1 2 310.294 4.581 20 0 DJADLO Fc1ccc([C@@H]2CCCN2c2cc(C(F)(F)F)cc[nH+]2)cc1 ZINC000530934159 331637357 /nfs/dbraw/zinc/63/73/57/331637357.db2.gz BLCXBWMVQHSYCG-AWEZNQCLSA-N 1 2 310.294 4.581 20 0 DJADLO Cc1cc(C)c(NC(=O)[C@@H]2CC[C@H]3CCCC[C@@H]3C2)c(C)[nH+]1 ZINC000533757917 331683229 /nfs/dbraw/zinc/68/32/29/331683229.db2.gz ZSUQTSAOIJLORN-BRWVUGGUSA-N 1 2 300.446 4.552 20 0 DJADLO C[C@@H]([NH2+]C(c1cccs1)c1cccs1)c1nccs1 ZINC000080268544 331684107 /nfs/dbraw/zinc/68/41/07/331684107.db2.gz RRCVSCIQFRDYHB-SNVBAGLBSA-N 1 2 306.481 4.706 20 0 DJADLO Clc1cnc(C[NH2+]C2(c3ccc(Cl)cc3)CCC2)s1 ZINC000556409680 331701574 /nfs/dbraw/zinc/70/15/74/331701574.db2.gz ZRTZNCUZBSYKKE-UHFFFAOYSA-N 1 2 313.253 4.619 20 0 DJADLO CC(C)(C)c1cc(C[NH2+]C2(c3ccc(Cl)cc3)CCC2)no1 ZINC000558476178 331911154 /nfs/dbraw/zinc/91/11/54/331911154.db2.gz QPKZHUQAVDPCSA-UHFFFAOYSA-N 1 2 318.848 4.795 20 0 DJADLO CCc1nc([C@@H](C)[NH2+][C@H](C)c2cc(F)c(F)c(F)c2)cs1 ZINC000162341287 332934842 /nfs/dbraw/zinc/93/48/42/332934842.db2.gz QZIXDALOEUHLCS-RKDXNWHRSA-N 1 2 314.376 4.535 20 0 DJADLO Fc1ccc2c(cc[nH+]c2N2CCC(CC(F)(F)F)CC2)c1 ZINC000566148312 331995641 /nfs/dbraw/zinc/99/56/41/331995641.db2.gz AQSNTWYIBBKILF-UHFFFAOYSA-N 1 2 312.310 4.543 20 0 DJADLO C[C@@H](c1c(F)cccc1F)[N@H+](C)Cc1cnc2ccccc2c1 ZINC000410342515 332113188 /nfs/dbraw/zinc/11/31/88/332113188.db2.gz KTXHRWDOTFGYAY-ZDUSSCGKSA-N 1 2 312.363 4.706 20 0 DJADLO C[C@@H](c1c(F)cccc1F)[N@@H+](C)Cc1cnc2ccccc2c1 ZINC000410342515 332113190 /nfs/dbraw/zinc/11/31/90/332113190.db2.gz KTXHRWDOTFGYAY-ZDUSSCGKSA-N 1 2 312.363 4.706 20 0 DJADLO Cc1ccc(CCCCC(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC000520092817 332124674 /nfs/dbraw/zinc/12/46/74/332124674.db2.gz ZQYJYAMOPWNGRF-UHFFFAOYSA-N 1 2 310.441 4.667 20 0 DJADLO CCCc1csc(C[N@@H+]2CCC[C@H]2c2ccc(CC)o2)n1 ZINC000426417875 332147376 /nfs/dbraw/zinc/14/73/76/332147376.db2.gz UOVJGKONMPGNAQ-HNNXBMFYSA-N 1 2 304.459 4.588 20 0 DJADLO CCCc1csc(C[N@H+]2CCC[C@H]2c2ccc(CC)o2)n1 ZINC000426417875 332147377 /nfs/dbraw/zinc/14/73/77/332147377.db2.gz UOVJGKONMPGNAQ-HNNXBMFYSA-N 1 2 304.459 4.588 20 0 DJADLO Cc1nc([C@H]2CCC[N@@H+]2Cc2ccc(Cl)cc2C)cs1 ZINC000426792002 332154210 /nfs/dbraw/zinc/15/42/10/332154210.db2.gz KSNRMWRXGQIAMW-MRXNPFEDSA-N 1 2 306.862 4.750 20 0 DJADLO Cc1nc([C@H]2CCC[N@H+]2Cc2ccc(Cl)cc2C)cs1 ZINC000426792002 332154211 /nfs/dbraw/zinc/15/42/11/332154211.db2.gz KSNRMWRXGQIAMW-MRXNPFEDSA-N 1 2 306.862 4.750 20 0 DJADLO CCc1ccc([C@@H](COC)[NH2+][C@@H](C)c2csc(Cl)c2)o1 ZINC000191308559 332172661 /nfs/dbraw/zinc/17/26/61/332172661.db2.gz SGWBBEALGSAOSK-GXFFZTMASA-N 1 2 313.850 4.595 20 0 DJADLO Cc1ccc2nc(C[NH2+][C@H](C)c3cc4ccc(C)cc4o3)[nH]c2c1 ZINC000426059065 335094620 /nfs/dbraw/zinc/09/46/20/335094620.db2.gz DBVANGIGSYAWGW-CQSZACIVSA-N 1 2 319.408 4.777 20 0 DJADLO CC[C@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1ccsc1 ZINC000394306014 332346151 /nfs/dbraw/zinc/34/61/51/332346151.db2.gz VDKQZABIFRHBPB-INIZCTEOSA-N 1 2 301.459 4.697 20 0 DJADLO Cc1sccc1CNc1cccc(-c2[nH+]cc3n2CCCC3)c1 ZINC000582126214 332349768 /nfs/dbraw/zinc/34/97/68/332349768.db2.gz VMTOQMNQCUJFAF-UHFFFAOYSA-N 1 2 323.465 4.868 20 0 DJADLO C[C@H](Nc1ccc(CCCc2ccccc2)cc1)c1[nH]cc[nH+]1 ZINC000560548985 332357178 /nfs/dbraw/zinc/35/71/78/332357178.db2.gz LPVSKKPRZQIKOF-INIZCTEOSA-N 1 2 305.425 4.758 20 0 DJADLO CCc1ccc(N[C@@H](c2[nH]cc[nH+]2)c2ccccc2)cc1Cl ZINC000560580600 332364367 /nfs/dbraw/zinc/36/43/67/332364367.db2.gz KZPIKGMEVMJPQZ-QGZVFWFLSA-N 1 2 311.816 4.827 20 0 DJADLO CC[C@H](c1ccncc1)[N@H+](C)Cc1csc(-c2ccccc2)n1 ZINC000560638865 332372129 /nfs/dbraw/zinc/37/21/29/332372129.db2.gz TWFUHOCZVNQVDG-GOSISDBHSA-N 1 2 323.465 4.788 20 0 DJADLO CC[C@H](c1ccncc1)[N@@H+](C)Cc1csc(-c2ccccc2)n1 ZINC000560638865 332372130 /nfs/dbraw/zinc/37/21/30/332372130.db2.gz TWFUHOCZVNQVDG-GOSISDBHSA-N 1 2 323.465 4.788 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)CCc1cc(Cl)cc(Cl)c1 ZINC000425586451 335107182 /nfs/dbraw/zinc/10/71/82/335107182.db2.gz KYEAYPLTBSRKDL-UHFFFAOYSA-N 1 2 323.223 4.577 20 0 DJADLO Fc1c(Cl)cccc1C[NH2+][C@H](c1ccco1)c1ccccc1 ZINC000318330622 332678898 /nfs/dbraw/zinc/67/88/98/332678898.db2.gz SGZPASZPSHXCNI-SFHVURJKSA-N 1 2 315.775 4.951 20 0 DJADLO Cc1ccccc1-c1cnc(C[NH2+]C(C)(C)c2ccccc2F)o1 ZINC000570113893 332713910 /nfs/dbraw/zinc/71/39/10/332713910.db2.gz FHROPNZGIOSMPT-UHFFFAOYSA-N 1 2 324.399 4.814 20 0 DJADLO C[C@H]([NH2+]Cc1nc2ccccc2s1)c1c(F)cccc1Cl ZINC000181730695 333031577 /nfs/dbraw/zinc/03/15/77/333031577.db2.gz GOFDOZZGEYQYMC-JTQLQIEISA-N 1 2 320.820 4.940 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1ccco1)c1ccccc1)c1cccc(F)c1F ZINC000183212610 333053066 /nfs/dbraw/zinc/05/30/66/333053066.db2.gz GWFRMRKUGSFRSK-BFUOFWGJSA-N 1 2 313.347 4.998 20 0 DJADLO Cc1oncc1C[N@@H+]1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000188848279 333056917 /nfs/dbraw/zinc/05/69/17/333056917.db2.gz ZFDPCCAJMCJNET-HNNXBMFYSA-N 1 2 311.212 4.627 20 0 DJADLO Cc1oncc1C[N@H+]1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000188848279 333056919 /nfs/dbraw/zinc/05/69/19/333056919.db2.gz ZFDPCCAJMCJNET-HNNXBMFYSA-N 1 2 311.212 4.627 20 0 DJADLO Cc1cccc(C)c1C[NH2+][C@@H](C)c1nc(C2CCCCC2)no1 ZINC000185258776 335122947 /nfs/dbraw/zinc/12/29/47/335122947.db2.gz UNCXNSRCULAXSZ-HNNXBMFYSA-N 1 2 313.445 4.585 20 0 DJADLO Fc1ccccc1C1CC[NH+](Cc2csc(C3CC3)n2)CC1 ZINC000533934334 333217756 /nfs/dbraw/zinc/21/77/56/333217756.db2.gz PRSSDIPPWFJIMT-UHFFFAOYSA-N 1 2 316.445 4.539 20 0 DJADLO CCCOc1c(Cl)cc(CNc2cccc[nH+]2)cc1OCC ZINC000019777762 333245698 /nfs/dbraw/zinc/24/56/98/333245698.db2.gz OYSONPKSKXGJBP-UHFFFAOYSA-N 1 2 320.820 4.535 20 0 DJADLO C[C@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1ccccc1F ZINC000119585704 333255577 /nfs/dbraw/zinc/25/55/77/333255577.db2.gz PPIWRINQWWAJNZ-YWZLYKJASA-N 1 2 306.384 4.661 20 0 DJADLO Cc1nc([C@H](C)[N@@H+]2CC[C@@](C)(F)C2)oc1-c1ccc(Cl)cc1 ZINC000501422764 333273411 /nfs/dbraw/zinc/27/34/11/333273411.db2.gz NJCACWOSCGRVDD-YVEFUNNKSA-N 1 2 322.811 4.798 20 0 DJADLO Cc1nc([C@H](C)[N@H+]2CC[C@@](C)(F)C2)oc1-c1ccc(Cl)cc1 ZINC000501422764 333273413 /nfs/dbraw/zinc/27/34/13/333273413.db2.gz NJCACWOSCGRVDD-YVEFUNNKSA-N 1 2 322.811 4.798 20 0 DJADLO COc1ccccc1[C@@H](C)[NH2+][C@@H](c1ccco1)c1ccccc1 ZINC000120217704 333276262 /nfs/dbraw/zinc/27/62/62/333276262.db2.gz YMOUWFSKHHDDNF-FOIQADDNSA-N 1 2 307.393 4.728 20 0 DJADLO CC(C)[C@@H]([NH2+]Cc1c(F)cccc1Cl)c1ccc(F)cn1 ZINC000497822325 333296962 /nfs/dbraw/zinc/29/69/62/333296962.db2.gz WXLKSBRGHLQUSK-MRXNPFEDSA-N 1 2 310.775 4.500 20 0 DJADLO Cc1nc(C[N@@H+](C)[C@@H](c2ccccc2Cl)C(C)C)cs1 ZINC000525785670 333311751 /nfs/dbraw/zinc/31/17/51/333311751.db2.gz DKDGEUNKCPKKGY-MRXNPFEDSA-N 1 2 308.878 4.934 20 0 DJADLO Cc1nc(C[N@H+](C)[C@@H](c2ccccc2Cl)C(C)C)cs1 ZINC000525785670 333311753 /nfs/dbraw/zinc/31/17/53/333311753.db2.gz DKDGEUNKCPKKGY-MRXNPFEDSA-N 1 2 308.878 4.934 20 0 DJADLO FC(F)Oc1ccc[nH+]c1NCc1cc2ccccc2s1 ZINC000463250894 333364697 /nfs/dbraw/zinc/36/46/97/333364697.db2.gz RVGTXMYNTSOXOT-UHFFFAOYSA-N 1 2 306.337 4.510 20 0 DJADLO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2Cl)s1 ZINC000274262767 333486006 /nfs/dbraw/zinc/48/60/06/333486006.db2.gz VDPYUJPANUPRKC-JGVFFNPUSA-N 1 2 316.257 4.565 20 0 DJADLO CCc1ccc(C[NH2+][C@@H](c2ccccc2)c2ccccc2OC)o1 ZINC000531611927 333538041 /nfs/dbraw/zinc/53/80/41/333538041.db2.gz WLVSRWDEDQQCTB-NRFANRHFSA-N 1 2 321.420 4.730 20 0 DJADLO CCOc1cccc2cc([C@@H](C)[NH2+][C@@H](C)c3cscn3)oc21 ZINC000534329664 333577653 /nfs/dbraw/zinc/57/76/53/333577653.db2.gz VQUGQURMPWAUMP-NWDGAFQWSA-N 1 2 316.426 4.700 20 0 DJADLO Cc1ccc(C(=O)N2[C@H](C)CCC2(C)C)cc1Oc1cc[nH+]cc1 ZINC000411094913 333632814 /nfs/dbraw/zinc/63/28/14/333632814.db2.gz XUHVCMSJXQVAGC-OAHLLOKOSA-N 1 2 324.424 4.585 20 0 DJADLO CC[C@@H](Sc1ccccc1)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000414792883 334098565 /nfs/dbraw/zinc/09/85/65/334098565.db2.gz RVXNSIKVJOOQFV-MRXNPFEDSA-N 1 2 314.454 4.516 20 0 DJADLO CC[C@@H]([NH2+][C@H](C)c1noc(-c2ccccc2)n1)c1ccsc1 ZINC000296686045 334235894 /nfs/dbraw/zinc/23/58/94/334235894.db2.gz GVXRHCHHELQQHB-IUODEOHRSA-N 1 2 313.426 4.600 20 0 DJADLO Cc1cnc(C[N@@H+](CC(C)C)[C@H](C)c2ccccc2Cl)nc1 ZINC000580339283 334266068 /nfs/dbraw/zinc/26/60/68/334266068.db2.gz REPYFHDTCUXZRN-OAHLLOKOSA-N 1 2 317.864 4.658 20 0 DJADLO Cc1cnc(C[N@H+](CC(C)C)[C@H](C)c2ccccc2Cl)nc1 ZINC000580339283 334266069 /nfs/dbraw/zinc/26/60/69/334266069.db2.gz REPYFHDTCUXZRN-OAHLLOKOSA-N 1 2 317.864 4.658 20 0 DJADLO FC(F)(F)C[C@H]([NH2+]Cc1nc2ccccc2o1)c1ccccc1 ZINC000341583305 334458280 /nfs/dbraw/zinc/45/82/80/334458280.db2.gz CYYVBHAGVOBJEP-AWEZNQCLSA-N 1 2 320.314 4.611 20 0 DJADLO CCC[C@H]([NH2+]Cc1nc(C)sc1C)c1ccc(F)cc1F ZINC000342294973 334525839 /nfs/dbraw/zinc/52/58/39/334525839.db2.gz OQPYEDRTQCUKRV-HNNXBMFYSA-N 1 2 310.413 4.669 20 0 DJADLO Cc1ccc(NC(=O)N2CCC[C@@H]2c2ccc(C)c(C)c2)c(C)[nH+]1 ZINC000152296077 334741097 /nfs/dbraw/zinc/74/10/97/334741097.db2.gz BREXUIHDTOJHSE-LJQANCHMSA-N 1 2 323.440 4.684 20 0 DJADLO Cc1cccc(CN(Cc2ccco2)Cc2c[nH+]cn2C(C)C)c1 ZINC000425332314 334802536 /nfs/dbraw/zinc/80/25/36/334802536.db2.gz YUUVKWDCWKFYHJ-UHFFFAOYSA-N 1 2 323.440 4.568 20 0 DJADLO Clc1ccc(C2=CCN(c3cc[nH+]c4ccncc43)CC2)cc1 ZINC000444081193 338468022 /nfs/dbraw/zinc/46/80/22/338468022.db2.gz DRSCCOHCSIBJGP-UHFFFAOYSA-N 1 2 321.811 4.577 20 0 DJADLO Cc1noc(C)c1[C@H](C)CNc1cc(C)[nH+]c2c(F)cccc12 ZINC000129433439 334908862 /nfs/dbraw/zinc/90/88/62/334908862.db2.gz UWHRHJLOABYSFB-SNVBAGLBSA-N 1 2 313.376 4.503 20 0 DJADLO C[C@H]1Cc2cc(F)ccc2[C@H](C)[N@@H+]1Cc1nc(C2CC2)cs1 ZINC000343744975 335190079 /nfs/dbraw/zinc/19/00/79/335190079.db2.gz VWIBRRIUFARYHI-RYUDHWBXSA-N 1 2 316.445 4.667 20 0 DJADLO C[C@H]1Cc2cc(F)ccc2[C@H](C)[N@H+]1Cc1nc(C2CC2)cs1 ZINC000343744975 335190081 /nfs/dbraw/zinc/19/00/81/335190081.db2.gz VWIBRRIUFARYHI-RYUDHWBXSA-N 1 2 316.445 4.667 20 0 DJADLO COc1cccc2cc([C@@H](C)[NH2+][C@@H](C)c3csc(C)n3)oc21 ZINC000344099350 335218062 /nfs/dbraw/zinc/21/80/62/335218062.db2.gz KCMQBJCODPESFH-WDEREUQCSA-N 1 2 316.426 4.618 20 0 DJADLO FC(F)(F)C[C@H]([NH2+]Cc1ncc(Cl)s1)c1ccccc1 ZINC000349667000 335690261 /nfs/dbraw/zinc/69/02/61/335690261.db2.gz LMJXLYOCJPBRAM-JTQLQIEISA-N 1 2 320.767 4.580 20 0 DJADLO C[C@H]([NH2+][C@H]1CCCc2c(Cl)sc(Cl)c21)c1ccon1 ZINC000349835539 335704921 /nfs/dbraw/zinc/70/49/21/335704921.db2.gz QHVWIECHXSHRLO-XVKPBYJWSA-N 1 2 317.241 4.771 20 0 DJADLO CC(C)(C)c1cnc(C[NH2+][C@H](c2ccc(F)cc2)C(C)(C)C)o1 ZINC000097079379 335839401 /nfs/dbraw/zinc/83/94/01/335839401.db2.gz GWXDMSQEMVYMCQ-QGZVFWFLSA-N 1 2 318.436 4.988 20 0 DJADLO CC[C@@H]([NH2+][C@@H](C)c1cscn1)c1cc(Cl)ccc1OC ZINC000519833117 335899077 /nfs/dbraw/zinc/89/90/77/335899077.db2.gz MSNQHJCJZQNYSN-GXFFZTMASA-N 1 2 310.850 4.607 20 0 DJADLO Cc1c[nH]c(-c2ccccc2NC(=O)C[C@@H]2CCC[C@H](C)C2)[nH+]1 ZINC000331707829 336145190 /nfs/dbraw/zinc/14/51/90/336145190.db2.gz BRILVWMBKBPIIT-DZGCQCFKSA-N 1 2 311.429 4.540 20 0 DJADLO Cc1cnc([C@@H](C)[NH2+][C@H](C)c2ccc(Oc3cccnc3)cc2)o1 ZINC000352250479 336206825 /nfs/dbraw/zinc/20/68/25/336206825.db2.gz OADHVIRNXLORPK-HUUCEWRRSA-N 1 2 323.396 4.582 20 0 DJADLO CCc1ccc([C@H](COC)[NH2+][C@@H](CC)c2ccc(F)cc2F)o1 ZINC000532524541 336254221 /nfs/dbraw/zinc/25/42/21/336254221.db2.gz DXRMYCLCJGFEEP-IRXDYDNUSA-N 1 2 323.383 4.549 20 0 DJADLO CC(C)c1ccc([C@@H](C)CC(=O)Nc2cccc3[nH+]ccn32)cc1 ZINC000460334947 336259981 /nfs/dbraw/zinc/25/99/81/336259981.db2.gz LYDHESMMVCWSCS-HNNXBMFYSA-N 1 2 321.424 4.590 20 0 DJADLO CC[C@H](c1ccc(F)cc1F)[N@H+](C)Cc1nc2ccccc2o1 ZINC000532749123 336269635 /nfs/dbraw/zinc/26/96/35/336269635.db2.gz NUSKJNUYLMDIIP-MRXNPFEDSA-N 1 2 316.351 4.689 20 0 DJADLO CC[C@H](c1ccc(F)cc1F)[N@@H+](C)Cc1nc2ccccc2o1 ZINC000532749123 336269636 /nfs/dbraw/zinc/26/96/36/336269636.db2.gz NUSKJNUYLMDIIP-MRXNPFEDSA-N 1 2 316.351 4.689 20 0 DJADLO C[C@@H](CCC(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1)c1ccccc1 ZINC000532756553 336269919 /nfs/dbraw/zinc/26/99/19/336269919.db2.gz DIMHTKYDMDWNBA-HNNXBMFYSA-N 1 2 319.408 4.599 20 0 DJADLO Cc1c[nH]c(-c2ccccc2NC(=O)C[C@H]2CCCC[C@@H]2C)[nH+]1 ZINC000532862001 336273335 /nfs/dbraw/zinc/27/33/35/336273335.db2.gz KBGWQDVLCLFYID-DZGCQCFKSA-N 1 2 311.429 4.540 20 0 DJADLO Cc1cc(N[C@@H](C)c2nc(C(C)(C)C)cs2)nc(C(C)C)[nH+]1 ZINC000301197032 336294447 /nfs/dbraw/zinc/29/44/47/336294447.db2.gz OJHZISWPTXYLGC-LBPRGKRZSA-N 1 2 318.490 4.836 20 0 DJADLO c1cc2c(ncnc2Nc2cccc(Oc3cc[nH+]cc3)c2)s1 ZINC000301219977 336295441 /nfs/dbraw/zinc/29/54/41/336295441.db2.gz AAHRENDHKOPVFV-UHFFFAOYSA-N 1 2 320.377 4.622 20 0 DJADLO Cc1ccc([C@@H](C)Nc2nc(-c3ccncc3)[nH+]c(C)c2C)s1 ZINC000301302220 336299901 /nfs/dbraw/zinc/29/99/01/336299901.db2.gz YDHVWZTVITVLFI-CQSZACIVSA-N 1 2 324.453 4.698 20 0 DJADLO c1ccc2[nH+]c(NCc3ccc(-c4cccnc4)cc3)ccc2c1 ZINC000301464284 336308536 /nfs/dbraw/zinc/30/85/36/336308536.db2.gz WEQZKNVRYWGJGN-UHFFFAOYSA-N 1 2 311.388 4.909 20 0 DJADLO CC[C@@H](Nc1cc(C(F)(F)F)cc[nH+]1)c1ccc(OC)cc1 ZINC000301603439 336317880 /nfs/dbraw/zinc/31/78/80/336317880.db2.gz XCYWJWUQMSVNLQ-CQSZACIVSA-N 1 2 310.319 4.672 20 0 DJADLO Cc1cccc([C@@H]2CCCN2c2cc(C(C)C)[nH+]c(C(C)C)n2)n1 ZINC000301872726 336335387 /nfs/dbraw/zinc/33/53/87/336335387.db2.gz QFESXCHIIQGIHW-SFHVURJKSA-N 1 2 324.472 4.768 20 0 DJADLO Cc1cc(N2C[C@H](C)C[C@H]2c2cccnc2)c2cccc(F)c2[nH+]1 ZINC000302134660 336350104 /nfs/dbraw/zinc/35/01/04/336350104.db2.gz LWYGQEMETXNMJB-ACJLOTCBSA-N 1 2 321.399 4.665 20 0 DJADLO Cc1cc(N2C[C@@H](C)C[C@H]2c2cccnc2)c2cccc(F)c2[nH+]1 ZINC000302134666 336350110 /nfs/dbraw/zinc/35/01/10/336350110.db2.gz LWYGQEMETXNMJB-UGSOOPFHSA-N 1 2 321.399 4.665 20 0 DJADLO COc1cccc2c(N3CCC[C@H]3c3cccs3)cc[nH+]c12 ZINC000302483498 336359725 /nfs/dbraw/zinc/35/97/25/336359725.db2.gz XACRBOKWWYUAOB-HNNXBMFYSA-N 1 2 310.422 4.646 20 0 DJADLO CC(C)c1nc(N2CCC[C@@H]2c2ccncc2)cc(C(C)(C)C)[nH+]1 ZINC000302771995 336368413 /nfs/dbraw/zinc/36/84/13/336368413.db2.gz CLESAPIQBUOAJH-MRXNPFEDSA-N 1 2 324.472 4.634 20 0 DJADLO CC[C@H](Nc1cc(C(C)(C)C)[nH+]c(C(C)C)n1)c1nccs1 ZINC000302893924 336373513 /nfs/dbraw/zinc/37/35/13/336373513.db2.gz OLHPBRONAXWXIO-LBPRGKRZSA-N 1 2 318.490 4.917 20 0 DJADLO CCc1nc([C@@H](C)Nc2[nH+]ccc3ccc(F)cc32)cs1 ZINC000354327090 336467012 /nfs/dbraw/zinc/46/70/12/336467012.db2.gz GFXDXFSLSOXTMT-SNVBAGLBSA-N 1 2 301.390 4.566 20 0 DJADLO c1sc(CNc2cccc[nH+]2)nc1-c1cc2ccccc2o1 ZINC000355735628 336520477 /nfs/dbraw/zinc/52/04/77/336520477.db2.gz FENCCUPLWONDGL-UHFFFAOYSA-N 1 2 307.378 4.563 20 0 DJADLO Cc1ccc(NC(=O)C[C@@H]2C[C@H](C)c3c2cccc3C)c(C)[nH+]1 ZINC000362649275 336807808 /nfs/dbraw/zinc/80/78/08/336807808.db2.gz PMARLZNSQMGPOK-BBRMVZONSA-N 1 2 308.425 4.626 20 0 DJADLO Cc1ccc(NC(=O)c2cccc3c2ccn3CC(C)C)c(C)[nH+]1 ZINC000362739378 336810426 /nfs/dbraw/zinc/81/04/26/336810426.db2.gz ACAAYYSUAJHWFS-UHFFFAOYSA-N 1 2 321.424 4.561 20 0 DJADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1sccc1C1CC1 ZINC000373668417 336968299 /nfs/dbraw/zinc/96/82/99/336968299.db2.gz NKYFMUXBQXNOND-UHFFFAOYSA-N 1 2 323.421 4.576 20 0 DJADLO FC(F)(F)c1ncc(C[N@@H+]2CCC[C@@H]2c2cccs2)s1 ZINC000375716785 337017675 /nfs/dbraw/zinc/01/76/75/337017675.db2.gz DEVHXGRJZREGNB-SNVBAGLBSA-N 1 2 318.389 4.561 20 0 DJADLO FC(F)(F)c1ncc(C[N@H+]2CCC[C@@H]2c2cccs2)s1 ZINC000375716785 337017676 /nfs/dbraw/zinc/01/76/76/337017676.db2.gz DEVHXGRJZREGNB-SNVBAGLBSA-N 1 2 318.389 4.561 20 0 DJADLO Cc1cccc([C@@H]([NH2+][C@@H](C)c2cc(C)ccn2)c2ccccn2)c1 ZINC000375811374 337020127 /nfs/dbraw/zinc/02/01/27/337020127.db2.gz WGGNVDOXXDFYCR-LAUBAEHRSA-N 1 2 317.436 4.534 20 0 DJADLO Fc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H](c1nccs1)c1ccccc1 ZINC000123072882 337035221 /nfs/dbraw/zinc/03/52/21/337035221.db2.gz OORZQLDIAOBXFI-ZWKOTPCHSA-N 1 2 324.424 4.649 20 0 DJADLO Cc1nc([C@H](C)[NH2+][C@H]2CCCOc3c(Cl)cccc32)cs1 ZINC000378449048 337073152 /nfs/dbraw/zinc/07/31/52/337073152.db2.gz FFFHOGDNTWMSOY-HZMBPMFUSA-N 1 2 322.861 4.669 20 0 DJADLO CCCc1cccc(C(C)C)c1NC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000582610451 337113565 /nfs/dbraw/zinc/11/35/65/337113565.db2.gz XOVRBWMFAQNPSE-HNNXBMFYSA-N 1 2 313.445 4.549 20 0 DJADLO Cc1ccoc1C[N@H+](C)Cc1cnc(C2CCCCC2)s1 ZINC000582650115 337120782 /nfs/dbraw/zinc/12/07/82/337120782.db2.gz VWHUISHRTBTHNV-UHFFFAOYSA-N 1 2 304.459 4.724 20 0 DJADLO Cc1ccoc1C[N@@H+](C)Cc1cnc(C2CCCCC2)s1 ZINC000582650115 337120783 /nfs/dbraw/zinc/12/07/83/337120783.db2.gz VWHUISHRTBTHNV-UHFFFAOYSA-N 1 2 304.459 4.724 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1ccco1)c1ccccc1)c1ccc(Cl)nc1 ZINC000179098035 337167064 /nfs/dbraw/zinc/16/70/64/337167064.db2.gz YEIRKQGEFCEAEZ-FZKQIMNGSA-N 1 2 312.800 4.768 20 0 DJADLO CC[C@H]([NH2+]Cc1ncc(-c2ccccc2)cn1)c1ccc(F)cc1 ZINC000185825775 337250517 /nfs/dbraw/zinc/25/05/17/337250517.db2.gz UMIXDWGNCJMWTK-IBGZPJMESA-N 1 2 321.399 4.524 20 0 DJADLO Cc1cc([C@@H](C)[NH2+][C@H](c2ccccc2)c2ccccn2)c(C)o1 ZINC000321410178 337262487 /nfs/dbraw/zinc/26/24/87/337262487.db2.gz BEVSQTNBMNIQKR-FOIQADDNSA-N 1 2 306.409 4.732 20 0 DJADLO Cc1cccc2c1OCC[C@H]2[NH2+][C@H](C)c1csc(C(C)C)n1 ZINC000189370159 337278980 /nfs/dbraw/zinc/27/89/80/337278980.db2.gz WNSGZDUBZYTXGM-UKRRQHHQSA-N 1 2 316.470 4.749 20 0 DJADLO Cc1nc([C@@H]2CCC[N@H+]2Cc2ccc([C@@H]3C[C@@H]3C)o2)cs1 ZINC000189924621 337283790 /nfs/dbraw/zinc/28/37/90/337283790.db2.gz LAOGZMQQDXUOIA-PEYYIBSZSA-N 1 2 302.443 4.505 20 0 DJADLO Cc1nc([C@@H]2CCC[N@@H+]2Cc2ccc([C@@H]3C[C@@H]3C)o2)cs1 ZINC000189924621 337283791 /nfs/dbraw/zinc/28/37/91/337283791.db2.gz LAOGZMQQDXUOIA-PEYYIBSZSA-N 1 2 302.443 4.505 20 0 DJADLO C[C@@H]([NH2+][C@H](c1nccs1)c1ccccc1)c1cccs1 ZINC000123143688 337397890 /nfs/dbraw/zinc/39/78/90/337397890.db2.gz KXYOITISSQAVBT-DOMZBBRYSA-N 1 2 300.452 4.645 20 0 DJADLO CC[C@@H]([NH2+]Cc1nc(C(C)C)cs1)c1cc(F)ccc1F ZINC000128577682 337425825 /nfs/dbraw/zinc/42/58/25/337425825.db2.gz XNOVRNNNGYOZQG-CQSZACIVSA-N 1 2 310.413 4.786 20 0 DJADLO Cc1[nH+]c(C(C)C)ccc1CSCc1nc(C(C)(C)C)no1 ZINC000419385769 337483412 /nfs/dbraw/zinc/48/34/12/337483412.db2.gz OKDCGBMMKHRXHA-UHFFFAOYSA-N 1 2 319.474 4.627 20 0 DJADLO Cc1ccc(CSCc2ncccc2C(F)(F)F)c(C)[nH+]1 ZINC000432237712 337537250 /nfs/dbraw/zinc/53/72/50/337537250.db2.gz JOZXYUHAQBLUPH-UHFFFAOYSA-N 1 2 312.360 4.546 20 0 DJADLO COc1cc(C)[nH+]c(CNc2ccc(-c3ccccc3)cc2)c1 ZINC000322167041 337574648 /nfs/dbraw/zinc/57/46/48/337574648.db2.gz NJPGQHPDUVZOGB-UHFFFAOYSA-N 1 2 304.393 4.678 20 0 DJADLO COc1cc(Cl)ccc1[C@H](C)[NH2+]Cc1nc(C(C)C)cs1 ZINC000421841501 337653488 /nfs/dbraw/zinc/65/34/88/337653488.db2.gz JBHXIBPOJRPBQP-NSHDSACASA-N 1 2 324.877 4.779 20 0 DJADLO Cc1nc(C(C)C)sc1[C@H](C)Nc1ccc2c(c1)CC[NH2+]2 ZINC000423214620 337704795 /nfs/dbraw/zinc/70/47/95/337704795.db2.gz LMTMRMQTJJRBIR-NSHDSACASA-N 1 2 301.459 4.716 20 0 DJADLO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2ccc(OC)cc2Cl)cs1 ZINC000424327706 337821673 /nfs/dbraw/zinc/82/16/73/337821673.db2.gz ZIGZWFYSZNKELF-WDEREUQCSA-N 1 2 324.877 4.779 20 0 DJADLO CCc1nc(C[NH2+][C@H](c2ccc([C@H](C)CC)cc2)C(C)C)no1 ZINC000533334316 337842633 /nfs/dbraw/zinc/84/26/33/337842633.db2.gz UYJMJSUNJVSIBJ-KUHUBIRLSA-N 1 2 315.461 4.632 20 0 DJADLO CCCCc1noc(C[NH2+][C@H](CC(C)C)c2ccccc2C)n1 ZINC000537058613 337883131 /nfs/dbraw/zinc/88/31/31/337883131.db2.gz MULYHHFVCIFXMB-QGZVFWFLSA-N 1 2 315.461 4.598 20 0 DJADLO Cc1ccc([C@H](C)[NH2+][C@@H](c2cccc(F)c2)c2ccccn2)o1 ZINC000090955816 337887481 /nfs/dbraw/zinc/88/74/81/337887481.db2.gz ACISVRXJKFDLOP-LIRRHRJNSA-N 1 2 310.372 4.562 20 0 DJADLO C[C@@H]([NH2+][C@H](c1cccc(F)c1)c1ccccn1)c1cccc(F)c1 ZINC000090956408 337887489 /nfs/dbraw/zinc/88/74/89/337887489.db2.gz BPDFFHGMTCCMPW-JLTOFOAXSA-N 1 2 324.374 4.800 20 0 DJADLO C[C@H]([NH2+][C@H](c1cccc(F)c1)c1ccccn1)c1ccccc1F ZINC000090956219 337887508 /nfs/dbraw/zinc/88/75/08/337887508.db2.gz VUCFGVVKKBWUGN-VBKZILBWSA-N 1 2 324.374 4.800 20 0 DJADLO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2ncc(-c3ccccc3)s2)o1 ZINC000537749039 337960571 /nfs/dbraw/zinc/96/05/71/337960571.db2.gz WDFVOHCBTHHFGR-XJKSGUPXSA-N 1 2 324.449 4.816 20 0 DJADLO Cc1nc([C@@H](C)[NH2+]C(c2ccccc2)c2ccccc2)cs1 ZINC000315381566 337985929 /nfs/dbraw/zinc/98/59/29/337985929.db2.gz DNAYDRAPHQCLFS-CQSZACIVSA-N 1 2 308.450 4.892 20 0 DJADLO CC(C)Oc1cccc([C@@H]([NH2+]CCCC(C)(F)F)C(F)F)c1 ZINC000516194000 338006566 /nfs/dbraw/zinc/00/65/66/338006566.db2.gz VJXZXIIWKFDHRH-CQSZACIVSA-N 1 2 321.358 4.805 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)C[C@H](C)Cc1ccc(Cl)cc1 ZINC000425598679 338015925 /nfs/dbraw/zinc/01/59/25/338015925.db2.gz XEQATWJIKYTVHO-GFCCVEGCSA-N 1 2 316.832 4.559 20 0 DJADLO Cc1ccoc1C[NH2+][C@@H](c1cc2ccccc2o1)c1cccnc1 ZINC000426332958 338027609 /nfs/dbraw/zinc/02/76/09/338027609.db2.gz SSPIBABNOLPHAK-HXUWFJFHSA-N 1 2 318.376 4.608 20 0 DJADLO CCCc1csc(C[N@H+](C)[C@@H](C)c2sc(CC)nc2C)n1 ZINC000426416320 338031341 /nfs/dbraw/zinc/03/13/41/338031341.db2.gz HOSXYPQKZPRXSG-LBPRGKRZSA-N 1 2 323.531 4.616 20 0 DJADLO CCCc1csc(C[N@@H+](C)[C@@H](C)c2sc(CC)nc2C)n1 ZINC000426416320 338031342 /nfs/dbraw/zinc/03/13/42/338031342.db2.gz HOSXYPQKZPRXSG-LBPRGKRZSA-N 1 2 323.531 4.616 20 0 DJADLO CCCc1csc(C[N@H+](C)Cc2cccc(OC(C)C)c2)n1 ZINC000426420544 338031574 /nfs/dbraw/zinc/03/15/74/338031574.db2.gz MBQAROFVKFLXNI-UHFFFAOYSA-N 1 2 318.486 4.515 20 0 DJADLO CCCc1csc(C[N@@H+](C)Cc2cccc(OC(C)C)c2)n1 ZINC000426420544 338031575 /nfs/dbraw/zinc/03/15/75/338031575.db2.gz MBQAROFVKFLXNI-UHFFFAOYSA-N 1 2 318.486 4.515 20 0 DJADLO C[C@H]([NH2+]Cc1nc2ccc(F)cc2s1)c1ccc(F)cc1F ZINC000428857186 338062688 /nfs/dbraw/zinc/06/26/88/338062688.db2.gz RISPGPIRSTXLHI-VIFPVBQESA-N 1 2 322.355 4.564 20 0 DJADLO CC(C)([NH2+]Cc1ncc(-c2ccccc2)o1)c1ccccc1F ZINC000429244666 338074558 /nfs/dbraw/zinc/07/45/58/338074558.db2.gz LRDJOMZFRSHBHP-UHFFFAOYSA-N 1 2 310.372 4.506 20 0 DJADLO C[C@@H]1CC[N@H+](Cc2cc(C(C)(C)C)on2)[C@@H](c2ccco2)C1 ZINC000429700217 338087617 /nfs/dbraw/zinc/08/76/17/338087617.db2.gz ZBYJLJOQHFLNBT-UKRRQHHQSA-N 1 2 302.418 4.538 20 0 DJADLO C[C@@H]1CC[N@@H+](Cc2cc(C(C)(C)C)on2)[C@@H](c2ccco2)C1 ZINC000429700217 338087618 /nfs/dbraw/zinc/08/76/18/338087618.db2.gz ZBYJLJOQHFLNBT-UKRRQHHQSA-N 1 2 302.418 4.538 20 0 DJADLO C[C@H]1CC[N@H+](Cc2cc(C(C)(C)C)on2)[C@H](c2ccco2)C1 ZINC000429700219 338087632 /nfs/dbraw/zinc/08/76/32/338087632.db2.gz ZBYJLJOQHFLNBT-ZFWWWQNUSA-N 1 2 302.418 4.538 20 0 DJADLO C[C@H]1CC[N@@H+](Cc2cc(C(C)(C)C)on2)[C@H](c2ccco2)C1 ZINC000429700219 338087633 /nfs/dbraw/zinc/08/76/33/338087633.db2.gz ZBYJLJOQHFLNBT-ZFWWWQNUSA-N 1 2 302.418 4.538 20 0 DJADLO C[C@H]1CC[N@H+](Cc2cc(C(C)(C)C)on2)[C@@H](c2ccco2)C1 ZINC000429700213 338087702 /nfs/dbraw/zinc/08/77/02/338087702.db2.gz ZBYJLJOQHFLNBT-DZGCQCFKSA-N 1 2 302.418 4.538 20 0 DJADLO C[C@H]1CC[N@@H+](Cc2cc(C(C)(C)C)on2)[C@@H](c2ccco2)C1 ZINC000429700213 338087703 /nfs/dbraw/zinc/08/77/03/338087703.db2.gz ZBYJLJOQHFLNBT-DZGCQCFKSA-N 1 2 302.418 4.538 20 0 DJADLO C[C@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1cccc(Cl)c1 ZINC000429809934 338090441 /nfs/dbraw/zinc/09/04/41/338090441.db2.gz NVBLFKOLROZJPW-QMMMGPOBSA-N 1 2 317.713 4.747 20 0 DJADLO CC(C)CCn1cccc1C[N@@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000430096727 338096341 /nfs/dbraw/zinc/09/63/41/338096341.db2.gz AXLZACVWQVFDIF-IBGZPJMESA-N 1 2 311.473 4.512 20 0 DJADLO CC(C)CCn1cccc1C[N@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000430096727 338096342 /nfs/dbraw/zinc/09/63/42/338096342.db2.gz AXLZACVWQVFDIF-IBGZPJMESA-N 1 2 311.473 4.512 20 0 DJADLO C[C@]12CC[N@H+](Cc3ccc(F)c(Cl)c3Cl)C[C@H]1C2(F)F ZINC000430106604 338096982 /nfs/dbraw/zinc/09/69/82/338096982.db2.gz RRVTTZCXRMOCIP-MFKMUULPSA-N 1 2 324.173 4.610 20 0 DJADLO C[C@]12CC[N@@H+](Cc3ccc(F)c(Cl)c3Cl)C[C@H]1C2(F)F ZINC000430106604 338096983 /nfs/dbraw/zinc/09/69/83/338096983.db2.gz RRVTTZCXRMOCIP-MFKMUULPSA-N 1 2 324.173 4.610 20 0 DJADLO C[C@@]12CC[N@H+](Cc3ccc(F)c(Cl)c3Cl)C[C@@H]1C2(F)F ZINC000430106603 338097126 /nfs/dbraw/zinc/09/71/26/338097126.db2.gz RRVTTZCXRMOCIP-GXFFZTMASA-N 1 2 324.173 4.610 20 0 DJADLO C[C@@]12CC[N@@H+](Cc3ccc(F)c(Cl)c3Cl)C[C@@H]1C2(F)F ZINC000430106603 338097127 /nfs/dbraw/zinc/09/71/27/338097127.db2.gz RRVTTZCXRMOCIP-GXFFZTMASA-N 1 2 324.173 4.610 20 0 DJADLO Clc1scc(C[NH2+]Cc2nc(C3CC3)cs2)c1Cl ZINC000432251349 338150985 /nfs/dbraw/zinc/15/09/85/338150985.db2.gz ALKPKULANFWVNB-UHFFFAOYSA-N 1 2 319.282 4.679 20 0 DJADLO C[C@H](c1ccccn1)[N@H+](C)Cc1csc(Cl)c1Cl ZINC000432915976 338172920 /nfs/dbraw/zinc/17/29/20/338172920.db2.gz GJBDREPLTVLUJN-SECBINFHSA-N 1 2 301.242 4.643 20 0 DJADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1csc(Cl)c1Cl ZINC000432915976 338172921 /nfs/dbraw/zinc/17/29/21/338172921.db2.gz GJBDREPLTVLUJN-SECBINFHSA-N 1 2 301.242 4.643 20 0 DJADLO C[C@@H]([NH2+]Cc1cc(F)c(Cl)cc1F)c1ccc(Cl)cn1 ZINC000433086840 338180998 /nfs/dbraw/zinc/18/09/98/338180998.db2.gz GEOZWRHOYMZKLJ-MRVPVSSYSA-N 1 2 317.166 4.517 20 0 DJADLO CC(C)[C@H]([NH2+][C@H](C)c1nc(C2CC2)no1)c1ccc(Cl)cc1 ZINC000433782599 338201700 /nfs/dbraw/zinc/20/17/00/338201700.db2.gz JRVOOSAUDDFRCB-ABAIWWIYSA-N 1 2 319.836 4.648 20 0 DJADLO Fc1ccc(C[N@@H+]2CCCC[C@H]2c2cccc(Cl)c2)nc1 ZINC000434513086 338219084 /nfs/dbraw/zinc/21/90/84/338219084.db2.gz YSDWIKKHSUMOMZ-KRWDZBQOSA-N 1 2 304.796 4.601 20 0 DJADLO Fc1ccc(C[N@H+]2CCCC[C@H]2c2cccc(Cl)c2)nc1 ZINC000434513086 338219085 /nfs/dbraw/zinc/21/90/85/338219085.db2.gz YSDWIKKHSUMOMZ-KRWDZBQOSA-N 1 2 304.796 4.601 20 0 DJADLO CC(C)C[C@H]1CCCC[N@@H+]1Cc1ncc(C(F)(F)F)s1 ZINC000435124263 338232523 /nfs/dbraw/zinc/23/25/23/338232523.db2.gz NNXUVOKMBWDYQQ-LLVKDONJSA-N 1 2 306.397 4.563 20 0 DJADLO CC(C)C[C@H]1CCCC[N@H+]1Cc1ncc(C(F)(F)F)s1 ZINC000435124263 338232524 /nfs/dbraw/zinc/23/25/24/338232524.db2.gz NNXUVOKMBWDYQQ-LLVKDONJSA-N 1 2 306.397 4.563 20 0 DJADLO Cc1ccc([C@H](C)[N@H+](C)Cc2ncc(C(F)(F)F)s2)cc1 ZINC000435134216 338232826 /nfs/dbraw/zinc/23/28/26/338232826.db2.gz GHQTZEIFTMRSLO-NSHDSACASA-N 1 2 314.376 4.663 20 0 DJADLO Cc1ccc([C@H](C)[N@@H+](C)Cc2ncc(C(F)(F)F)s2)cc1 ZINC000435134216 338232827 /nfs/dbraw/zinc/23/28/27/338232827.db2.gz GHQTZEIFTMRSLO-NSHDSACASA-N 1 2 314.376 4.663 20 0 DJADLO Cc1ccc2[nH+]c(CSc3nc(-c4ccccc4)co3)cn2c1 ZINC000436248067 338263471 /nfs/dbraw/zinc/26/34/71/338263471.db2.gz RRBRLIFLHXMPNR-UHFFFAOYSA-N 1 2 321.405 4.590 20 0 DJADLO Cc1cc(C)c(NC(=O)N[C@H](C)c2ccccc2Cl)c(C)[nH+]1 ZINC000436489012 338274050 /nfs/dbraw/zinc/27/40/50/338274050.db2.gz FCIMBKCJZSWSEW-GFCCVEGCSA-N 1 2 317.820 4.543 20 0 DJADLO C[C@H](c1cccnc1)[N@@H+]1CCc2cc(Cl)cc(Cl)c2C1 ZINC000437507966 338312034 /nfs/dbraw/zinc/31/20/34/338312034.db2.gz XOMZAFBLIDAJGW-LLVKDONJSA-N 1 2 307.224 4.508 20 0 DJADLO C[C@H](c1cccnc1)[N@H+]1CCc2cc(Cl)cc(Cl)c2C1 ZINC000437507966 338312035 /nfs/dbraw/zinc/31/20/35/338312035.db2.gz XOMZAFBLIDAJGW-LLVKDONJSA-N 1 2 307.224 4.508 20 0 DJADLO CCCCc1nc(C[N@H+](CCC(F)(F)F)CC2CC2)cs1 ZINC000437527598 338312685 /nfs/dbraw/zinc/31/26/85/338312685.db2.gz OCKOQDVNKXROKN-UHFFFAOYSA-N 1 2 320.424 4.650 20 0 DJADLO CCCCc1nc(C[N@@H+](CCC(F)(F)F)CC2CC2)cs1 ZINC000437527598 338312686 /nfs/dbraw/zinc/31/26/86/338312686.db2.gz OCKOQDVNKXROKN-UHFFFAOYSA-N 1 2 320.424 4.650 20 0 DJADLO c1[nH+]cn(Cc2ccccc2)c1COc1cccc2ccccc21 ZINC000437599698 338315783 /nfs/dbraw/zinc/31/57/83/338315783.db2.gz DEBRLWJUIBQBKW-UHFFFAOYSA-N 1 2 314.388 4.664 20 0 DJADLO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(Cl)cc2F)o1 ZINC000437959674 338326519 /nfs/dbraw/zinc/32/65/19/338326519.db2.gz CXYQMZABQABRDP-INIZCTEOSA-N 1 2 323.795 4.556 20 0 DJADLO COCc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(Cl)cc2F)o1 ZINC000437959674 338326520 /nfs/dbraw/zinc/32/65/20/338326520.db2.gz CXYQMZABQABRDP-INIZCTEOSA-N 1 2 323.795 4.556 20 0 DJADLO C[C@@H](SCc1cn2ccccc2[nH+]1)c1ccc(F)c(F)c1 ZINC000439522654 338372296 /nfs/dbraw/zinc/37/22/96/338372296.db2.gz CTDZPHOELKOJFN-LLVKDONJSA-N 1 2 304.365 4.607 20 0 DJADLO Cc1ccc(-c2cnc(C[N@@H+]([C@@H](C)c3ccco3)C3CC3)o2)cc1 ZINC000440903528 338399593 /nfs/dbraw/zinc/39/95/93/338399593.db2.gz SUMRDOJBYRONEI-HNNXBMFYSA-N 1 2 322.408 4.969 20 0 DJADLO Cc1ccc(-c2cnc(C[N@H+]([C@@H](C)c3ccco3)C3CC3)o2)cc1 ZINC000440903528 338399594 /nfs/dbraw/zinc/39/95/94/338399594.db2.gz SUMRDOJBYRONEI-HNNXBMFYSA-N 1 2 322.408 4.969 20 0 DJADLO Cc1ccc(NC(=O)[C@@H](C)c2ccc(Cl)c(Cl)c2)c(C)[nH+]1 ZINC000446427537 338527958 /nfs/dbraw/zinc/52/79/58/338527958.db2.gz GMGNFMKIKSRGCI-JTQLQIEISA-N 1 2 323.223 4.747 20 0 DJADLO Cc1ccc(NC(=O)N(Cc2ccc(C)c(C)c2)C2CC2)c(C)[nH+]1 ZINC000447188614 338547210 /nfs/dbraw/zinc/54/72/10/338547210.db2.gz YSSVQRMMQCNCEP-UHFFFAOYSA-N 1 2 323.440 4.512 20 0 DJADLO CC[C@H](NC(=O)Nc1ccc(C)[nH+]c1C)c1cccc(Cl)c1 ZINC000447195740 338547375 /nfs/dbraw/zinc/54/73/75/338547375.db2.gz XVRJDMZYBUOERE-HNNXBMFYSA-N 1 2 317.820 4.625 20 0 DJADLO FC(F)C1CC[NH+](Cc2cc(Cl)sc2Cl)CC1 ZINC000449031860 338585565 /nfs/dbraw/zinc/58/55/65/338585565.db2.gz WUDZRPFWCYLLOO-UHFFFAOYSA-N 1 2 300.201 4.532 20 0 DJADLO Cc1nc([C@H]([NH2+][C@H](C)CC(C)(C)C)c2ccc(Cl)cc2)no1 ZINC000449255034 338607286 /nfs/dbraw/zinc/60/72/86/338607286.db2.gz ZMICBJDDPBEJEM-IAQYHMDHSA-N 1 2 321.852 4.535 20 0 DJADLO CCc1ccc(-c2ccc(C[NH2+][C@H]3C[C@H](C)n4ccnc43)o2)cc1 ZINC000449571445 338638751 /nfs/dbraw/zinc/63/87/51/338638751.db2.gz LHPORFPCMWAQHW-KSSFIOAISA-N 1 2 321.424 4.501 20 0 DJADLO CCc1ccc(-c2ccc(C[NH2+][C@@H]3C[C@H](C)n4ccnc43)o2)cc1 ZINC000449571443 338638867 /nfs/dbraw/zinc/63/88/67/338638867.db2.gz LHPORFPCMWAQHW-KBXCAEBGSA-N 1 2 321.424 4.501 20 0 DJADLO CCc1ccc(-c2ccc(C[NH2+][C@H]3C[C@@H](C)n4ccnc43)o2)cc1 ZINC000449571444 338638921 /nfs/dbraw/zinc/63/89/21/338638921.db2.gz LHPORFPCMWAQHW-KDOFPFPSSA-N 1 2 321.424 4.501 20 0 DJADLO FC(F)(F)C1CCC(SCc2c[nH+]c3ccccn23)CC1 ZINC000451036860 338718719 /nfs/dbraw/zinc/71/87/19/338718719.db2.gz MPXOILXJZZCPMP-UHFFFAOYSA-N 1 2 314.376 4.689 20 0 DJADLO C[C@H]([NH2+]C1(c2c(Cl)cccc2Cl)CCC1)c1ccncn1 ZINC000453209105 338808174 /nfs/dbraw/zinc/80/81/74/338808174.db2.gz CTDCAHVJYJRCPS-NSHDSACASA-N 1 2 322.239 4.513 20 0 DJADLO CC[C@H]([NH2+][C@@H]1C[C@H](C)n2ccnc21)c1ccc(Cl)cc1Cl ZINC000453358542 338830995 /nfs/dbraw/zinc/83/09/95/338830995.db2.gz PXZBWIKNYWGAFN-NZVBXONLSA-N 1 2 324.255 4.937 20 0 DJADLO Cc1cccc([C@H]2CCCN2C(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC000455471343 338895506 /nfs/dbraw/zinc/89/55/06/338895506.db2.gz ILHVESCWQXYRPG-GOSISDBHSA-N 1 2 323.440 4.684 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N1CC2(CCCCC2)[C@@H]1C(C)C ZINC000459549611 339035273 /nfs/dbraw/zinc/03/52/73/339035273.db2.gz FHYNLJSTQWPZAE-KRWDZBQOSA-N 1 2 315.461 4.521 20 0 DJADLO C[C@H](c1csnn1)[N@@H+]1CC2(CCCCC2)[C@H]1c1ccccc1 ZINC000459752892 339046344 /nfs/dbraw/zinc/04/63/44/339046344.db2.gz RDYUCPFCSXSQIT-RHSMWYFYSA-N 1 2 313.470 4.607 20 0 DJADLO C[C@H](c1csnn1)[N@H+]1CC2(CCCCC2)[C@H]1c1ccccc1 ZINC000459752892 339046345 /nfs/dbraw/zinc/04/63/45/339046345.db2.gz RDYUCPFCSXSQIT-RHSMWYFYSA-N 1 2 313.470 4.607 20 0 DJADLO CC[C@@H]([NH2+][C@@H](C)c1ccn(C)n1)c1ccc(Cl)cc1Cl ZINC000459778473 339048009 /nfs/dbraw/zinc/04/80/09/339048009.db2.gz FLHOMWJIZJYGTB-IINYFYTJSA-N 1 2 312.244 4.529 20 0 DJADLO FC(F)c1ccc(C[N@@H+]2CCc3c4ccccc4[nH]c3C2)cc1 ZINC000461374374 339062535 /nfs/dbraw/zinc/06/25/35/339062535.db2.gz FXAPKBYCPFVGPQ-UHFFFAOYSA-N 1 2 312.363 4.664 20 0 DJADLO FC(F)c1ccc(C[N@H+]2CCc3c4ccccc4[nH]c3C2)cc1 ZINC000461374374 339062536 /nfs/dbraw/zinc/06/25/36/339062536.db2.gz FXAPKBYCPFVGPQ-UHFFFAOYSA-N 1 2 312.363 4.664 20 0 DJADLO CC[C@@H](C)Oc1cc(C)ccc1C[NH2+][C@H](C)c1csc(C)n1 ZINC000462810352 339090887 /nfs/dbraw/zinc/09/08/87/339090887.db2.gz HXEQFIMFFNCOTM-ZIAGYGMSSA-N 1 2 318.486 4.788 20 0 DJADLO CC[C@H](C)Oc1cc(C)ccc1C[NH2+][C@@H](C)c1csc(C)n1 ZINC000462810345 339090890 /nfs/dbraw/zinc/09/08/90/339090890.db2.gz HXEQFIMFFNCOTM-KBPBESRZSA-N 1 2 318.486 4.788 20 0 DJADLO CCC[C@@H](Nc1cc[nH+]c(C)n1)c1cccc(C(F)(F)F)c1 ZINC000462814541 339091267 /nfs/dbraw/zinc/09/12/67/339091267.db2.gz UQZUIDMMRLISGA-CQSZACIVSA-N 1 2 309.335 4.757 20 0 DJADLO CCC[C@H](Nc1cc[nH+]c(C)n1)c1cccc(C(F)(F)F)c1 ZINC000462814540 339091302 /nfs/dbraw/zinc/09/13/02/339091302.db2.gz UQZUIDMMRLISGA-AWEZNQCLSA-N 1 2 309.335 4.757 20 0 DJADLO CCn1ccnc1C[N@H+](Cc1ccccc1)[C@H](C)c1ccccc1 ZINC000462912273 339097812 /nfs/dbraw/zinc/09/78/12/339097812.db2.gz QBTSOYSRUZUFOR-GOSISDBHSA-N 1 2 319.452 4.666 20 0 DJADLO CCn1ccnc1C[N@@H+](Cc1ccccc1)[C@H](C)c1ccccc1 ZINC000462912273 339097813 /nfs/dbraw/zinc/09/78/13/339097813.db2.gz QBTSOYSRUZUFOR-GOSISDBHSA-N 1 2 319.452 4.666 20 0 DJADLO CCn1ccnc1C[N@H+](Cc1ccccc1)[C@@H](C)c1ccccc1 ZINC000462914454 339097906 /nfs/dbraw/zinc/09/79/06/339097906.db2.gz QBTSOYSRUZUFOR-SFHVURJKSA-N 1 2 319.452 4.666 20 0 DJADLO CCn1ccnc1C[N@@H+](Cc1ccccc1)[C@@H](C)c1ccccc1 ZINC000462914454 339097907 /nfs/dbraw/zinc/09/79/07/339097907.db2.gz QBTSOYSRUZUFOR-SFHVURJKSA-N 1 2 319.452 4.666 20 0 DJADLO CCc1ccc([C@@H]2C[C@@H](C)CCN2c2cc[nH+]c(C(C)C)n2)o1 ZINC000463068355 339103853 /nfs/dbraw/zinc/10/38/53/339103853.db2.gz KNZALFQUVQITBL-HOCLYGCPSA-N 1 2 313.445 4.733 20 0 DJADLO Cc1cc(C[N@H+](Cc2ccccc2)[C@H](C)c2ccccc2)no1 ZINC000463228228 339110426 /nfs/dbraw/zinc/11/04/26/339110426.db2.gz ARXWAIIMBITUSS-QGZVFWFLSA-N 1 2 306.409 4.746 20 0 DJADLO Cc1cc(C[N@@H+](Cc2ccccc2)[C@H](C)c2ccccc2)no1 ZINC000463228228 339110427 /nfs/dbraw/zinc/11/04/27/339110427.db2.gz ARXWAIIMBITUSS-QGZVFWFLSA-N 1 2 306.409 4.746 20 0 DJADLO C[N@H+](Cc1ncc(C(C)(C)C)o1)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463448468 339118124 /nfs/dbraw/zinc/11/81/24/339118124.db2.gz DQDWZMCXMYBVMQ-NEPJUHHUSA-N 1 2 318.383 4.525 20 0 DJADLO C[N@@H+](Cc1ncc(C(C)(C)C)o1)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463448468 339118125 /nfs/dbraw/zinc/11/81/25/339118125.db2.gz DQDWZMCXMYBVMQ-NEPJUHHUSA-N 1 2 318.383 4.525 20 0 DJADLO CC[N@H+](Cc1nnc(-c2ccccc2)s1)Cc1ccccc1C ZINC000464275106 339138713 /nfs/dbraw/zinc/13/87/13/339138713.db2.gz MDAHDCIICQOHFZ-UHFFFAOYSA-N 1 2 323.465 4.536 20 0 DJADLO CC[N@@H+](Cc1nnc(-c2ccccc2)s1)Cc1ccccc1C ZINC000464275106 339138714 /nfs/dbraw/zinc/13/87/14/339138714.db2.gz MDAHDCIICQOHFZ-UHFFFAOYSA-N 1 2 323.465 4.536 20 0 DJADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2ccn(C(C)C)n2)o1 ZINC000464851668 339157865 /nfs/dbraw/zinc/15/78/65/339157865.db2.gz QLEGFLAPYOERFW-QAPCUYQASA-N 1 2 315.461 4.593 20 0 DJADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2ccn(C(C)C)n2)o1 ZINC000464851668 339157866 /nfs/dbraw/zinc/15/78/66/339157866.db2.gz QLEGFLAPYOERFW-QAPCUYQASA-N 1 2 315.461 4.593 20 0 DJADLO CCCc1nc(C[N@@H+]2CC[C@H](C)C[C@H]2c2ccco2)cs1 ZINC000464852997 339158000 /nfs/dbraw/zinc/15/80/00/339158000.db2.gz MXWPRQHEBHXAIM-ZFWWWQNUSA-N 1 2 304.459 4.662 20 0 DJADLO CCCc1nc(C[N@H+]2CC[C@H](C)C[C@H]2c2ccco2)cs1 ZINC000464852997 339158001 /nfs/dbraw/zinc/15/80/01/339158001.db2.gz MXWPRQHEBHXAIM-ZFWWWQNUSA-N 1 2 304.459 4.662 20 0 DJADLO C[C@H]1CC[N@H+](Cc2cc(-c3ccco3)on2)[C@H](c2ccco2)C1 ZINC000464862259 339158806 /nfs/dbraw/zinc/15/88/06/339158806.db2.gz XBOJLTGPTORGNP-ZFWWWQNUSA-N 1 2 312.369 4.501 20 0 DJADLO C[C@H]1CC[N@@H+](Cc2cc(-c3ccco3)on2)[C@H](c2ccco2)C1 ZINC000464862259 339158807 /nfs/dbraw/zinc/15/88/07/339158807.db2.gz XBOJLTGPTORGNP-ZFWWWQNUSA-N 1 2 312.369 4.501 20 0 DJADLO CCc1noc(C)c1C[NH+]1Cc2ccccc2-c2ccccc2C1 ZINC000466831701 339218543 /nfs/dbraw/zinc/21/85/43/339218543.db2.gz OUOVLRXPZAHJLP-UHFFFAOYSA-N 1 2 318.420 4.728 20 0 DJADLO Cc1[nH]c2ccc(CSc3nc4cc(C)ccc4o3)cc2[nH+]1 ZINC000467204913 339228183 /nfs/dbraw/zinc/22/81/83/339228183.db2.gz FGLVQXFSMCZYFL-UHFFFAOYSA-N 1 2 309.394 4.613 20 0 DJADLO Cc1[nH]c2cc(CSc3nc4cc(C)ccc4o3)ccc2[nH+]1 ZINC000467204913 339228184 /nfs/dbraw/zinc/22/81/84/339228184.db2.gz FGLVQXFSMCZYFL-UHFFFAOYSA-N 1 2 309.394 4.613 20 0 DJADLO Cc1ccc(CSCc2[nH+]ccn2Cc2ccccc2)cc1 ZINC000467223176 339228770 /nfs/dbraw/zinc/22/87/70/339228770.db2.gz DCTGHXJRSHKFTC-UHFFFAOYSA-N 1 2 308.450 4.673 20 0 DJADLO Cc1ccc[nH+]c1[C@@H]1CCC[C@@H](Nc2ccccc2N(C)C)C1 ZINC000467334059 339232058 /nfs/dbraw/zinc/23/20/58/339232058.db2.gz MMMAHHZHMGCRNI-IAGOWNOFSA-N 1 2 309.457 4.594 20 0 DJADLO Cc1ccc[nH+]c1[C@@H]1CCC[C@@H](Nc2cnn([C@@H](C)C3CC3)c2)C1 ZINC000467349370 339233125 /nfs/dbraw/zinc/23/31/25/339233125.db2.gz JALOCYBHBQQZMT-CGTJXYLNSA-N 1 2 324.472 4.696 20 0 DJADLO Cc1nc2ccc(N[C@H]3CCC[C@@H](c4[nH+]cccc4C)C3)cc2o1 ZINC000467357858 339233748 /nfs/dbraw/zinc/23/37/48/339233748.db2.gz ZFEJWWMVMIELSC-CVEARBPZSA-N 1 2 321.424 4.978 20 0 DJADLO Cc1nc2cc(N[C@H]3CCC[C@@H](c4[nH+]cccc4C)C3)ccc2o1 ZINC000467369472 339234658 /nfs/dbraw/zinc/23/46/58/339234658.db2.gz YWMYFPWIXXDSNX-CVEARBPZSA-N 1 2 321.424 4.978 20 0 DJADLO FC(F)[C@@H](CCc1ccccc1)[NH2+]Cc1cccc2cc[nH]c21 ZINC000467375913 339235293 /nfs/dbraw/zinc/23/52/93/339235293.db2.gz HJYCXWVFVUUSPL-QGZVFWFLSA-N 1 2 314.379 4.524 20 0 DJADLO C[C@H](Sc1ccccc1)c1ccc(NCc2[nH+]ccn2C)cc1 ZINC000467759140 339245993 /nfs/dbraw/zinc/24/59/93/339245993.db2.gz RHABFANMAJFVOX-HNNXBMFYSA-N 1 2 323.465 4.886 20 0 DJADLO C[C@H]1CC[C@H](CC(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)C1 ZINC000468924254 339274849 /nfs/dbraw/zinc/27/48/49/339274849.db2.gz KUBRCPFGRJAEDQ-GJZGRUSLSA-N 1 2 310.397 4.639 20 0 DJADLO CC(C)c1nc(C[N@H+](Cc2ccccc2)[C@H](C)C(C)(C)C)no1 ZINC000469445724 339289593 /nfs/dbraw/zinc/28/95/93/339289593.db2.gz GBRQLTRIMAWIPM-OAHLLOKOSA-N 1 2 315.461 4.630 20 0 DJADLO CC(C)c1nc(C[N@@H+](Cc2ccccc2)[C@H](C)C(C)(C)C)no1 ZINC000469445724 339289594 /nfs/dbraw/zinc/28/95/94/339289594.db2.gz GBRQLTRIMAWIPM-OAHLLOKOSA-N 1 2 315.461 4.630 20 0 DJADLO C[C@H]1CCC[C@@H]1CC(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000469485324 339291244 /nfs/dbraw/zinc/29/12/44/339291244.db2.gz FKESQSMADPYXQS-LSDHHAIUSA-N 1 2 310.397 4.639 20 0 DJADLO Cc1cnc(C[N@@H+]2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)o1 ZINC000469533388 339292780 /nfs/dbraw/zinc/29/27/80/339292780.db2.gz OAOXQEGYSFUGDD-OAHLLOKOSA-N 1 2 324.346 4.729 20 0 DJADLO Cc1cnc(C[N@H+]2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)o1 ZINC000469533388 339292781 /nfs/dbraw/zinc/29/27/81/339292781.db2.gz OAOXQEGYSFUGDD-OAHLLOKOSA-N 1 2 324.346 4.729 20 0 DJADLO COc1ccc(C2([NH2+][C@@H](C)c3csc(C(C)C)n3)CC2)cc1 ZINC000469804834 339301322 /nfs/dbraw/zinc/30/13/22/339301322.db2.gz SXJOXJJOEMJLQJ-ZDUSSCGKSA-N 1 2 316.470 4.615 20 0 DJADLO CC(C)(C)c1nc(C[N@@H+]2CC[C@H](C(F)(F)F)C2(C)C)cs1 ZINC000470007530 339308173 /nfs/dbraw/zinc/30/81/73/339308173.db2.gz CCCSXJLZCCEIGU-NSHDSACASA-N 1 2 320.424 4.603 20 0 DJADLO CC(C)(C)c1nc(C[N@H+]2CC[C@H](C(F)(F)F)C2(C)C)cs1 ZINC000470007530 339308174 /nfs/dbraw/zinc/30/81/74/339308174.db2.gz CCCSXJLZCCEIGU-NSHDSACASA-N 1 2 320.424 4.603 20 0 DJADLO C[C@H](c1c(F)cccc1F)[N@@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000470191018 339313468 /nfs/dbraw/zinc/31/34/68/339313468.db2.gz RXDZTUFNNOBXQO-HSMVNMDESA-N 1 2 323.408 4.549 20 0 DJADLO C[C@H](c1c(F)cccc1F)[N@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000470191018 339313469 /nfs/dbraw/zinc/31/34/69/339313469.db2.gz RXDZTUFNNOBXQO-HSMVNMDESA-N 1 2 323.408 4.549 20 0 DJADLO C[N@H+](Cc1nc2c(s1)CCCC2)Cc1cccc(C(F)F)c1 ZINC000470765291 339327242 /nfs/dbraw/zinc/32/72/42/339327242.db2.gz LNXUDBGKGZAPSA-UHFFFAOYSA-N 1 2 322.424 4.592 20 0 DJADLO C[N@@H+](Cc1nc2c(s1)CCCC2)Cc1cccc(C(F)F)c1 ZINC000470765291 339327243 /nfs/dbraw/zinc/32/72/43/339327243.db2.gz LNXUDBGKGZAPSA-UHFFFAOYSA-N 1 2 322.424 4.592 20 0 DJADLO CCCCc1nc(C[N@H+](CC)[C@@H](C)c2cccc(O)c2)cs1 ZINC000471182166 339339626 /nfs/dbraw/zinc/33/96/26/339339626.db2.gz KCUYDFMLCXSSJT-AWEZNQCLSA-N 1 2 318.486 4.774 20 0 DJADLO CCCCc1nc(C[N@@H+](CC)[C@@H](C)c2cccc(O)c2)cs1 ZINC000471182166 339339627 /nfs/dbraw/zinc/33/96/27/339339627.db2.gz KCUYDFMLCXSSJT-AWEZNQCLSA-N 1 2 318.486 4.774 20 0 DJADLO Cc1cccc(C(C)C)c1NC(=O)C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000471178131 339339636 /nfs/dbraw/zinc/33/96/36/339339636.db2.gz UCCNUDXDTXWLQD-IBGZPJMESA-N 1 2 322.452 4.504 20 0 DJADLO Cc1cccc(C(C)C)c1NC(=O)C[N@H+]1CC[C@H]1c1ccccc1 ZINC000471178131 339339637 /nfs/dbraw/zinc/33/96/37/339339637.db2.gz UCCNUDXDTXWLQD-IBGZPJMESA-N 1 2 322.452 4.504 20 0 DJADLO Cc1cccc(C(C)C)c1NC(=O)C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000471178132 339339748 /nfs/dbraw/zinc/33/97/48/339339748.db2.gz UCCNUDXDTXWLQD-LJQANCHMSA-N 1 2 322.452 4.504 20 0 DJADLO Cc1cccc(C(C)C)c1NC(=O)C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000471178132 339339749 /nfs/dbraw/zinc/33/97/49/339339749.db2.gz UCCNUDXDTXWLQD-LJQANCHMSA-N 1 2 322.452 4.504 20 0 DJADLO CC[C@@H](C)Oc1cc(C)ccc1C[NH2+]Cc1ncc(Cl)s1 ZINC000472051569 339361007 /nfs/dbraw/zinc/36/10/07/339361007.db2.gz GZMZVCJVQAGVSE-GFCCVEGCSA-N 1 2 324.877 4.572 20 0 DJADLO C[C@H]1CC[N@H+](Cc2ncc(C(C)(C)C)o2)[C@H]1c1cccc(F)c1 ZINC000472317775 339369759 /nfs/dbraw/zinc/36/97/59/339369759.db2.gz JQYHUALCUFXRIM-SCLBCKFNSA-N 1 2 316.420 4.694 20 0 DJADLO C[C@H]1CC[N@@H+](Cc2ncc(C(C)(C)C)o2)[C@H]1c1cccc(F)c1 ZINC000472317775 339369760 /nfs/dbraw/zinc/36/97/60/339369760.db2.gz JQYHUALCUFXRIM-SCLBCKFNSA-N 1 2 316.420 4.694 20 0 DJADLO C[C@@H](c1ccccc1Cl)[N@@H+]1CCO[C@H](c2cccs2)C1 ZINC000472806763 339377404 /nfs/dbraw/zinc/37/74/04/339377404.db2.gz CDVILCLZHSWBKM-WFASDCNBSA-N 1 2 307.846 4.536 20 0 DJADLO C[C@@H](c1ccccc1Cl)[N@H+]1CCO[C@H](c2cccs2)C1 ZINC000472806763 339377405 /nfs/dbraw/zinc/37/74/05/339377405.db2.gz CDVILCLZHSWBKM-WFASDCNBSA-N 1 2 307.846 4.536 20 0 DJADLO C[C@@H](c1ccccc1Cl)[N@@H+]1CCO[C@@H](c2cccs2)C1 ZINC000472806760 339377447 /nfs/dbraw/zinc/37/74/47/339377447.db2.gz CDVILCLZHSWBKM-SWLSCSKDSA-N 1 2 307.846 4.536 20 0 DJADLO C[C@@H](c1ccccc1Cl)[N@H+]1CCO[C@@H](c2cccs2)C1 ZINC000472806760 339377448 /nfs/dbraw/zinc/37/74/48/339377448.db2.gz CDVILCLZHSWBKM-SWLSCSKDSA-N 1 2 307.846 4.536 20 0 DJADLO C[C@H]1CC[N@H+](Cc2ncc(Cl)s2)[C@@H]1c1cccc(F)c1 ZINC000473139072 339382241 /nfs/dbraw/zinc/38/22/41/339382241.db2.gz LWHYZOHYKJZFLP-BONVTDFDSA-N 1 2 310.825 4.519 20 0 DJADLO C[C@H]1CC[N@@H+](Cc2ncc(Cl)s2)[C@@H]1c1cccc(F)c1 ZINC000473139072 339382242 /nfs/dbraw/zinc/38/22/42/339382242.db2.gz LWHYZOHYKJZFLP-BONVTDFDSA-N 1 2 310.825 4.519 20 0 DJADLO CC(C)[N@H+](Cc1ncc(Cl)s1)Cc1cccc(Cl)c1 ZINC000473141875 339382617 /nfs/dbraw/zinc/38/26/17/339382617.db2.gz HGWDVBKDZOENCL-UHFFFAOYSA-N 1 2 315.269 4.861 20 0 DJADLO CC(C)[N@@H+](Cc1ncc(Cl)s1)Cc1cccc(Cl)c1 ZINC000473141875 339382618 /nfs/dbraw/zinc/38/26/18/339382618.db2.gz HGWDVBKDZOENCL-UHFFFAOYSA-N 1 2 315.269 4.861 20 0 DJADLO CC(C)([NH2+]Cc1nc(C2CC2)cs1)c1cccc(Cl)c1F ZINC000473429265 339385198 /nfs/dbraw/zinc/38/51/98/339385198.db2.gz CEXYTILHLRGETA-UHFFFAOYSA-N 1 2 324.852 4.838 20 0 DJADLO CCc1cccc(Cl)c1C[NH2+]Cc1ccn(C2CCCC2)n1 ZINC000474351856 339410541 /nfs/dbraw/zinc/41/05/41/339410541.db2.gz SAIIJGZMFDXNEH-UHFFFAOYSA-N 1 2 317.864 4.504 20 0 DJADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@@H](C)CC1CCCC1 ZINC000477978965 339506628 /nfs/dbraw/zinc/50/66/28/339506628.db2.gz YCISEYWKTOUVGQ-AWEZNQCLSA-N 1 2 311.429 4.540 20 0 DJADLO CC[C@@H]1CCCC[C@H]1C(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C ZINC000477996190 339506862 /nfs/dbraw/zinc/50/68/62/339506862.db2.gz CGBCRNHNEAPEOC-GDBMZVCRSA-N 1 2 311.429 4.540 20 0 DJADLO C[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)N(c2cccc[nH+]2)C1 ZINC000482099571 339622991 /nfs/dbraw/zinc/62/29/91/339622991.db2.gz XLLDKPPDXJZZSD-SWLSCSKDSA-N 1 2 306.331 4.688 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC[C@@H]1CCC1CCCC1 ZINC000485449629 339703530 /nfs/dbraw/zinc/70/35/30/339703530.db2.gz DEGAQRWTJFQCBM-QGZVFWFLSA-N 1 2 315.461 4.665 20 0 DJADLO Cc1cc(N2CCCC[C@@H]2c2ccc(F)cc2)nc(C2CC2)[nH+]1 ZINC000487625004 339759519 /nfs/dbraw/zinc/75/95/19/339759519.db2.gz USJLYQAFFIYYKU-QGZVFWFLSA-N 1 2 311.404 4.533 20 0 DJADLO Cc1ccc(C(=O)Nc2ccc(Oc3cc[nH+]cc3)c(C)c2)s1 ZINC000487694099 339761129 /nfs/dbraw/zinc/76/11/29/339761129.db2.gz VCARUPSSUSSEMR-UHFFFAOYSA-N 1 2 324.405 4.805 20 0 DJADLO C[C@H](Nc1ccc2scnc2c1)c1ccc(-n2cc[nH+]c2)cc1 ZINC000488512134 339786173 /nfs/dbraw/zinc/78/61/73/339786173.db2.gz ZAEKBGLPKYCYDY-ZDUSSCGKSA-N 1 2 320.421 4.655 20 0 DJADLO CCCc1csc(C[NH2+][C@H](C)c2c(F)cccc2Cl)n1 ZINC000494117250 339941445 /nfs/dbraw/zinc/94/14/45/339941445.db2.gz RVFQEZVTCMORMU-SNVBAGLBSA-N 1 2 312.841 4.739 20 0 DJADLO CCCc1csc(C[NH2+][C@@H](c2ccco2)c2ccccc2)n1 ZINC000494357609 339947283 /nfs/dbraw/zinc/94/72/83/339947283.db2.gz KOOOAUFOYLESCT-GOSISDBHSA-N 1 2 312.438 4.568 20 0 DJADLO COc1cc(C)cc(N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)c1C ZINC000494452134 339949676 /nfs/dbraw/zinc/94/96/76/339949676.db2.gz MZWDMVZVQYDUAP-MRXNPFEDSA-N 1 2 321.424 4.671 20 0 DJADLO CCCOc1cccc2c(N3CCC(C(F)F)CC3)cc[nH+]c12 ZINC000499146387 340031144 /nfs/dbraw/zinc/03/11/44/340031144.db2.gz LTIKGDXTFABNJZ-UHFFFAOYSA-N 1 2 320.383 4.505 20 0 DJADLO C[N@H+](Cc1cnc2ccccc2c1)Cc1cc(Cl)ccc1F ZINC000499734108 340043639 /nfs/dbraw/zinc/04/36/39/340043639.db2.gz MDVURVSRQXPBHQ-UHFFFAOYSA-N 1 2 314.791 4.659 20 0 DJADLO C[N@@H+](Cc1cnc2ccccc2c1)Cc1cc(Cl)ccc1F ZINC000499734108 340043640 /nfs/dbraw/zinc/04/36/40/340043640.db2.gz MDVURVSRQXPBHQ-UHFFFAOYSA-N 1 2 314.791 4.659 20 0 DJADLO Cc1[nH]ncc1C[NH2+][C@@H](c1ccccc1C)[C@@H]1CCC[C@H](C)C1 ZINC000500884569 340069165 /nfs/dbraw/zinc/06/91/65/340069165.db2.gz BHXQDPNIWHCRTC-JNAXZKDPSA-N 1 2 311.473 4.684 20 0 DJADLO Cc1ncc(C[N@@H+]([C@@H](C)c2ccccc2Cl)C2CC2)s1 ZINC000501203124 340076158 /nfs/dbraw/zinc/07/61/58/340076158.db2.gz IDNRNOAWDADTBY-NSHDSACASA-N 1 2 306.862 4.831 20 0 DJADLO Cc1ncc(C[N@H+]([C@@H](C)c2ccccc2Cl)C2CC2)s1 ZINC000501203124 340076159 /nfs/dbraw/zinc/07/61/59/340076159.db2.gz IDNRNOAWDADTBY-NSHDSACASA-N 1 2 306.862 4.831 20 0 DJADLO Cc1ncc(C[N@H+](Cc2c(F)cccc2F)C2CCCC2)s1 ZINC000501203942 340076169 /nfs/dbraw/zinc/07/61/69/340076169.db2.gz JJYRYGCKWICCNO-UHFFFAOYSA-N 1 2 322.424 4.675 20 0 DJADLO Cc1ncc(C[N@@H+](Cc2c(F)cccc2F)C2CCCC2)s1 ZINC000501203942 340076170 /nfs/dbraw/zinc/07/61/70/340076170.db2.gz JJYRYGCKWICCNO-UHFFFAOYSA-N 1 2 322.424 4.675 20 0 DJADLO C[C@@H](c1ccccc1F)[N@H+](C)Cc1nc2ccccc2s1 ZINC000501425892 340080804 /nfs/dbraw/zinc/08/08/04/340080804.db2.gz QIFNSIKIFHQMIQ-LBPRGKRZSA-N 1 2 300.402 4.628 20 0 DJADLO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1nc2ccccc2s1 ZINC000501425892 340080805 /nfs/dbraw/zinc/08/08/05/340080805.db2.gz QIFNSIKIFHQMIQ-LBPRGKRZSA-N 1 2 300.402 4.628 20 0 DJADLO CC(C)c1nc([C@H](C)[NH2+][C@H](C)c2nc3c(s2)CCC3)cs1 ZINC000502042074 340093875 /nfs/dbraw/zinc/09/38/75/340093875.db2.gz JSBXELUNVWQPLY-WDEREUQCSA-N 1 2 321.515 4.624 20 0 DJADLO CCC[C@H](C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccccc1 ZINC000502539743 340107188 /nfs/dbraw/zinc/10/71/88/340107188.db2.gz KCDZLIOHKPUSTN-SFHVURJKSA-N 1 2 319.408 4.599 20 0 DJADLO CCc1ccc(-c2nc(C[N@H+](C)Cc3ccoc3)cs2)cc1 ZINC000502666889 340109918 /nfs/dbraw/zinc/10/99/18/340109918.db2.gz JRENCWUSPDRCQS-UHFFFAOYSA-N 1 2 312.438 4.598 20 0 DJADLO CCc1ccc(-c2nc(C[N@@H+](C)Cc3ccoc3)cs2)cc1 ZINC000502666889 340109919 /nfs/dbraw/zinc/10/99/19/340109919.db2.gz JRENCWUSPDRCQS-UHFFFAOYSA-N 1 2 312.438 4.598 20 0 DJADLO CCCc1nc(C[NH2+][C@]2(c3ccc(Cl)cc3)C[C@H]2C)cs1 ZINC000503412443 340127720 /nfs/dbraw/zinc/12/77/20/340127720.db2.gz URRDTOYQKREUBR-SJKOYZFVSA-N 1 2 320.889 4.774 20 0 DJADLO Fc1ccc(F)c(C[NH2+]Cc2ccc(Oc3ccccc3)o2)c1 ZINC000503575438 340131273 /nfs/dbraw/zinc/13/12/73/340131273.db2.gz DSFKMFCNLKGIAY-UHFFFAOYSA-N 1 2 315.319 4.640 20 0 DJADLO CCCCC(=O)Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000504843267 340153559 /nfs/dbraw/zinc/15/35/59/340153559.db2.gz PFSTXTZIBNNNAC-UHFFFAOYSA-N 1 2 304.777 4.656 20 0 DJADLO CC[C@@H](CC(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccccc1 ZINC000505098787 340161435 /nfs/dbraw/zinc/16/14/35/340161435.db2.gz NTFTZVNUHZONQW-HNNXBMFYSA-N 1 2 319.408 4.599 20 0 DJADLO COc1ccccc1C[N@H+](Cc1ccco1)Cc1cccs1 ZINC000505554469 340170918 /nfs/dbraw/zinc/17/09/18/340170918.db2.gz YVEWIGZHZBZGPV-UHFFFAOYSA-N 1 2 313.422 4.552 20 0 DJADLO COc1ccccc1C[N@@H+](Cc1ccco1)Cc1cccs1 ZINC000505554469 340170919 /nfs/dbraw/zinc/17/09/19/340170919.db2.gz YVEWIGZHZBZGPV-UHFFFAOYSA-N 1 2 313.422 4.552 20 0 DJADLO C[N@H+](Cc1nc(-c2ccccc2)cs1)Cc1cccc(F)c1 ZINC000505576886 340171474 /nfs/dbraw/zinc/17/14/74/340171474.db2.gz MQZNVJPUEUBFBP-UHFFFAOYSA-N 1 2 312.413 4.581 20 0 DJADLO C[N@@H+](Cc1nc(-c2ccccc2)cs1)Cc1cccc(F)c1 ZINC000505576886 340171475 /nfs/dbraw/zinc/17/14/75/340171475.db2.gz MQZNVJPUEUBFBP-UHFFFAOYSA-N 1 2 312.413 4.581 20 0 DJADLO C[C@@H](c1ccccc1F)[N@H+](C)Cc1cnc(C(C)(C)C)s1 ZINC000506569076 340196948 /nfs/dbraw/zinc/19/69/48/340196948.db2.gz WOERTXZPLWHHMI-LBPRGKRZSA-N 1 2 306.450 4.773 20 0 DJADLO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1cnc(C(C)(C)C)s1 ZINC000506569076 340196949 /nfs/dbraw/zinc/19/69/49/340196949.db2.gz WOERTXZPLWHHMI-LBPRGKRZSA-N 1 2 306.450 4.773 20 0 DJADLO Fc1ccc2c(c1)[C@@H](Nc1ccc3ccccc3[nH+]1)CCCO2 ZINC000506961621 340204529 /nfs/dbraw/zinc/20/45/29/340204529.db2.gz JDZRZWQUWIATLZ-KRWDZBQOSA-N 1 2 308.356 4.700 20 0 DJADLO c1ccc(-c2cccc3c2OCC[C@@H]3Nc2cccc[nH+]2)cc1 ZINC000507028024 340205715 /nfs/dbraw/zinc/20/57/15/340205715.db2.gz RLQXMFYQGGFZTM-SFHVURJKSA-N 1 2 302.377 4.684 20 0 DJADLO Clc1ccc([C@@H]2CCC[N@@H+]2Cc2ccncc2)cc1Cl ZINC000507131475 340208792 /nfs/dbraw/zinc/20/87/92/340208792.db2.gz IFHNSEQFNBIQML-INIZCTEOSA-N 1 2 307.224 4.726 20 0 DJADLO Clc1ccc([C@@H]2CCC[N@H+]2Cc2ccncc2)cc1Cl ZINC000507131475 340208793 /nfs/dbraw/zinc/20/87/93/340208793.db2.gz IFHNSEQFNBIQML-INIZCTEOSA-N 1 2 307.224 4.726 20 0 DJADLO Fc1cccc([C@H]2CCC[N@@H+]2Cc2ncccc2C(F)(F)F)c1 ZINC000507170633 340210808 /nfs/dbraw/zinc/21/08/08/340210808.db2.gz PFAIMMVISMZDHC-MRXNPFEDSA-N 1 2 324.321 4.577 20 0 DJADLO Fc1cccc([C@H]2CCC[N@H+]2Cc2ncccc2C(F)(F)F)c1 ZINC000507170633 340210809 /nfs/dbraw/zinc/21/08/09/340210809.db2.gz PFAIMMVISMZDHC-MRXNPFEDSA-N 1 2 324.321 4.577 20 0 DJADLO Cc1csc(C[N@@H+](C)[C@@H](C)c2ccc(Cl)cc2Cl)n1 ZINC000507225123 340214330 /nfs/dbraw/zinc/21/43/30/340214330.db2.gz BNKFLJSMLUYENB-JTQLQIEISA-N 1 2 315.269 4.951 20 0 DJADLO Cc1csc(C[N@H+](C)[C@@H](C)c2ccc(Cl)cc2Cl)n1 ZINC000507225123 340214331 /nfs/dbraw/zinc/21/43/31/340214331.db2.gz BNKFLJSMLUYENB-JTQLQIEISA-N 1 2 315.269 4.951 20 0 DJADLO CCc1cccnc1[C@H](C)[NH2+][C@H](C)c1c(F)cccc1Cl ZINC000507508579 340223412 /nfs/dbraw/zinc/22/34/12/340223412.db2.gz JPJBEZOHXGTSFT-NEPJUHHUSA-N 1 2 306.812 4.848 20 0 DJADLO CCc1cccnc1[C@@H](C)[NH2+][C@H](C)c1nc(C(C)(C)C)cs1 ZINC000507517866 340223956 /nfs/dbraw/zinc/22/39/56/340223956.db2.gz ZAYHGJCTNNAOTP-CHWSQXEVSA-N 1 2 317.502 4.810 20 0 DJADLO CCc1cccnc1[C@H](C)[NH2+][C@H](c1ccco1)c1ccccc1 ZINC000507520811 340224155 /nfs/dbraw/zinc/22/41/55/340224155.db2.gz UBBCWJGDEIXGIC-YWZLYKJASA-N 1 2 306.409 4.677 20 0 DJADLO FC(F)(F)CCCCSCc1ccc(-n2cc[nH+]c2)cc1 ZINC000507643568 340227057 /nfs/dbraw/zinc/22/70/57/340227057.db2.gz KOXDCWMEGUMVSS-UHFFFAOYSA-N 1 2 314.376 4.838 20 0 DJADLO Fc1ccc(F)c2c1CC[C@@H]2[NH2+]Cc1c(F)cccc1Cl ZINC000507806362 340232318 /nfs/dbraw/zinc/23/23/18/340232318.db2.gz DCBHSMBHTCDZRU-HNNXBMFYSA-N 1 2 311.734 4.534 20 0 DJADLO Cc1sc(C[NH2+][C@H]2CCc3c2c(F)ccc3F)nc1C(C)C ZINC000507828696 340233490 /nfs/dbraw/zinc/23/34/90/340233490.db2.gz VRBLNLARVSZJAI-AWEZNQCLSA-N 1 2 322.424 4.630 20 0 DJADLO Cc1noc([C@@H](C)[NH2+][C@H](C)c2ccc(Oc3ccccc3)cc2)n1 ZINC000507898174 340235441 /nfs/dbraw/zinc/23/54/41/340235441.db2.gz YGVIGZGQGZATLQ-ZIAGYGMSSA-N 1 2 323.396 4.582 20 0 DJADLO Clc1ccccc1C1=CCN(c2cc[nH+]c3ccncc32)CC1 ZINC000508383973 340243141 /nfs/dbraw/zinc/24/31/41/340243141.db2.gz BVONOBDOHWIBPV-UHFFFAOYSA-N 1 2 321.811 4.577 20 0 DJADLO CCc1nc(C)c([C@@H](C)[N@H+](C)Cc2cccc(O)c2Cl)s1 ZINC000508725679 340251597 /nfs/dbraw/zinc/25/15/97/340251597.db2.gz MUKIICYRIOEKHU-LLVKDONJSA-N 1 2 324.877 4.566 20 0 DJADLO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2cccc(O)c2Cl)s1 ZINC000508725679 340251598 /nfs/dbraw/zinc/25/15/98/340251598.db2.gz MUKIICYRIOEKHU-LLVKDONJSA-N 1 2 324.877 4.566 20 0 DJADLO Cc1csc(C[N@H+](Cc2ccc(F)cc2F)C2CCCC2)n1 ZINC000508807773 340253581 /nfs/dbraw/zinc/25/35/81/340253581.db2.gz WSICOIWSKICTTG-UHFFFAOYSA-N 1 2 322.424 4.675 20 0 DJADLO Cc1csc(C[N@@H+](Cc2ccc(F)cc2F)C2CCCC2)n1 ZINC000508807773 340253582 /nfs/dbraw/zinc/25/35/82/340253582.db2.gz WSICOIWSKICTTG-UHFFFAOYSA-N 1 2 322.424 4.675 20 0 DJADLO Cc1cc(F)ccc1NC(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000509014203 340258185 /nfs/dbraw/zinc/25/81/85/340258185.db2.gz JHPQMIKXHNAZJW-UHFFFAOYSA-N 1 2 322.339 4.574 20 0 DJADLO C[C@@H]1CCC[C@H](N(C)C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000509148542 340262402 /nfs/dbraw/zinc/26/24/02/340262402.db2.gz AQMLFPUSNTYNIC-CVEARBPZSA-N 1 2 324.424 4.525 20 0 DJADLO Cc1ccc(-c2csc(C[N@H+](C)CCC(F)(F)F)n2)cc1 ZINC000509343377 340266726 /nfs/dbraw/zinc/26/67/26/340266726.db2.gz KAANVGIFBVAYGJ-UHFFFAOYSA-N 1 2 314.376 4.503 20 0 DJADLO Cc1ccc(-c2csc(C[N@@H+](C)CCC(F)(F)F)n2)cc1 ZINC000509343377 340266727 /nfs/dbraw/zinc/26/67/27/340266727.db2.gz KAANVGIFBVAYGJ-UHFFFAOYSA-N 1 2 314.376 4.503 20 0 DJADLO Clc1ccccc1C1=CC[N@H+](Cc2nc3ccccc3o2)CC1 ZINC000509490785 340271250 /nfs/dbraw/zinc/27/12/50/340271250.db2.gz BDFQBJWKIGHJPI-UHFFFAOYSA-N 1 2 324.811 4.771 20 0 DJADLO Clc1ccccc1C1=CC[N@@H+](Cc2nc3ccccc3o2)CC1 ZINC000509490785 340271251 /nfs/dbraw/zinc/27/12/51/340271251.db2.gz BDFQBJWKIGHJPI-UHFFFAOYSA-N 1 2 324.811 4.771 20 0 DJADLO CC[N@H+](Cc1ncc(C(C)(C)C)o1)[C@@H](C)c1cccc(OC)c1 ZINC000516617732 340277868 /nfs/dbraw/zinc/27/78/68/340277868.db2.gz GWBOPBQLLUJHOX-AWEZNQCLSA-N 1 2 316.445 4.564 20 0 DJADLO CC[N@@H+](Cc1ncc(C(C)(C)C)o1)[C@@H](C)c1cccc(OC)c1 ZINC000516617732 340277869 /nfs/dbraw/zinc/27/78/69/340277869.db2.gz GWBOPBQLLUJHOX-AWEZNQCLSA-N 1 2 316.445 4.564 20 0 DJADLO C[C@@H](NC(=O)c1ccccc1Oc1cc[nH+]cc1)C1CCCCC1 ZINC000509935018 340283129 /nfs/dbraw/zinc/28/31/29/340283129.db2.gz QOYOYSCRHMSJGM-OAHLLOKOSA-N 1 2 324.424 4.573 20 0 DJADLO C[C@H]([NH2+]Cc1ccc(F)c(Cl)c1Cl)c1ccncc1F ZINC000509979898 340284502 /nfs/dbraw/zinc/28/45/02/340284502.db2.gz UCNNAZDPTDKGIK-QMMMGPOBSA-N 1 2 317.166 4.517 20 0 DJADLO C[N@H+](Cc1ccccc1F)Cc1c(Cl)ccc2cccnc21 ZINC000516618275 340288484 /nfs/dbraw/zinc/28/84/84/340288484.db2.gz XLVCNVLTOHYZOF-UHFFFAOYSA-N 1 2 314.791 4.659 20 0 DJADLO C[N@@H+](Cc1ccccc1F)Cc1c(Cl)ccc2cccnc21 ZINC000516618275 340288485 /nfs/dbraw/zinc/28/84/85/340288485.db2.gz XLVCNVLTOHYZOF-UHFFFAOYSA-N 1 2 314.791 4.659 20 0 DJADLO Cc1nc(C[N@@H+](Cc2ccc(F)cc2Cl)CC2CC2)cs1 ZINC000511089162 340320426 /nfs/dbraw/zinc/32/04/26/340320426.db2.gz JOBHRJKEPMFFAJ-UHFFFAOYSA-N 1 2 324.852 4.656 20 0 DJADLO Cc1nc(C[N@H+](Cc2ccc(F)cc2Cl)CC2CC2)cs1 ZINC000511089162 340320427 /nfs/dbraw/zinc/32/04/27/340320427.db2.gz JOBHRJKEPMFFAJ-UHFFFAOYSA-N 1 2 324.852 4.656 20 0 DJADLO CC[C@@H](CC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1)C(C)C ZINC000303452677 340326380 /nfs/dbraw/zinc/32/63/80/340326380.db2.gz LDTYOHHVXCWCBO-HNNXBMFYSA-N 1 2 312.413 4.885 20 0 DJADLO C[N@H+](Cc1cscn1)Cc1cccc(Oc2ccccc2)c1 ZINC000512053124 340346831 /nfs/dbraw/zinc/34/68/31/340346831.db2.gz ORHTZILDLMZPMA-UHFFFAOYSA-N 1 2 310.422 4.567 20 0 DJADLO C[N@@H+](Cc1cscn1)Cc1cccc(Oc2ccccc2)c1 ZINC000512053124 340346832 /nfs/dbraw/zinc/34/68/32/340346832.db2.gz ORHTZILDLMZPMA-UHFFFAOYSA-N 1 2 310.422 4.567 20 0 DJADLO Cc1ccc(-c2ccc(C[N@@H+](C)Cc3cscn3)s2)cc1 ZINC000512085628 340348085 /nfs/dbraw/zinc/34/80/85/340348085.db2.gz XLVSVNFWTIVEBD-UHFFFAOYSA-N 1 2 314.479 4.812 20 0 DJADLO Cc1ccc(-c2ccc(C[N@H+](C)Cc3cscn3)s2)cc1 ZINC000512085628 340348086 /nfs/dbraw/zinc/34/80/86/340348086.db2.gz XLVSVNFWTIVEBD-UHFFFAOYSA-N 1 2 314.479 4.812 20 0 DJADLO CSCc1cnc(C[N@@H+]2CCCC[C@@H]2c2ccccc2)s1 ZINC000512547857 340366497 /nfs/dbraw/zinc/36/64/97/340366497.db2.gz TXHCACOLMXQUSG-MRXNPFEDSA-N 1 2 318.511 4.733 20 0 DJADLO CSCc1cnc(C[N@H+]2CCCC[C@@H]2c2ccccc2)s1 ZINC000512547857 340366498 /nfs/dbraw/zinc/36/64/98/340366498.db2.gz TXHCACOLMXQUSG-MRXNPFEDSA-N 1 2 318.511 4.733 20 0 DJADLO C[C@@H]([NH2+]Cc1c(Cl)oc2ccccc21)c1c(F)cncc1F ZINC000513042574 340390374 /nfs/dbraw/zinc/39/03/74/340390374.db2.gz YNPMLJPDGQQPNX-SECBINFHSA-N 1 2 322.742 4.610 20 0 DJADLO CCC1(C)CCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)CC1 ZINC000513563747 340413678 /nfs/dbraw/zinc/41/36/78/340413678.db2.gz VRFVHYSFIZOWPU-UHFFFAOYSA-N 1 2 324.424 4.526 20 0 DJADLO CCCC[C@H]([NH2+]Cc1cc[nH]n1)c1ccc(Cl)cc1Cl ZINC000521074984 340479894 /nfs/dbraw/zinc/47/98/94/340479894.db2.gz KSRIPXPVPUTYBT-HNNXBMFYSA-N 1 2 312.244 4.738 20 0 DJADLO C[C@@H](CC(=O)Nc1cccc(-c2[nH]cc[nH+]2)c1)C1CCCCC1 ZINC000522862948 340608345 /nfs/dbraw/zinc/60/83/45/340608345.db2.gz MONLLRPOGJSDGU-AWEZNQCLSA-N 1 2 311.429 4.622 20 0 DJADLO Fc1ccc(C[NH2+][C@@H](c2ccco2)c2ccccc2)c(Cl)c1 ZINC000237794245 340673922 /nfs/dbraw/zinc/67/39/22/340673922.db2.gz NIRJNHKEASTJPD-GOSISDBHSA-N 1 2 315.775 4.951 20 0 DJADLO c1coc(C[NH+](CCOC2CCCCCC2)Cc2ccco2)c1 ZINC000524892916 340683781 /nfs/dbraw/zinc/68/37/81/340683781.db2.gz SATGMYHKRUPCFS-UHFFFAOYSA-N 1 2 317.429 4.614 20 0 DJADLO CC[C@@H]([NH2+]Cc1nc(C2CCCC2)no1)c1cc(C)ccc1C ZINC000528801387 340735067 /nfs/dbraw/zinc/73/50/67/340735067.db2.gz NFGBXYNJKBPPAB-QGZVFWFLSA-N 1 2 313.445 4.585 20 0 DJADLO CC(C)CCc1nc(C[NH2+][C@@H](C)c2c(F)cccc2F)cs1 ZINC000538124809 340810491 /nfs/dbraw/zinc/81/04/91/340810491.db2.gz JSSBXLZZGCVILF-LBPRGKRZSA-N 1 2 324.440 4.861 20 0 DJADLO CCCCc1nc(C[NH2+]C(C)(C)c2ccc(F)c(F)c2)cs1 ZINC000538235064 340814433 /nfs/dbraw/zinc/81/44/33/340814433.db2.gz VIBJXUUOSYSAIX-UHFFFAOYSA-N 1 2 324.440 4.789 20 0 DJADLO CCC(CC)n1ccc(C[NH2+][C@H](CC)c2cc(F)ccc2F)n1 ZINC000538261524 340815371 /nfs/dbraw/zinc/81/53/71/340815371.db2.gz UFODMOBWJFUEFR-GOSISDBHSA-N 1 2 321.415 4.763 20 0 DJADLO CSc1ccc(C)c(NCc2[nH+]ccn2Cc2ccccc2)c1 ZINC000538301194 340817039 /nfs/dbraw/zinc/81/70/39/340817039.db2.gz MQARXSSBYLQZFZ-UHFFFAOYSA-N 1 2 323.465 4.574 20 0 DJADLO C[C@@H]([NH2+]Cc1cscn1)c1ccccc1OCc1ccccc1 ZINC000127310996 340849054 /nfs/dbraw/zinc/84/90/54/340849054.db2.gz YJNVGLGLBGEJSV-OAHLLOKOSA-N 1 2 324.449 4.573 20 0 DJADLO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1csc(C(C)(C)C)n1 ZINC000067184844 340855548 /nfs/dbraw/zinc/85/55/48/340855548.db2.gz FUCOFHBJKHQKJQ-ZDUSSCGKSA-N 1 2 318.486 4.608 20 0 DJADLO CCCCc1nc(C[NH2+][C@H](C)c2c(F)cccc2F)cs1 ZINC000539223818 340877198 /nfs/dbraw/zinc/87/71/98/340877198.db2.gz MWQYDFDXRKQUPW-LLVKDONJSA-N 1 2 310.413 4.615 20 0 DJADLO CC[C@@H](C)[C@@H]([NH2+]Cc1nc(C(C)C)no1)c1ccc(Cl)cc1 ZINC000539285857 340879356 /nfs/dbraw/zinc/87/93/56/340879356.db2.gz FOUAXNGFGWBMCX-MLGOLLRUSA-N 1 2 321.852 4.723 20 0 DJADLO CCCCc1noc(C[NH2+][C@H](CC(C)(C)C)c2ccccc2)n1 ZINC000540380064 340928967 /nfs/dbraw/zinc/92/89/67/340928967.db2.gz SLPUIQCMEPZYHN-MRXNPFEDSA-N 1 2 315.461 4.679 20 0 DJADLO CC(C)C[C@@H]([NH2+][C@H](C)c1nc(C(C)(C)C)no1)c1cccs1 ZINC000541627126 340978383 /nfs/dbraw/zinc/97/83/83/340978383.db2.gz TZICEGDKOZPLIH-CHWSQXEVSA-N 1 2 321.490 4.867 20 0 DJADLO CC(C)C[C@H]([NH2+][C@H](C)c1nc(C(C)(C)C)no1)c1cccs1 ZINC000541627127 340978463 /nfs/dbraw/zinc/97/84/63/340978463.db2.gz TZICEGDKOZPLIH-OLZOCXBDSA-N 1 2 321.490 4.867 20 0 DJADLO CCOc1cccc2cc([C@H](C)[NH2+][C@H](C)c3ncc(C)o3)oc21 ZINC000541659056 340979768 /nfs/dbraw/zinc/97/97/68/340979768.db2.gz WCRWKZKFGOTSTR-QWHCGFSZSA-N 1 2 314.385 4.540 20 0 DJADLO Cc1ccsc1[C@@H](C)Nc1ccc(N2CCCCC2)[nH+]c1 ZINC000070090687 340988683 /nfs/dbraw/zinc/98/86/83/340988683.db2.gz ZIAPMJZDBZNGIJ-CQSZACIVSA-N 1 2 301.459 4.615 20 0 DJADLO CC(C)c1cnc(C[N@@H+]2CC[C@@H](C)C[C@H]2c2ccco2)s1 ZINC000542465827 341008421 /nfs/dbraw/zinc/00/84/21/341008421.db2.gz MIAZHDLGRSYDDX-KGLIPLIRSA-N 1 2 304.459 4.833 20 0 DJADLO CC(C)c1cnc(C[N@H+]2CC[C@@H](C)C[C@H]2c2ccco2)s1 ZINC000542465827 341008422 /nfs/dbraw/zinc/00/84/22/341008422.db2.gz MIAZHDLGRSYDDX-KGLIPLIRSA-N 1 2 304.459 4.833 20 0 DJADLO Cc1c[nH]c(-c2ccccc2NC(=O)[C@H](C)CCC(C)(C)C)[nH+]1 ZINC000542653774 341015682 /nfs/dbraw/zinc/01/56/82/341015682.db2.gz PRUTZRKXFJCYRQ-CYBMUJFWSA-N 1 2 313.445 4.786 20 0 DJADLO CCOc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1ncc(CC)s1 ZINC000130486182 341022914 /nfs/dbraw/zinc/02/29/14/341022914.db2.gz PIMGLFYATKGLNM-NSHDSACASA-N 1 2 324.877 4.608 20 0 DJADLO Cc1ccc(-c2nnc([C@H](C)[N@@H+]3Cc4ccccc4[C@@H]3C)o2)cc1 ZINC000543061269 341029856 /nfs/dbraw/zinc/02/98/56/341029856.db2.gz RWAODLNWRJPGIH-GJZGRUSLSA-N 1 2 319.408 4.683 20 0 DJADLO Cc1ccc(-c2nnc([C@H](C)[N@H+]3Cc4ccccc4[C@@H]3C)o2)cc1 ZINC000543061269 341029857 /nfs/dbraw/zinc/02/98/57/341029857.db2.gz RWAODLNWRJPGIH-GJZGRUSLSA-N 1 2 319.408 4.683 20 0 DJADLO CC[C@H]1c2ccsc2CC[N@H+]1Cc1ncc(C(C)C)s1 ZINC000543393289 341041584 /nfs/dbraw/zinc/04/15/84/341041584.db2.gz FYXLFESSUWASJC-ZDUSSCGKSA-N 1 2 306.500 4.837 20 0 DJADLO CC[C@H]1c2ccsc2CC[N@@H+]1Cc1ncc(C(C)C)s1 ZINC000543393289 341041585 /nfs/dbraw/zinc/04/15/85/341041585.db2.gz FYXLFESSUWASJC-ZDUSSCGKSA-N 1 2 306.500 4.837 20 0 DJADLO CCc1c[nH+]ccc1[C@H](C)[C@@H](c1ccc(F)cc1)c1cnccn1 ZINC000543403845 341042480 /nfs/dbraw/zinc/04/24/80/341042480.db2.gz WGSVATSVMKPZLD-XOBRGWDASA-N 1 2 321.399 4.509 20 0 DJADLO CC(C)c1ncc(C[NH2+][C@@H](c2ccco2)c2ccccc2)s1 ZINC000130799277 341045734 /nfs/dbraw/zinc/04/57/34/341045734.db2.gz SMOSSQRPTXLCFK-QGZVFWFLSA-N 1 2 312.438 4.739 20 0 DJADLO CC(C)c1cnc(C[NH2+]Cc2c(Cl)cccc2Cl)s1 ZINC000544189171 341073641 /nfs/dbraw/zinc/07/36/41/341073641.db2.gz LMSXHJIPINLBJH-UHFFFAOYSA-N 1 2 315.269 4.863 20 0 DJADLO CCc1cnc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)cc2)s1 ZINC000544347728 341077131 /nfs/dbraw/zinc/07/71/31/341077131.db2.gz ABGKWEUPVNLVEG-HNNXBMFYSA-N 1 2 306.862 4.696 20 0 DJADLO CCc1cnc(C[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)s1 ZINC000544347728 341077132 /nfs/dbraw/zinc/07/71/32/341077132.db2.gz ABGKWEUPVNLVEG-HNNXBMFYSA-N 1 2 306.862 4.696 20 0 DJADLO CCc1cnc(C[NH+]2CCC(=Cc3ccccc3F)CC2)s1 ZINC000544352121 341077695 /nfs/dbraw/zinc/07/76/95/341077695.db2.gz YPVZRQBBWTXNLX-UHFFFAOYSA-N 1 2 316.445 4.524 20 0 DJADLO CC(C)CCc1noc(C[NH2+][C@H](CC(C)C)c2cccs2)n1 ZINC000544451586 341082776 /nfs/dbraw/zinc/08/27/76/341082776.db2.gz GZXIDLAHYGGNFG-CQSZACIVSA-N 1 2 321.490 4.597 20 0 DJADLO CSc1ccccc1C[NH2+][C@H](C)c1ncc(-c2ccccc2)o1 ZINC000544463186 341083229 /nfs/dbraw/zinc/08/32/29/341083229.db2.gz GHLAECHCMHFSBO-CQSZACIVSA-N 1 2 324.449 4.914 20 0 DJADLO Cc1ccc([C@H]([NH2+]Cc2coc(-c3ccccc3)n2)C2CCC2)o1 ZINC000544577610 341086925 /nfs/dbraw/zinc/08/69/25/341086925.db2.gz LRHNUNVMZDVYKV-LJQANCHMSA-N 1 2 322.408 4.874 20 0 DJADLO Cc1cccn2cc(CNc3cccc(C(F)F)c3Cl)[nH+]c12 ZINC000544639218 341089991 /nfs/dbraw/zinc/08/99/91/341089991.db2.gz ADWKWXXWZXDADH-UHFFFAOYSA-N 1 2 321.758 4.846 20 0 DJADLO CC(C)c1nc([C@@H](C)[NH2+][C@H]2COc3ccc(Cl)cc32)cs1 ZINC000545279227 341118974 /nfs/dbraw/zinc/11/89/74/341118974.db2.gz OFGZWODJNVWXFN-MFKMUULPSA-N 1 2 322.861 4.704 20 0 DJADLO Cc1ccc([C@H](C)[N@H+](C)Cc2nc(C(F)(F)F)cs2)cc1 ZINC000132361628 341121355 /nfs/dbraw/zinc/12/13/55/341121355.db2.gz XPLFNEFHBMZLPS-NSHDSACASA-N 1 2 314.376 4.663 20 0 DJADLO Cc1ccc([C@H](C)[N@@H+](C)Cc2nc(C(F)(F)F)cs2)cc1 ZINC000132361628 341121356 /nfs/dbraw/zinc/12/13/56/341121356.db2.gz XPLFNEFHBMZLPS-NSHDSACASA-N 1 2 314.376 4.663 20 0 DJADLO Cc1cc(NCc2cn3ccccc3[nH+]2)ccc1-c1ccccc1 ZINC000545827560 341142715 /nfs/dbraw/zinc/14/27/15/341142715.db2.gz HLWRYUMTRWPXHN-UHFFFAOYSA-N 1 2 313.404 4.922 20 0 DJADLO FC(F)(F)C1CC[NH+](Cc2csc(C3CCCC3)n2)CC1 ZINC000075997659 341195173 /nfs/dbraw/zinc/19/51/73/341195173.db2.gz VUNFMFAHOOWDFO-UHFFFAOYSA-N 1 2 318.408 4.575 20 0 DJADLO CCO[C@@H](C)c1nc(C[NH2+][C@H](C)c2ccccc2Cl)cs1 ZINC000076716230 341212915 /nfs/dbraw/zinc/21/29/15/341212915.db2.gz GCGNVUSNKIFDGG-NEPJUHHUSA-N 1 2 324.877 4.745 20 0 DJADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)C1=CCCCCC1 ZINC000547521003 341220018 /nfs/dbraw/zinc/22/00/18/341220018.db2.gz WYBCDQPJSVAHCB-UHFFFAOYSA-N 1 2 308.381 4.703 20 0 DJADLO C[C@H]([NH2+][C@@H](c1ccco1)c1ccccc1)c1ccc(F)cc1F ZINC000078970915 341250880 /nfs/dbraw/zinc/25/08/80/341250880.db2.gz DRVCKEKRAOTPIW-ORAYPTAESA-N 1 2 313.347 4.998 20 0 DJADLO C[C@@H]([NH2+][C@H](c1ccco1)c1ccccc1)c1ccc(F)cc1F ZINC000078970910 341250929 /nfs/dbraw/zinc/25/09/29/341250929.db2.gz DRVCKEKRAOTPIW-YJYMSZOUSA-N 1 2 313.347 4.998 20 0 DJADLO C[C@H]([NH2+][C@@H](c1ccco1)c1ccccc1)c1cc(F)ccc1F ZINC000078968703 341250933 /nfs/dbraw/zinc/25/09/33/341250933.db2.gz YSHLFBIDNVJUIG-ORAYPTAESA-N 1 2 313.347 4.998 20 0 DJADLO CC(C)c1nc(C[NH2+]C2(c3ccc(F)cc3F)CCC2)cs1 ZINC000136130671 341253398 /nfs/dbraw/zinc/25/33/98/341253398.db2.gz DNJCUHFSAAGYIS-UHFFFAOYSA-N 1 2 322.424 4.714 20 0 DJADLO COc1ccccc1-c1ccc([C@H](C)[NH2+]CC(C)(F)F)cc1 ZINC000550869686 341325097 /nfs/dbraw/zinc/32/50/97/341325097.db2.gz CJZZJJPZNSBTJS-ZDUSSCGKSA-N 1 2 305.368 4.668 20 0 DJADLO Cc1cc([C@H](C)[NH2+]Cc2ccccc2Oc2ccc(C)cc2)no1 ZINC000550886586 341325679 /nfs/dbraw/zinc/32/56/79/341325679.db2.gz IGUVEAQEAYUCAA-INIZCTEOSA-N 1 2 322.408 4.935 20 0 DJADLO Cc1cnc(C[N@@H+](C)[C@H](C)c2ccc(-c3ccccc3)cc2)nc1 ZINC000551420178 341341218 /nfs/dbraw/zinc/34/12/18/341341218.db2.gz QCXILQZJGSLQBN-QGZVFWFLSA-N 1 2 317.436 4.645 20 0 DJADLO Cc1cnc(C[N@H+](C)[C@H](C)c2ccc(-c3ccccc3)cc2)nc1 ZINC000551420178 341341219 /nfs/dbraw/zinc/34/12/19/341341219.db2.gz QCXILQZJGSLQBN-QGZVFWFLSA-N 1 2 317.436 4.645 20 0 DJADLO Cc1cnc(C[N@@H+](CC(C)C)[C@H](C)c2ccccc2Cl)o1 ZINC000551424490 341341384 /nfs/dbraw/zinc/34/13/84/341341384.db2.gz HZMIWOTUHFJVOW-CQSZACIVSA-N 1 2 306.837 4.856 20 0 DJADLO Cc1cnc(C[N@H+](CC(C)C)[C@H](C)c2ccccc2Cl)o1 ZINC000551424490 341341385 /nfs/dbraw/zinc/34/13/85/341341385.db2.gz HZMIWOTUHFJVOW-CQSZACIVSA-N 1 2 306.837 4.856 20 0 DJADLO CCO[C@@H](C)c1nc(C[N@H+](C)[C@H](CC)c2ccccc2)cs1 ZINC000247077342 341360664 /nfs/dbraw/zinc/36/06/64/341360664.db2.gz ZCAYVAQRRUYMIT-WMLDXEAASA-N 1 2 318.486 4.824 20 0 DJADLO CCO[C@@H](C)c1nc(C[N@@H+](C)[C@H](CC)c2ccccc2)cs1 ZINC000247077342 341360665 /nfs/dbraw/zinc/36/06/65/341360665.db2.gz ZCAYVAQRRUYMIT-WMLDXEAASA-N 1 2 318.486 4.824 20 0 DJADLO Cc1ccnc([C@@H](C)[NH2+][C@H](C)c2nc(C(C)(C)C)cs2)c1 ZINC000552046486 341364737 /nfs/dbraw/zinc/36/47/37/341364737.db2.gz IZBMEOXNAJORCA-CHWSQXEVSA-N 1 2 303.475 4.556 20 0 DJADLO COc1cc(N[C@H](c2[nH]cc[nH+]2)C2CCCCC2)ccc1Cl ZINC000552064088 341366516 /nfs/dbraw/zinc/36/65/16/341366516.db2.gz XFGAOXWTVCFTTK-INIZCTEOSA-N 1 2 319.836 4.805 20 0 DJADLO COc1cc(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)ccc1Cl ZINC000552064089 341366583 /nfs/dbraw/zinc/36/65/83/341366583.db2.gz XFGAOXWTVCFTTK-MRXNPFEDSA-N 1 2 319.836 4.805 20 0 DJADLO CCOCc1ccc(N[C@H](c2[nH]cc[nH+]2)C2CCCCC2)cc1 ZINC000552068366 341367083 /nfs/dbraw/zinc/36/70/83/341367083.db2.gz UAFKJWDRDZYCMW-SFHVURJKSA-N 1 2 313.445 4.680 20 0 DJADLO C[C@H]([NH2+][C@H](c1nccn1C)C1CC1)c1cccc(Cl)c1Cl ZINC000552319939 341386336 /nfs/dbraw/zinc/38/63/36/341386336.db2.gz UMZBXWYGKKLJLA-BONVTDFDSA-N 1 2 324.255 4.529 20 0 DJADLO C[C@@H](CCCC(F)(F)F)Nc1cc(C(F)(F)F)cc[nH+]1 ZINC000553246865 341421781 /nfs/dbraw/zinc/42/17/81/341421781.db2.gz SBQIQMFNGYRFRV-QMMMGPOBSA-N 1 2 300.246 4.633 20 0 DJADLO Cc1cc(N[C@@H](C)c2ccc3n[nH]cc3c2)c2cccc(F)c2[nH+]1 ZINC000553388767 341427600 /nfs/dbraw/zinc/42/76/00/341427600.db2.gz LXDPCOYCYHYACV-LBPRGKRZSA-N 1 2 320.371 4.732 20 0 DJADLO CCc1noc(CC)c1CNc1cc[nH+]c2c(Cl)cccc12 ZINC000553444123 341429118 /nfs/dbraw/zinc/42/91/18/341429118.db2.gz UTVBUAFCRGBQNR-UHFFFAOYSA-N 1 2 315.804 4.613 20 0 DJADLO CCCCn1cc[nH+]c1-c1cccc(NCc2ccncc2C)c1 ZINC000556139000 341495354 /nfs/dbraw/zinc/49/53/54/341495354.db2.gz AFIXGWBLPVTHOQ-UHFFFAOYSA-N 1 2 320.440 4.666 20 0 DJADLO CCOC1CC(CCNc2cc[nH+]c3c(Cl)cccc23)C1 ZINC000565355020 341524986 /nfs/dbraw/zinc/52/49/86/341524986.db2.gz QIWHVCQUTXPTJG-UHFFFAOYSA-N 1 2 304.821 4.505 20 0 DJADLO Cc1cc([C@H](C)[NH2+]Cc2ccccc2Oc2ccccc2C)no1 ZINC000565436025 341527308 /nfs/dbraw/zinc/52/73/08/341527308.db2.gz HSKXZWMMTJTKDS-INIZCTEOSA-N 1 2 322.408 4.935 20 0 DJADLO C[C@H]([NH2+]Cc1ccccc1OC1CC1)c1c(F)cccc1Cl ZINC000568445160 341671427 /nfs/dbraw/zinc/67/14/27/341671427.db2.gz QCEQTLSJSJIGRF-LBPRGKRZSA-N 1 2 319.807 4.871 20 0 DJADLO CCOc1ccccc1[C@@H](CC)[NH2+]Cc1cc(C(C)(C)C)on1 ZINC000568449171 341671710 /nfs/dbraw/zinc/67/17/10/341671710.db2.gz UEUBFJZLFVIJKB-MRXNPFEDSA-N 1 2 316.445 4.612 20 0 DJADLO CC[C@@H]([NH2+]Cc1nc(CCC(C)C)no1)c1ccc(Cl)cc1 ZINC000175528534 341839469 /nfs/dbraw/zinc/83/94/69/341839469.db2.gz AIRQVDYQZSPGHH-OAHLLOKOSA-N 1 2 321.852 4.553 20 0 DJADLO CC(C)(C)c1nc(C[NH2+]C(C)(C)c2ccc(F)c(F)c2)cs1 ZINC000175987779 341855032 /nfs/dbraw/zinc/85/50/32/341855032.db2.gz MJDGMRMTUUIDBU-UHFFFAOYSA-N 1 2 324.440 4.744 20 0 DJADLO CCc1ccc([C@@H](COC)[NH2+][C@H](C)c2ccccc2Cl)o1 ZINC000177372768 341919108 /nfs/dbraw/zinc/91/91/08/341919108.db2.gz JEEQZWJNDAXAPW-MLGOLLRUSA-N 1 2 307.821 4.534 20 0 DJADLO COC[C@H]([NH2+]Cc1sc2ccccc2c1Cl)c1ccco1 ZINC000177576553 341921303 /nfs/dbraw/zinc/92/13/03/341921303.db2.gz AEBBLWZBIZIAOF-LBPRGKRZSA-N 1 2 321.829 4.625 20 0 DJADLO Cc1ccc([C@@H](C)[NH2+]Cc2cc(F)c(C(F)(F)F)cc2F)o1 ZINC000561884103 518189621 /nfs/dbraw/zinc/18/96/21/518189621.db2.gz WLTLTHGLAXPDBY-SECBINFHSA-N 1 2 319.273 4.736 20 0 DJADLO CC(C)n1ccnc1C[NH2+]C(C)(c1ccccc1)c1ccccc1 ZINC000182194892 520031950 /nfs/dbraw/zinc/03/19/50/520031950.db2.gz ZQNOZFGCNKRECH-UHFFFAOYSA-N 1 2 319.452 4.517 20 0 DJADLO CCO[C@H](C)c1nc(C[N@@H+]2CCC[C@H]2c2ccsc2)cs1 ZINC000336832698 520478402 /nfs/dbraw/zinc/47/84/02/520478402.db2.gz AWCWPINCWIYAMQ-DOMZBBRYSA-N 1 2 322.499 4.639 20 0 DJADLO CCO[C@H](C)c1nc(C[N@H+]2CCC[C@H]2c2ccsc2)cs1 ZINC000336832698 520478409 /nfs/dbraw/zinc/47/84/09/520478409.db2.gz AWCWPINCWIYAMQ-DOMZBBRYSA-N 1 2 322.499 4.639 20 0 DJADLO CCCCc1noc([C@@H](C)[NH2+][C@H](C)c2cc3ccccc3o2)n1 ZINC000182631911 521346924 /nfs/dbraw/zinc/34/69/24/521346924.db2.gz QHQGPTNASBSQFC-CHWSQXEVSA-N 1 2 313.401 4.570 20 0 DJADLO CCc1nc(C)c([C@H](C)[N@H+](C)Cc2csc(C3CC3)n2)s1 ZINC000163133645 522228979 /nfs/dbraw/zinc/22/89/79/522228979.db2.gz RSWNCLOWPNOCJS-NSHDSACASA-N 1 2 321.515 4.541 20 0 DJADLO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2csc(C3CC3)n2)s1 ZINC000163133645 522228985 /nfs/dbraw/zinc/22/89/85/522228985.db2.gz RSWNCLOWPNOCJS-NSHDSACASA-N 1 2 321.515 4.541 20 0 DJADLO CCc1nc([C@@H](C)[NH2+][C@H](CC)c2cc(F)ccc2F)cs1 ZINC000162316908 522422548 /nfs/dbraw/zinc/42/25/48/522422548.db2.gz DQRNGBCJWIOQCS-QMTHXVAHSA-N 1 2 310.413 4.786 20 0 DJADLO CCc1nc([C@H](C)[NH2+][C@H](CC)c2cc(F)ccc2F)cs1 ZINC000162317059 522457376 /nfs/dbraw/zinc/45/73/76/522457376.db2.gz DQRNGBCJWIOQCS-IINYFYTJSA-N 1 2 310.413 4.786 20 0 DJADLO CC[C@H]([NH2+][C@H](C)c1nc2ccccc2o1)c1cc(F)ccc1F ZINC000181230228 522745183 /nfs/dbraw/zinc/74/51/83/522745183.db2.gz IEZKIGSEEPUBGE-ABAIWWIYSA-N 1 2 316.351 4.908 20 0 DJADLO CC[C@@H]([NH2+][C@H](C)c1nc2ccccc2o1)c1cc(F)ccc1F ZINC000181230243 522939599 /nfs/dbraw/zinc/93/95/99/522939599.db2.gz IEZKIGSEEPUBGE-IAQYHMDHSA-N 1 2 316.351 4.908 20 0 DJADLO CO[C@H](C)c1nc(C[N@@H+]2CCCCC[C@@H]2c2ccco2)cs1 ZINC000267085942 523912605 /nfs/dbraw/zinc/91/26/05/523912605.db2.gz ZMWGFMPFTPKBJM-UKRRQHHQSA-N 1 2 320.458 4.561 20 0 DJADLO CO[C@H](C)c1nc(C[N@H+]2CCCCC[C@@H]2c2ccco2)cs1 ZINC000267085942 523912612 /nfs/dbraw/zinc/91/26/12/523912612.db2.gz ZMWGFMPFTPKBJM-UKRRQHHQSA-N 1 2 320.458 4.561 20 0 DJADLO Cc1cc(C(=O)Nc2cc[nH+]cc2C)c(C)n1C1CCCCC1 ZINC000107287232 524182377 /nfs/dbraw/zinc/18/23/77/524182377.db2.gz QUPZQDRWSAFHHS-UHFFFAOYSA-N 1 2 311.429 4.566 20 0 DJADLO COc1ccccc1[C@H](C)[NH2+][C@@H](C)c1ncc(-c2ccccc2)o1 ZINC000266519927 524782523 /nfs/dbraw/zinc/78/25/23/524782523.db2.gz ZJFZPBMEMPKYKS-GJZGRUSLSA-N 1 2 322.408 4.762 20 0 DJADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+][C@@H](c2nccs2)c2ccccc2)o1 ZINC000237374834 525344193 /nfs/dbraw/zinc/34/41/93/525344193.db2.gz CIBLRFWJVIUFDM-RPVQJOFSSA-N 1 2 324.449 4.739 20 0 DJADLO C[C@@H]([NH2+]C1(c2ccccc2F)CC1)c1nc2c(s1)CCCC2 ZINC000182234589 525394588 /nfs/dbraw/zinc/39/45/88/525394588.db2.gz GMONCHAGHSMOPX-GFCCVEGCSA-N 1 2 316.445 4.501 20 0 DJADLO Cc1cc([C@@H](C)[NH2+][C@H](C)c2ncc(C(C)(C)C)o2)ccc1F ZINC000267606666 525475049 /nfs/dbraw/zinc/47/50/49/525475049.db2.gz GDEHNJIYPCNKEV-CHWSQXEVSA-N 1 2 304.409 4.831 20 0 DJADLO C[C@@H]([NH2+]Cc1csc(C2CCCCC2)n1)c1ccncc1F ZINC000338355700 525557205 /nfs/dbraw/zinc/55/72/05/525557205.db2.gz KZHKNSVNXLOSKS-GFCCVEGCSA-N 1 2 319.449 4.576 20 0 DJADLO Cc1ccc([C@H]([NH2+][C@@H](C)c2ccccc2F)c2ccccn2)cc1 ZINC000366425869 525972335 /nfs/dbraw/zinc/97/23/35/525972335.db2.gz CPYILRJLHROOAK-KKSFZXQISA-N 1 2 320.411 4.969 20 0 DJADLO CCCC[C@H](CC)CC(=O)N1CCCC[C@H]1c1[nH+]ccn1CC ZINC000366646708 534992270 /nfs/dbraw/zinc/99/22/70/534992270.db2.gz HTMLJJOISLMBND-IRXDYDNUSA-N 1 2 319.493 4.563 20 0 DJADLO CC[C@@H]([NH2+][C@H](C)c1nnc(C(C)C)[nH]1)c1cccc(Cl)c1F ZINC000274092073 535808676 /nfs/dbraw/zinc/80/86/76/535808676.db2.gz UFAJPMJVJMRYQN-ZWNOBZJWSA-N 1 2 324.831 4.523 20 0 DJADLO CCCCc1nc(C[NH2+][C@](C)(CC)c2nc(C)cs2)cs1 ZINC000072863577 191244765 /nfs/dbraw/zinc/24/47/65/191244765.db2.gz JLZGEWOUALFXSM-MRXNPFEDSA-N 1 2 323.531 4.666 20 0 DJADLO CCc1cc2c(ncnc2Nc2ccc([NH+]3CCCC3)cc2)s1 ZINC000019975040 182172621 /nfs/dbraw/zinc/17/26/21/182172621.db2.gz JQDUWMSFZDYCLA-UHFFFAOYSA-N 1 2 324.453 4.598 20 0 DJADLO C[N@H+](Cc1ccc(Cl)cc1)Cc1nc(Cl)ccc1Cl ZINC000061630512 184179680 /nfs/dbraw/zinc/17/96/80/184179680.db2.gz RPYHAWJJRGKNSY-UHFFFAOYSA-N 1 2 315.631 4.674 20 0 DJADLO C[N@@H+](Cc1ccc(Cl)cc1)Cc1nc(Cl)ccc1Cl ZINC000061630512 184179682 /nfs/dbraw/zinc/17/96/82/184179682.db2.gz RPYHAWJJRGKNSY-UHFFFAOYSA-N 1 2 315.631 4.674 20 0 DJADLO CCSc1cccc(F)c1NCc1cn2cccc(C)c2[nH+]1 ZINC000563847940 335053342 /nfs/dbraw/zinc/05/33/42/335053342.db2.gz ZMQQSKPJDJULSP-UHFFFAOYSA-N 1 2 315.417 4.506 20 0 DJADLO C[C@@H]([NH2+]C1(c2c(Cl)cccc2Cl)CC1)c1ccccn1 ZINC000272206812 130007392 /nfs/dbraw/zinc/00/73/92/130007392.db2.gz JZFRBORDLKROND-LLVKDONJSA-N 1 2 307.224 4.728 20 0 DJADLO C[C@H](Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)c1cscn1 ZINC000272320825 130020850 /nfs/dbraw/zinc/02/08/50/130020850.db2.gz BJMSPLUPUFKVPU-ZDUSSCGKSA-N 1 2 324.453 4.516 20 0 DJADLO CC(C)[C@@H]([NH2+][C@H](C)c1cscn1)c1ccc(Cl)cc1F ZINC000272711488 130056396 /nfs/dbraw/zinc/05/63/96/130056396.db2.gz BEJIMAJRFQWFTP-MEBBXXQBSA-N 1 2 312.841 4.984 20 0 DJADLO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc(SC(C)C)cc2)s1 ZINC000274133956 130209563 /nfs/dbraw/zinc/20/95/63/130209563.db2.gz CFGPJLVZMAVRLZ-NWDGAFQWSA-N 1 2 321.515 4.759 20 0 DJADLO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(SC(C)C)cc2)s1 ZINC000274133960 130209773 /nfs/dbraw/zinc/20/97/73/130209773.db2.gz CFGPJLVZMAVRLZ-VXGBXAGGSA-N 1 2 321.515 4.759 20 0 DJADLO CCCCOc1ccc(C[NH2+][C@@H](C)c2cscn2)cc1Cl ZINC000276208451 130454442 /nfs/dbraw/zinc/45/44/42/130454442.db2.gz ZVWMETKJTFCGJY-LBPRGKRZSA-N 1 2 324.877 4.826 20 0 DJADLO CCCCOc1ccc(C[NH2+][C@H](C)c2cc(C)on2)cc1Cl ZINC000285211301 131147949 /nfs/dbraw/zinc/14/79/49/131147949.db2.gz ONZSGMXIZNOOTE-CYBMUJFWSA-N 1 2 322.836 4.666 20 0 DJADLO Cc1c2ccccc2oc1[C@H](C)[NH2+][C@H](C)c1c(F)cncc1F ZINC000285698655 131194466 /nfs/dbraw/zinc/19/44/66/131194466.db2.gz OSYYCIZQKIAGMO-NEPJUHHUSA-N 1 2 316.351 4.826 20 0 DJADLO Cc1oc(C(C)C)cc1C(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C ZINC000285953430 131212577 /nfs/dbraw/zinc/21/25/77/131212577.db2.gz NBCQOAPBTXORAI-UHFFFAOYSA-N 1 2 323.396 4.662 20 0 DJADLO COc1cccc(F)c1[C@H](C)Nc1[nH+]ccc2ccc(F)cc21 ZINC000340260194 131297300 /nfs/dbraw/zinc/29/73/00/131297300.db2.gz PYPRGCZLZGNVKO-NSHDSACASA-N 1 2 314.335 4.695 20 0 DJADLO C[C@H]([NH2+][C@@H](c1c(Cl)cccc1Cl)C1CC1)c1cnccn1 ZINC000289366533 131378670 /nfs/dbraw/zinc/37/86/70/131378670.db2.gz AHYYVTVPKJEASZ-MGPLVRAMSA-N 1 2 322.239 4.585 20 0 DJADLO CO[C@H](C)c1cccc(N[C@H](c2[nH]cc[nH+]2)C2CCCCC2)c1 ZINC000556890576 331749238 /nfs/dbraw/zinc/74/92/38/331749238.db2.gz RUYDGCYVMKGSEA-KDOFPFPSSA-N 1 2 313.445 4.851 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1nccs1)c1cc2cc(Cl)ccc2o1 ZINC000090034730 331975862 /nfs/dbraw/zinc/97/58/62/331975862.db2.gz WVIAZMPTBAVCJY-UWVGGRQHSA-N 1 2 306.818 4.955 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1nccs1)c1cc2cc(Cl)ccc2o1 ZINC000090034733 331975868 /nfs/dbraw/zinc/97/58/68/331975868.db2.gz WVIAZMPTBAVCJY-ZJUUUORDSA-N 1 2 306.818 4.955 20 0 DJADLO Clc1ccc(-c2nc(C[NH+]3Cc4ccccc4C3)co2)cc1 ZINC000518513522 332070194 /nfs/dbraw/zinc/07/01/94/332070194.db2.gz CHGHTVYXGNBNFI-UHFFFAOYSA-N 1 2 310.784 4.511 20 0 DJADLO Cc1cc(C[N@H+](C)Cc2ccc(-c3ccccc3Cl)o2)no1 ZINC000092254631 332122845 /nfs/dbraw/zinc/12/28/45/332122845.db2.gz XXXWKUGDFZUNLK-UHFFFAOYSA-N 1 2 316.788 4.528 20 0 DJADLO Cc1cc(C[N@@H+](C)Cc2ccc(-c3ccccc3Cl)o2)no1 ZINC000092254631 332122846 /nfs/dbraw/zinc/12/28/46/332122846.db2.gz XXXWKUGDFZUNLK-UHFFFAOYSA-N 1 2 316.788 4.528 20 0 DJADLO Cc1cc2[nH+]cn(Cc3ccc(C(F)(F)F)cc3)c2cc1C ZINC000317775737 332178887 /nfs/dbraw/zinc/17/88/87/332178887.db2.gz SBSJDSNOLVWOGN-UHFFFAOYSA-N 1 2 304.315 4.720 20 0 DJADLO C[C@@H](SCCn1cc[nH+]c1)c1ccc(Cl)cc1Cl ZINC000536373040 332234821 /nfs/dbraw/zinc/23/48/21/332234821.db2.gz AHAUUGVLODLDGB-SNVBAGLBSA-N 1 2 301.242 4.684 20 0 DJADLO CCC(CC)n1ccc(C[N@H+](Cc2cccc(F)c2)C2CC2)n1 ZINC000559948393 332296429 /nfs/dbraw/zinc/29/64/29/332296429.db2.gz YCYSLWCPRUKAGD-UHFFFAOYSA-N 1 2 315.436 4.548 20 0 DJADLO CCC(CC)n1ccc(C[N@@H+](Cc2cccc(F)c2)C2CC2)n1 ZINC000559948393 332296431 /nfs/dbraw/zinc/29/64/31/332296431.db2.gz YCYSLWCPRUKAGD-UHFFFAOYSA-N 1 2 315.436 4.548 20 0 DJADLO FC(F)Oc1cccc(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)c1 ZINC000560543408 332356079 /nfs/dbraw/zinc/35/60/79/332356079.db2.gz KFIIMFNPVYINJD-OAHLLOKOSA-N 1 2 321.371 4.745 20 0 DJADLO Clc1cccc(C[N@@H+]2CCC[C@H]2c2cccnc2)c1Cl ZINC000583423060 332398831 /nfs/dbraw/zinc/39/88/31/332398831.db2.gz IGTDOARODOMPQE-HNNXBMFYSA-N 1 2 307.224 4.726 20 0 DJADLO Clc1cccc(C[N@H+]2CCC[C@H]2c2cccnc2)c1Cl ZINC000583423060 332398832 /nfs/dbraw/zinc/39/88/32/332398832.db2.gz IGTDOARODOMPQE-HNNXBMFYSA-N 1 2 307.224 4.726 20 0 DJADLO Cc1cnc(C[NH2+][C@H](C)c2ccc(Cl)cc2Cl)s1 ZINC000122948427 332416146 /nfs/dbraw/zinc/41/61/46/332416146.db2.gz AFXLCHFMLMCTTR-SECBINFHSA-N 1 2 301.242 4.609 20 0 DJADLO CCc1nc(C[NH2+][C@@H](C)c2cc(Cl)sc2Cl)cs1 ZINC000156431948 332470627 /nfs/dbraw/zinc/47/06/27/332470627.db2.gz ARCUUXYPFFBLMI-ZETCQYMHSA-N 1 2 321.298 4.925 20 0 DJADLO Cc1cnc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2Cl)cn1 ZINC000427822351 332527539 /nfs/dbraw/zinc/52/75/39/332527539.db2.gz CWYPJYLVMPRDRI-MNOVXSKESA-N 1 2 310.228 4.504 20 0 DJADLO Cc1cccc(NCc2cn3cc(Cl)ccc3[nH+]2)c1Cl ZINC000312207119 332647158 /nfs/dbraw/zinc/64/71/58/332647158.db2.gz AADDQLKIVRWZSH-UHFFFAOYSA-N 1 2 306.196 4.562 20 0 DJADLO CC[C@@H]([NH2+]Cc1c(Cl)cccc1Cl)c1ccc(F)cn1 ZINC000538709353 332671381 /nfs/dbraw/zinc/67/13/81/332671381.db2.gz PPEFWKGUMQYLIB-CQSZACIVSA-N 1 2 313.203 4.768 20 0 DJADLO CC(C)c1nc([C@@H](C)[NH2+]Cc2c(F)cccc2Cl)cs1 ZINC000460360760 333071394 /nfs/dbraw/zinc/07/13/94/333071394.db2.gz SFBOFAUGCKUSPR-SNVBAGLBSA-N 1 2 312.841 4.910 20 0 DJADLO C[C@H]1C[C@@H](Nc2cc(Cl)cc(C(F)(F)F)c2)c2[nH+]ccn21 ZINC000379034918 333097083 /nfs/dbraw/zinc/09/70/83/333097083.db2.gz YUYZZKJVSBTQKR-QPUJVOFHSA-N 1 2 315.726 4.673 20 0 DJADLO Cc1nc([C@@H](C)[NH2+][C@H](C)c2cc3cccc(F)c3o2)cs1 ZINC000462821569 333119477 /nfs/dbraw/zinc/11/94/77/333119477.db2.gz ZTRXVRPRGXALCV-NXEZZACHSA-N 1 2 304.390 4.749 20 0 DJADLO Cc1cccc([C@H](C)[NH2+][C@@H](C)c2nc(C3CCCCC3)no2)c1 ZINC000185266465 335124402 /nfs/dbraw/zinc/12/44/02/335124402.db2.gz BKHKYUBGSIXKDV-GJZGRUSLSA-N 1 2 313.445 4.838 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1)c1nc(C2CCCCC2)no1 ZINC000185270899 335124444 /nfs/dbraw/zinc/12/44/44/335124444.db2.gz GZIKMJZFYCVAIR-STQMWFEESA-N 1 2 317.408 4.668 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1)c1nc(C2CCCCC2)no1 ZINC000185270935 335124638 /nfs/dbraw/zinc/12/46/38/335124638.db2.gz GZIKMJZFYCVAIR-QWHCGFSZSA-N 1 2 317.408 4.668 20 0 DJADLO O=C(C[C@H]1C=CCCC1)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000187927500 333153835 /nfs/dbraw/zinc/15/38/35/333153835.db2.gz ZHCPBZUWLXQAQW-HNNXBMFYSA-N 1 2 308.381 4.559 20 0 DJADLO Fc1ccc(SCc2[nH+]ccn2Cc2ccccc2)c(F)c1 ZINC000497319506 333235744 /nfs/dbraw/zinc/23/57/44/333235744.db2.gz JIEJAGWOKDZURO-UHFFFAOYSA-N 1 2 316.376 4.502 20 0 DJADLO Cc1nc(C[N@@H+](C)Cc2cccc(-c3ccccc3)c2)cs1 ZINC000500424369 333241887 /nfs/dbraw/zinc/24/18/87/333241887.db2.gz CBAYNBPNANJABB-UHFFFAOYSA-N 1 2 308.450 4.751 20 0 DJADLO Cc1nc(C[N@H+](C)Cc2cccc(-c3ccccc3)c2)cs1 ZINC000500424369 333241889 /nfs/dbraw/zinc/24/18/89/333241889.db2.gz CBAYNBPNANJABB-UHFFFAOYSA-N 1 2 308.450 4.751 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1ccccc1F ZINC000119585839 333255567 /nfs/dbraw/zinc/25/55/67/333255567.db2.gz PPIWRINQWWAJNZ-QRWLVFNGSA-N 1 2 306.384 4.661 20 0 DJADLO Cc1nc(C[N@@H+]([C@@H](C)c2ccccc2Cl)C2CC2)cs1 ZINC000525787290 333313693 /nfs/dbraw/zinc/31/36/93/333313693.db2.gz KEXXYUCMHXJQKB-NSHDSACASA-N 1 2 306.862 4.831 20 0 DJADLO Cc1nc(C[N@H+]([C@@H](C)c2ccccc2Cl)C2CC2)cs1 ZINC000525787290 333313694 /nfs/dbraw/zinc/31/36/94/333313694.db2.gz KEXXYUCMHXJQKB-NSHDSACASA-N 1 2 306.862 4.831 20 0 DJADLO C[N@H+](Cc1cc(Cl)cs1)Cc1nc2ccccc2s1 ZINC000495089016 333352254 /nfs/dbraw/zinc/35/22/54/333352254.db2.gz WYNQEGNVSPJKPU-UHFFFAOYSA-N 1 2 308.859 4.643 20 0 DJADLO C[N@@H+](Cc1cc(Cl)cs1)Cc1nc2ccccc2s1 ZINC000495089016 333352255 /nfs/dbraw/zinc/35/22/55/333352255.db2.gz WYNQEGNVSPJKPU-UHFFFAOYSA-N 1 2 308.859 4.643 20 0 DJADLO C[C@H](c1nc2ccccc2s1)[N@H+](C)Cc1ccc(Cl)cn1 ZINC000521483684 333372530 /nfs/dbraw/zinc/37/25/30/333372530.db2.gz WFLWNPARSUWOCM-LLVKDONJSA-N 1 2 317.845 4.538 20 0 DJADLO C[C@H](c1nc2ccccc2s1)[N@@H+](C)Cc1ccc(Cl)cn1 ZINC000521483684 333372531 /nfs/dbraw/zinc/37/25/31/333372531.db2.gz WFLWNPARSUWOCM-LLVKDONJSA-N 1 2 317.845 4.538 20 0 DJADLO Cc1oc(-c2ccccc2)c(C(=O)Nc2cc[nH+]cc2C)c1C ZINC000186727035 333377494 /nfs/dbraw/zinc/37/74/94/333377494.db2.gz MDOBIHDNNIITTK-UHFFFAOYSA-N 1 2 306.365 4.519 20 0 DJADLO c1sc(C[NH2+][C@@H]2CSc3ccccc32)nc1-c1ccccc1 ZINC000522756121 333385452 /nfs/dbraw/zinc/38/54/52/333385452.db2.gz JYVHMHSDADDIDR-MRXNPFEDSA-N 1 2 324.474 4.747 20 0 DJADLO CCOc1ccccc1[C@H](C)[NH2+]Cc1c(F)cccc1Cl ZINC000531694292 333546585 /nfs/dbraw/zinc/54/65/85/333546585.db2.gz ICIBMZHHXPQYFM-LBPRGKRZSA-N 1 2 307.796 4.729 20 0 DJADLO CC(C)c1ccccc1OCc1c[nH+]cn1Cc1ccccc1 ZINC000563463636 333609332 /nfs/dbraw/zinc/60/93/32/333609332.db2.gz XVDVPWMECXNUOM-UHFFFAOYSA-N 1 2 306.409 4.634 20 0 DJADLO Cc1ccc(NC(=O)N(C)[C@H](c2ccccc2)C(C)C)c(C)[nH+]1 ZINC000152169659 333636186 /nfs/dbraw/zinc/63/61/86/333636186.db2.gz DOCUXOIZBCDVPF-SFHVURJKSA-N 1 2 311.429 4.559 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1csnn1)c1ccc(C2CCCCC2)cc1 ZINC000414294886 333935106 /nfs/dbraw/zinc/93/51/06/333935106.db2.gz FFFRWJBNRPRJKT-KGLIPLIRSA-N 1 2 315.486 4.998 20 0 DJADLO CCc1nc(C)c([C@H](C)[N@H+](C)Cc2nc(C3CC3)cs2)s1 ZINC000343536257 335170545 /nfs/dbraw/zinc/17/05/45/335170545.db2.gz RSADBGDSSRPJOE-NSHDSACASA-N 1 2 321.515 4.541 20 0 DJADLO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2nc(C3CC3)cs2)s1 ZINC000343536257 335170547 /nfs/dbraw/zinc/17/05/47/335170547.db2.gz RSADBGDSSRPJOE-NSHDSACASA-N 1 2 321.515 4.541 20 0 DJADLO Cc1nnc([C@H](C)[NH2+][C@H](C)c2cc(Cl)cc(Cl)c2)s1 ZINC000274270005 334058607 /nfs/dbraw/zinc/05/86/07/334058607.db2.gz WNQQOAPORKCBHW-SFYZADRCSA-N 1 2 316.257 4.565 20 0 DJADLO CC(C)[C@H]1CCCCN1C(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000343512217 335173334 /nfs/dbraw/zinc/17/33/34/335173334.db2.gz OCCXXFHBNOWHEE-LJQANCHMSA-N 1 2 324.424 4.525 20 0 DJADLO c1nc(C2CCCC2)sc1CNc1ccc2c(c1)CCC[NH2+]2 ZINC000414849291 334122128 /nfs/dbraw/zinc/12/21/28/334122128.db2.gz LNAXBTGWLLHFJN-UHFFFAOYSA-N 1 2 313.470 4.771 20 0 DJADLO CCn1ccnc1[C@H](C)[NH2+][C@H](C)c1cccc(Cl)c1Cl ZINC000453106515 334231565 /nfs/dbraw/zinc/23/15/65/334231565.db2.gz DWKZUUHUNISXEE-MNOVXSKESA-N 1 2 312.244 4.622 20 0 DJADLO CCn1cc[nH+]c1[C@H](C)Nc1ccc(CCC(F)(F)F)cc1 ZINC000296833244 334237077 /nfs/dbraw/zinc/23/70/77/334237077.db2.gz MQBLQQAENVNEJL-LBPRGKRZSA-N 1 2 311.351 4.571 20 0 DJADLO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1csc(C(C)C)n1 ZINC000303123920 334301069 /nfs/dbraw/zinc/30/10/69/334301069.db2.gz ASXHGPLGADTCTN-MRXNPFEDSA-N 1 2 316.470 4.612 20 0 DJADLO COc1ccccc1[C@H]1CCC[N@H+]1Cc1csc(C(C)C)n1 ZINC000303123920 334301071 /nfs/dbraw/zinc/30/10/71/334301071.db2.gz ASXHGPLGADTCTN-MRXNPFEDSA-N 1 2 316.470 4.612 20 0 DJADLO Cc1nc(C[NH+]2CCC(=Cc3ccccc3F)CC2)sc1C ZINC000340861843 334390885 /nfs/dbraw/zinc/39/08/85/334390885.db2.gz DXAFECFXJXBQGG-UHFFFAOYSA-N 1 2 316.445 4.578 20 0 DJADLO COc1cc[nH+]cc1CSCc1csc(C2CCCC2)n1 ZINC000341956355 334497574 /nfs/dbraw/zinc/49/75/74/334497574.db2.gz NGKFIORRNFYQQC-UHFFFAOYSA-N 1 2 320.483 4.638 20 0 DJADLO Cc1sc(CNc2cccc[nH+]2)nc1-c1ccc(Cl)cc1 ZINC000443439001 338451631 /nfs/dbraw/zinc/45/16/31/338451631.db2.gz SDOSHXAZMZAKMC-UHFFFAOYSA-N 1 2 315.829 4.779 20 0 DJADLO Cc1cccc(NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)c1C ZINC000112625181 334720000 /nfs/dbraw/zinc/72/00/00/334720000.db2.gz ZMIXGLGVANSNAQ-UHFFFAOYSA-N 1 2 318.376 4.743 20 0 DJADLO CCC[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccc(F)cc1F ZINC000343680254 335187748 /nfs/dbraw/zinc/18/77/48/335187748.db2.gz DUODYAKFTVINCS-HNNXBMFYSA-N 1 2 322.424 4.930 20 0 DJADLO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@@H+]1Cc1nc(C2CC2)cs1 ZINC000343744968 335190017 /nfs/dbraw/zinc/19/00/17/335190017.db2.gz VWIBRRIUFARYHI-NEPJUHHUSA-N 1 2 316.445 4.667 20 0 DJADLO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@H+]1Cc1nc(C2CC2)cs1 ZINC000343744968 335190018 /nfs/dbraw/zinc/19/00/18/335190018.db2.gz VWIBRRIUFARYHI-NEPJUHHUSA-N 1 2 316.445 4.667 20 0 DJADLO COc1cccc2cc([C@@H](C)[NH2+][C@H](C)c3csc(C)n3)oc21 ZINC000344099347 335217997 /nfs/dbraw/zinc/21/79/97/335217997.db2.gz KCMQBJCODPESFH-GHMZBOCLSA-N 1 2 316.426 4.618 20 0 DJADLO CCC[C@H]([NH2+]Cc1cn[nH]c1C)c1ccc(Cl)c(Cl)c1 ZINC000113352971 335325074 /nfs/dbraw/zinc/32/50/74/335325074.db2.gz GCPYAOFGURUPAF-HNNXBMFYSA-N 1 2 312.244 4.656 20 0 DJADLO CC(C)c1nc([C@H](C)[NH2+]Cc2ccc3ccccc3n2)cs1 ZINC000347831700 335531043 /nfs/dbraw/zinc/53/10/43/335531043.db2.gz MNURHOQXEIDKDH-ZDUSSCGKSA-N 1 2 311.454 4.666 20 0 DJADLO Cc1ccccc1[C@@H](CC(F)(F)F)[NH2+]Cc1ncc(C2CC2)o1 ZINC000444790736 338489013 /nfs/dbraw/zinc/48/90/13/338489013.db2.gz KHTPMNUIDCVGQC-CQSZACIVSA-N 1 2 324.346 4.644 20 0 DJADLO CCC[C@@H]([NH2+]Cc1ncc(Cl)s1)c1ccc(F)cc1F ZINC000349644563 335687972 /nfs/dbraw/zinc/68/79/72/335687972.db2.gz IEUXAXATJYFSRP-GFCCVEGCSA-N 1 2 316.804 4.706 20 0 DJADLO Cc1nc(C[NH2+][C@H](C)c2ccc(Cl)cc2Cl)sc1C ZINC000094965357 335763076 /nfs/dbraw/zinc/76/30/76/335763076.db2.gz BFQJJNDEJGEFBK-SECBINFHSA-N 1 2 315.269 4.918 20 0 DJADLO COc1ccccc1[C@@H](C)[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC000324018814 335769831 /nfs/dbraw/zinc/76/98/31/335769831.db2.gz LLGAJUGXBPEEJC-IIBYNOLFSA-N 1 2 318.420 4.530 20 0 DJADLO CCc1ccc(N[C@@H](c2[nH]cc[nH+]2)c2ccc(F)cc2)cc1CC ZINC000527360478 335842268 /nfs/dbraw/zinc/84/22/68/335842268.db2.gz IPDYDADNAKSNHH-LJQANCHMSA-N 1 2 323.415 4.875 20 0 DJADLO CC(C)c1[nH+]c2ccccc2n1Cc1noc(C2CCCCC2)n1 ZINC000445660116 338504916 /nfs/dbraw/zinc/50/49/16/338504916.db2.gz LVUNTUDETOHQET-UHFFFAOYSA-N 1 2 324.428 4.639 20 0 DJADLO CSCc1cnc(C[N@@H+]2CC[C@@H](C)C[C@H]2c2ccco2)s1 ZINC000351699886 336059633 /nfs/dbraw/zinc/05/96/33/336059633.db2.gz HECXGNNXYISNST-OCCSQVGLSA-N 1 2 322.499 4.572 20 0 DJADLO CSCc1cnc(C[N@H+]2CC[C@@H](C)C[C@H]2c2ccco2)s1 ZINC000351699886 336059635 /nfs/dbraw/zinc/05/96/35/336059635.db2.gz HECXGNNXYISNST-OCCSQVGLSA-N 1 2 322.499 4.572 20 0 DJADLO C[N@@H+](Cc1csc2ccccc12)Cc1ncc(Cl)s1 ZINC000352010747 336188668 /nfs/dbraw/zinc/18/86/68/336188668.db2.gz IZAWSGLWXVKEEP-UHFFFAOYSA-N 1 2 308.859 4.643 20 0 DJADLO C[N@H+](Cc1csc2ccccc12)Cc1ncc(Cl)s1 ZINC000352010747 336188669 /nfs/dbraw/zinc/18/86/69/336188669.db2.gz IZAWSGLWXVKEEP-UHFFFAOYSA-N 1 2 308.859 4.643 20 0 DJADLO Cc1cccc2c1OCC[C@H]2Nc1[nH+]ccc2ccc(F)cc21 ZINC000352446560 336219452 /nfs/dbraw/zinc/21/94/52/336219452.db2.gz WPKQDFISCYSSLN-QGZVFWFLSA-N 1 2 308.356 4.618 20 0 DJADLO CCC(CC)([NH2+]Cc1noc(C(C)C)n1)c1ccc(Cl)cc1 ZINC000103480386 336241896 /nfs/dbraw/zinc/24/18/96/336241896.db2.gz QYQPAGKRBLLPMA-UHFFFAOYSA-N 1 2 321.852 4.652 20 0 DJADLO C[C@H](c1ccc(Cl)cc1)[N@@H+]1CCO[C@H](c2cccs2)C1 ZINC000532379403 336244199 /nfs/dbraw/zinc/24/41/99/336244199.db2.gz KEFHRLJLMHYGTO-DOMZBBRYSA-N 1 2 307.846 4.536 20 0 DJADLO C[C@H](c1ccc(Cl)cc1)[N@H+]1CCO[C@H](c2cccs2)C1 ZINC000532379403 336244200 /nfs/dbraw/zinc/24/42/00/336244200.db2.gz KEFHRLJLMHYGTO-DOMZBBRYSA-N 1 2 307.846 4.536 20 0 DJADLO CC[N@H+](Cc1cc(C)on1)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000532714177 336267881 /nfs/dbraw/zinc/26/78/81/336267881.db2.gz GAQDDWYLEFPRKN-FQEVSTJZSA-N 1 2 324.399 4.734 20 0 DJADLO CC[N@@H+](Cc1cc(C)on1)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000532714177 336267882 /nfs/dbraw/zinc/26/78/82/336267882.db2.gz GAQDDWYLEFPRKN-FQEVSTJZSA-N 1 2 324.399 4.734 20 0 DJADLO C[N@H+](Cc1nc2ccccc2o1)Cc1cc(Cl)ccc1Cl ZINC000532744054 336269237 /nfs/dbraw/zinc/26/92/37/336269237.db2.gz AJNMHEKBZXUGAX-UHFFFAOYSA-N 1 2 321.207 4.767 20 0 DJADLO C[N@@H+](Cc1nc2ccccc2o1)Cc1cc(Cl)ccc1Cl ZINC000532744054 336269238 /nfs/dbraw/zinc/26/92/38/336269238.db2.gz AJNMHEKBZXUGAX-UHFFFAOYSA-N 1 2 321.207 4.767 20 0 DJADLO COc1ccccc1[C@H]([NH2+]Cc1ccc(C)cc1C)c1ccco1 ZINC000532866793 336273220 /nfs/dbraw/zinc/27/32/20/336273220.db2.gz XRDBCTDXIBOUST-NRFANRHFSA-N 1 2 321.420 4.784 20 0 DJADLO Cc1c[nH]c(-c2ccccc2NC(=O)C[C@@H]2CCCC[C@H]2C)[nH+]1 ZINC000532862002 336273359 /nfs/dbraw/zinc/27/33/59/336273359.db2.gz KBGWQDVLCLFYID-HIFRSBDPSA-N 1 2 311.429 4.540 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1cc2ccccc2o1)c1nc2ccccc2o1 ZINC000182627862 336276565 /nfs/dbraw/zinc/27/65/65/336276565.db2.gz MIBXDUKIHYALEA-QWHCGFSZSA-N 1 2 306.365 4.986 20 0 DJADLO Nc1cc(CSc2ccc(Cl)c(C(F)(F)F)c2)cc[nH+]1 ZINC000193049930 336292792 /nfs/dbraw/zinc/29/27/92/336292792.db2.gz FEQMDLKHEFDZPC-UHFFFAOYSA-N 1 2 318.751 4.628 20 0 DJADLO c1csc([C@H](Nc2ccc3ccccc3[nH+]2)c2ccccc2)n1 ZINC000301179427 336293628 /nfs/dbraw/zinc/29/36/28/336293628.db2.gz HHRDNHAVVMSJLP-GOSISDBHSA-N 1 2 317.417 4.893 20 0 DJADLO C[C@@H](Nc1cc[nH+]c(C2CC2)n1)c1ccc(-c2cccnc2)cc1 ZINC000301480057 336309442 /nfs/dbraw/zinc/30/94/42/336309442.db2.gz RLVSPARZFJYOFG-CQSZACIVSA-N 1 2 316.408 4.589 20 0 DJADLO CC(C)(C)c1nc(N[C@@H]2CCSc3c(F)cccc32)cc[nH+]1 ZINC000301564074 336315164 /nfs/dbraw/zinc/31/51/64/336315164.db2.gz YSYHBEIHSZPUJS-CYBMUJFWSA-N 1 2 317.433 4.562 20 0 DJADLO Cc1cc(N[C@@H](C)c2cccc(N3CCCC3)c2)nc(C(C)C)[nH+]1 ZINC000301585122 336316466 /nfs/dbraw/zinc/31/64/66/336316466.db2.gz VSJCHMNSHKLPAV-INIZCTEOSA-N 1 2 324.472 4.682 20 0 DJADLO CCOc1ccc([C@@H](C)Nc2cc(C(F)(F)F)cc[nH+]2)cc1 ZINC000301590587 336316823 /nfs/dbraw/zinc/31/68/23/336316823.db2.gz QKPBNHYHOHDZFT-LLVKDONJSA-N 1 2 310.319 4.672 20 0 DJADLO Cc1cccc([C@H]2CCCN2c2cc(C)[nH+]c3c(F)cccc23)n1 ZINC000301725636 336325819 /nfs/dbraw/zinc/32/58/19/336325819.db2.gz UUJCLDTZFNHZLK-GOSISDBHSA-N 1 2 321.399 4.727 20 0 DJADLO CC[C@@H](Nc1cc(C(C)C)[nH+]c(C(C)C)n1)c1c(C)noc1C ZINC000301846560 336333849 /nfs/dbraw/zinc/33/38/49/336333849.db2.gz BANCANIXVJZGDO-CQSZACIVSA-N 1 2 316.449 4.891 20 0 DJADLO Cc1cc2ccccc2[nH+]c1N[C@H]1CCO[C@H](c2ccccc2)C1 ZINC000302157632 336351377 /nfs/dbraw/zinc/35/13/77/336351377.db2.gz FUQZQBSMGSTKIA-ICSRJNTNSA-N 1 2 318.420 4.875 20 0 DJADLO Cc1cc2ccccc2[nH+]c1N[C@@H]1CCO[C@@H](c2ccccc2)C1 ZINC000302157634 336351387 /nfs/dbraw/zinc/35/13/87/336351387.db2.gz FUQZQBSMGSTKIA-UYAOXDASSA-N 1 2 318.420 4.875 20 0 DJADLO CSCc1cccc(CNc2cc(C(F)(F)F)cc[nH+]2)c1 ZINC000302520124 336360741 /nfs/dbraw/zinc/36/07/41/336360741.db2.gz XHQNRLDCLXFAQI-UHFFFAOYSA-N 1 2 312.360 4.576 20 0 DJADLO CCc1nc(C[NH2+]Cc2ccc(-c3ccc(C)cc3)o2)cs1 ZINC000107715565 336392637 /nfs/dbraw/zinc/39/26/37/336392637.db2.gz PMFQYMBYMBCWCV-UHFFFAOYSA-N 1 2 312.438 4.564 20 0 DJADLO Clc1cc(C[NH+]2CCC(OC3CCC3)CC2)c(Cl)s1 ZINC000418094725 336399450 /nfs/dbraw/zinc/39/94/50/336399450.db2.gz SNQQBYLDMBENTR-UHFFFAOYSA-N 1 2 320.285 4.588 20 0 DJADLO CC(C)(C)[C@H]1CCCN1C(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000353114549 336403140 /nfs/dbraw/zinc/40/31/40/336403140.db2.gz PEYJFSVPGZRQTR-GOSISDBHSA-N 1 2 324.424 4.525 20 0 DJADLO Cc1nc([C@@H](C)[NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)cs1 ZINC000360994206 336731495 /nfs/dbraw/zinc/73/14/95/336731495.db2.gz DIDIPGHHEBDHNB-IUODEOHRSA-N 1 2 314.454 4.549 20 0 DJADLO Cc1ccc(NC(=O)c2cscc2-c2ccccc2)c(C)[nH+]1 ZINC000362018853 336782098 /nfs/dbraw/zinc/78/20/98/336782098.db2.gz WXWCALARHRSJFW-UHFFFAOYSA-N 1 2 308.406 4.679 20 0 DJADLO C[C@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1cccc(F)c1F ZINC000371509823 336906624 /nfs/dbraw/zinc/90/66/24/336906624.db2.gz QYGNNUMPRKCQSK-VBKZILBWSA-N 1 2 324.374 4.800 20 0 DJADLO FC(F)(F)c1ncc(C[N@@H+]2CCC[C@H]2c2cccs2)s1 ZINC000375716776 337017546 /nfs/dbraw/zinc/01/75/46/337017546.db2.gz DEVHXGRJZREGNB-JTQLQIEISA-N 1 2 318.389 4.561 20 0 DJADLO FC(F)(F)c1ncc(C[N@H+]2CCC[C@H]2c2cccs2)s1 ZINC000375716776 337017547 /nfs/dbraw/zinc/01/75/47/337017547.db2.gz DEVHXGRJZREGNB-JTQLQIEISA-N 1 2 318.389 4.561 20 0 DJADLO Cc1ccccc1[C@@H](C)[NH2+][C@@H](c1nccs1)c1ccccc1 ZINC000123263443 337041608 /nfs/dbraw/zinc/04/16/08/337041608.db2.gz ZWKUCDCEANEHGY-CRAIPNDOSA-N 1 2 308.450 4.892 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)C/C=C/c1ccc(C(C)C)cc1 ZINC000425596402 337089185 /nfs/dbraw/zinc/08/91/85/337089185.db2.gz NCRLSRZBBLLMTA-AATRIKPKSA-N 1 2 308.425 4.864 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)cc(Cl)c1)c1cscn1 ZINC000582736558 337127867 /nfs/dbraw/zinc/12/78/67/337127867.db2.gz ANOHVTCLOIWHQE-DTWKUNHWSA-N 1 2 301.242 4.862 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1ncc(-c2ccccc2)o1)c1cccc(F)c1 ZINC000172581907 337130139 /nfs/dbraw/zinc/13/01/39/337130139.db2.gz XALDIWKZWLDEEC-KGLIPLIRSA-N 1 2 310.372 4.893 20 0 DJADLO Cc1ccc(C)c(C[NH2+][C@@H](C)c2nc(C3CCCCC3)no2)c1 ZINC000173867828 337138647 /nfs/dbraw/zinc/13/86/47/337138647.db2.gz UNRUAOJABURMQN-HNNXBMFYSA-N 1 2 313.445 4.585 20 0 DJADLO Cc1scc(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)c1C ZINC000179925156 337172566 /nfs/dbraw/zinc/17/25/66/337172566.db2.gz VZKBKWJXLGFKHG-UHFFFAOYSA-N 1 2 324.405 4.805 20 0 DJADLO CC(C)c1cnc(C[NH2+][C@@H](c2ccco2)c2ccccc2)s1 ZINC000183406070 337191643 /nfs/dbraw/zinc/19/16/43/337191643.db2.gz SHBJCNFCDOMVPF-GOSISDBHSA-N 1 2 312.438 4.739 20 0 DJADLO C[N@H+](Cc1ccco1)Cc1nc(-c2ccccc2Cl)cs1 ZINC000186468260 337256442 /nfs/dbraw/zinc/25/64/42/337256442.db2.gz BAWBDUNSOUVCPX-UHFFFAOYSA-N 1 2 318.829 4.689 20 0 DJADLO C[N@@H+](Cc1ccco1)Cc1nc(-c2ccccc2Cl)cs1 ZINC000186468260 337256443 /nfs/dbraw/zinc/25/64/43/337256443.db2.gz BAWBDUNSOUVCPX-UHFFFAOYSA-N 1 2 318.829 4.689 20 0 DJADLO Cc1cc([C@H](C)[NH2+][C@@H](c2ccccc2)c2ccccn2)c(C)o1 ZINC000321410184 337262526 /nfs/dbraw/zinc/26/25/26/337262526.db2.gz BEVSQTNBMNIQKR-YWZLYKJASA-N 1 2 306.409 4.732 20 0 DJADLO Cc1nc([C@H]2CCC[N@H+]2Cc2ccccc2OC(C)C)cs1 ZINC000189757416 337282542 /nfs/dbraw/zinc/28/25/42/337282542.db2.gz OHIMLSQTTCBODD-QGZVFWFLSA-N 1 2 316.470 4.576 20 0 DJADLO Cc1nc([C@H]2CCC[N@@H+]2Cc2ccccc2OC(C)C)cs1 ZINC000189757416 337282543 /nfs/dbraw/zinc/28/25/43/337282543.db2.gz OHIMLSQTTCBODD-QGZVFWFLSA-N 1 2 316.470 4.576 20 0 DJADLO Clc1ccsc1C[NH2+][C@H](c1nccs1)c1ccccc1 ZINC000193070264 337309165 /nfs/dbraw/zinc/30/91/65/337309165.db2.gz OEEJEWCQRPNGKI-AWEZNQCLSA-N 1 2 320.870 4.737 20 0 DJADLO C[C@H]([NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1)c1nc2c(s1)CCCC2 ZINC000584486158 337349730 /nfs/dbraw/zinc/34/97/30/337349730.db2.gz RSTIJZDNFWVMPD-OBJOEFQTSA-N 1 2 316.470 4.589 20 0 DJADLO Cc1cc([C@@H](C)[NH2+][C@H](COCC(C)C)c2ccco2)c(C)o1 ZINC000584569552 337363486 /nfs/dbraw/zinc/36/34/86/337363486.db2.gz LHEMXUJIGOHNJV-RHSMWYFYSA-N 1 2 305.418 4.554 20 0 DJADLO Cc1nc(C[NH2+][C@@H](C)c2cccc(Cl)c2Cl)cs1 ZINC000117951344 337393859 /nfs/dbraw/zinc/39/38/59/337393859.db2.gz QLTFXJPBQBWPRN-QMMMGPOBSA-N 1 2 301.242 4.609 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1nccs1)c1ccccc1)c1cccs1 ZINC000123144041 337397958 /nfs/dbraw/zinc/39/79/58/337397958.db2.gz KXYOITISSQAVBT-IUODEOHRSA-N 1 2 300.452 4.645 20 0 DJADLO CC[C@@H]([NH2+][C@@H](C)c1noc(-c2ccccc2)n1)c1cccs1 ZINC000124349324 337404981 /nfs/dbraw/zinc/40/49/81/337404981.db2.gz NUCBOMSRZAUROW-GXTWGEPZSA-N 1 2 313.426 4.600 20 0 DJADLO CC(C)n1cc[nH+]c1CSC[C@@H]1CCC2(CCCCC2)O1 ZINC000188733300 337426872 /nfs/dbraw/zinc/42/68/72/337426872.db2.gz NTPCDXLYAWLFIN-HNNXBMFYSA-N 1 2 308.491 4.579 20 0 DJADLO Cc1cnc([C@H](C)SCc2ccc(C(C)C)[nH+]c2C)cn1 ZINC000419498184 337485691 /nfs/dbraw/zinc/48/56/91/337485691.db2.gz WFNWFFLODKLAID-AWEZNQCLSA-N 1 2 301.459 4.606 20 0 DJADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+][C@H](c2ccccc2)c2cccnc2)o1 ZINC000245843871 337495168 /nfs/dbraw/zinc/49/51/68/337495168.db2.gz HWTXCOUIHPZQSW-MFMILTCTSA-N 1 2 318.420 4.677 20 0 DJADLO CC(C)c1nc(C[NH2+][C@@H](CC(F)F)c2ccccc2)cs1 ZINC000420994975 337518126 /nfs/dbraw/zinc/51/81/26/337518126.db2.gz NWEZPAVBSRJINM-AWEZNQCLSA-N 1 2 310.413 4.753 20 0 DJADLO c1coc(C[NH+](Cc2ccco2)Cc2ccc3ncccc3c2)c1 ZINC000162563632 337637553 /nfs/dbraw/zinc/63/75/53/337637553.db2.gz WGTGKYZCISMJTI-UHFFFAOYSA-N 1 2 318.376 4.623 20 0 DJADLO CCc1nc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2OC)cs1 ZINC000421835959 337652395 /nfs/dbraw/zinc/65/23/95/337652395.db2.gz QOPMMRIWVLFNID-GHMZBOCLSA-N 1 2 324.877 4.779 20 0 DJADLO COc1cc([C@H](C)Nc2ccc3c(c2)CC[NH2+]3)ccc1SC ZINC000423216561 337705003 /nfs/dbraw/zinc/70/50/03/337705003.db2.gz OTDICIGGOUTNMF-LBPRGKRZSA-N 1 2 314.454 4.558 20 0 DJADLO Cc1nc(C(C)(C)C)sc1[C@H](C)Nc1ccc2c(c1)CC[NH2+]2 ZINC000423220497 337705338 /nfs/dbraw/zinc/70/53/38/337705338.db2.gz VIKILWJVRJYBIM-NSHDSACASA-N 1 2 315.486 4.890 20 0 DJADLO Clc1ccc2c(c1)OCCC[C@@H]2Nc1ccc2c(c1)CC[NH2+]2 ZINC000423222126 337705577 /nfs/dbraw/zinc/70/55/77/337705577.db2.gz ZTPXVJKKUNYXMB-KRWDZBQOSA-N 1 2 314.816 4.634 20 0 DJADLO COc1cc(C)ccc1[C@@H](C)[NH2+]Cc1coc(-c2ccccc2)n1 ZINC000536872743 337752695 /nfs/dbraw/zinc/75/26/95/337752695.db2.gz VFAOHNKSQCDIPB-OAHLLOKOSA-N 1 2 322.408 4.509 20 0 DJADLO CC(C)n1c[nH+]cc1CNc1ccc2nc(C3CC3)sc2c1 ZINC000424151533 337776360 /nfs/dbraw/zinc/77/63/60/337776360.db2.gz HVNVMTCLTULMSA-UHFFFAOYSA-N 1 2 312.442 4.563 20 0 DJADLO CC(C)c1nc2ccc(NCc3c[nH+]cn3C(C)C)cc2s1 ZINC000424154170 337781437 /nfs/dbraw/zinc/78/14/37/337781437.db2.gz MHEYHNYFLODITN-UHFFFAOYSA-N 1 2 314.458 4.809 20 0 DJADLO Cc1ccc([C@@H](C)[NH2+][C@@H]2COc3c2ccc(Cl)c3Cl)o1 ZINC000536875513 337790995 /nfs/dbraw/zinc/79/09/95/337790995.db2.gz GXILGKPZYLRADG-BXKDBHETSA-N 1 2 312.196 4.679 20 0 DJADLO COc1ccc([C@@H](C)[NH2+][C@H](C)c2nc(C)cs2)c(Cl)c1 ZINC000424261668 337813200 /nfs/dbraw/zinc/81/32/00/337813200.db2.gz CPLOITJEZXSJMK-GHMZBOCLSA-N 1 2 310.850 4.525 20 0 DJADLO CCc1nc([C@H](C)[NH2+][C@@H](C)c2ccc(OC)cc2Cl)cs1 ZINC000424327705 337821573 /nfs/dbraw/zinc/82/15/73/337821573.db2.gz ZIGZWFYSZNKELF-QWRGUYRKSA-N 1 2 324.877 4.779 20 0 DJADLO Cc1c[nH+]ccc1NC(=O)CCCSc1ccc(Cl)cc1 ZINC000107293101 337828340 /nfs/dbraw/zinc/82/83/40/337828340.db2.gz RMXKVFICUUTURV-UHFFFAOYSA-N 1 2 320.845 4.554 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1ccco1)c1ccccc1)c1cc(F)cc(F)c1 ZINC000120837377 337881348 /nfs/dbraw/zinc/88/13/48/337881348.db2.gz LQENEJCSVRFVIE-BFUOFWGJSA-N 1 2 313.347 4.998 20 0 DJADLO COc1ccccc1[C@@H]([NH2+][C@H](C)c1cccs1)c1ccco1 ZINC000090534912 337882314 /nfs/dbraw/zinc/88/23/14/337882314.db2.gz FXVAJDRVYFNQIO-FZKQIMNGSA-N 1 2 313.422 4.790 20 0 DJADLO Cc1cc(C[NH2+][C@@H](C)c2ccccc2Oc2ccccc2)no1 ZINC000537059139 337883182 /nfs/dbraw/zinc/88/31/82/337883182.db2.gz QUJXLCHYKVQXFZ-HNNXBMFYSA-N 1 2 308.381 4.626 20 0 DJADLO COc1ccccc1[C@@H]([NH2+][C@@H](C)c1ccccc1)c1ccccn1 ZINC000090913222 337887147 /nfs/dbraw/zinc/88/71/47/337887147.db2.gz NHNCCGQCFHSXDW-HRAATJIYSA-N 1 2 318.420 4.530 20 0 DJADLO Cc1cccc([C@H]([NH2+][C@@H](C)c2ccccc2F)c2ccccn2)c1 ZINC000090946607 337887192 /nfs/dbraw/zinc/88/71/92/337887192.db2.gz MEFSPXPRJHGXLI-KKSFZXQISA-N 1 2 320.411 4.969 20 0 DJADLO Cc1cccc([C@H]2CCCCCN2C(=O)Nc2cc[nH+]cc2C)c1 ZINC000121536278 337895100 /nfs/dbraw/zinc/89/51/00/337895100.db2.gz FHGZORGPIBPOHA-LJQANCHMSA-N 1 2 323.440 4.848 20 0 DJADLO C[C@H]([NH2+][C@@H](c1cccc(Cl)c1)c1ccccn1)c1cccnc1 ZINC000092767884 337908027 /nfs/dbraw/zinc/90/80/27/337908027.db2.gz JIARQEPVBQTNLI-LIRRHRJNSA-N 1 2 323.827 4.570 20 0 DJADLO Cc1cnc(C[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)s1 ZINC000123027598 337939687 /nfs/dbraw/zinc/93/96/87/337939687.db2.gz LQDICBKWHRVPOS-VIFPVBQESA-N 1 2 301.242 4.609 20 0 DJADLO Fc1cc(N[C@@H](c2ccccc2)C2CC2)ccc1-n1cc[nH+]c1 ZINC000537530191 337940796 /nfs/dbraw/zinc/94/07/96/337940796.db2.gz LMBMJHXJBNKZRI-IBGZPJMESA-N 1 2 307.372 4.575 20 0 DJADLO Cc1cccc2c1CC[C@@H]2[NH2+][C@@H](c1nccs1)c1ccccc1 ZINC000123110637 337944709 /nfs/dbraw/zinc/94/47/09/337944709.db2.gz DTVRJRQFBNMZEY-RBUKOAKNSA-N 1 2 320.461 4.818 20 0 DJADLO Fc1ccc([C@@H]([NH2+]Cc2ccoc2)c2ccccc2Cl)cc1 ZINC000537607174 337947808 /nfs/dbraw/zinc/94/78/08/337947808.db2.gz PLGUSCBBLXRHJA-GOSISDBHSA-N 1 2 315.775 4.951 20 0 DJADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ncc(-c3ccccc3)s2)o1 ZINC000537749035 337960577 /nfs/dbraw/zinc/96/05/77/337960577.db2.gz WDFVOHCBTHHFGR-CJNGLKHVSA-N 1 2 324.449 4.816 20 0 DJADLO C[C@@H]([NH2+]Cc1c(F)cccc1Cl)c1nc2c(s1)CCCC2 ZINC000537883156 337964375 /nfs/dbraw/zinc/96/43/75/337964375.db2.gz PZQLIGSCDGNWON-SNVBAGLBSA-N 1 2 324.852 4.665 20 0 DJADLO CCOc1ccccc1[C@@H](CC(C)C)[NH2+][C@@H](C)c1cc(C)on1 ZINC000514895468 337973515 /nfs/dbraw/zinc/97/35/15/337973515.db2.gz YISFQBAVZJFJKM-MAUKXSAKSA-N 1 2 316.445 4.820 20 0 DJADLO CCOc1ccccc1[C@H](CC(C)C)[NH2+][C@@H](C)c1cc(C)on1 ZINC000514895471 337973564 /nfs/dbraw/zinc/97/35/64/337973564.db2.gz YISFQBAVZJFJKM-YJBOKZPZSA-N 1 2 316.445 4.820 20 0 DJADLO Cc1cccc2c1[C@@H](C)C[C@@H]2CC(=O)Nc1c(C)cc[nH+]c1C ZINC000425596721 338015796 /nfs/dbraw/zinc/01/57/96/338015796.db2.gz OSAJNQLXDPCJBE-GOEBONIOSA-N 1 2 308.425 4.626 20 0 DJADLO Cc1cccc2c1[C@H](C)C[C@@H]2CC(=O)Nc1c(C)cc[nH+]c1C ZINC000425596720 338015806 /nfs/dbraw/zinc/01/58/06/338015806.db2.gz OSAJNQLXDPCJBE-GDBMZVCRSA-N 1 2 308.425 4.626 20 0 DJADLO Cc1cccc2c1[C@@H](C)C[C@H]2CC(=O)Nc1c(C)cc[nH+]c1C ZINC000425596722 338015821 /nfs/dbraw/zinc/01/58/21/338015821.db2.gz OSAJNQLXDPCJBE-HOCLYGCPSA-N 1 2 308.425 4.626 20 0 DJADLO Cc1ccc2cc([C@@H](C)[NH2+]Cc3ccn(C4CCCC4)n3)oc2c1 ZINC000426062376 338020225 /nfs/dbraw/zinc/02/02/25/338020225.db2.gz MNFFZTOHFSTORT-OAHLLOKOSA-N 1 2 323.440 4.904 20 0 DJADLO Cc1nc(C(C)C)oc1C[N@@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000428219918 338043019 /nfs/dbraw/zinc/04/30/19/338043019.db2.gz NNHDHBZEAXKZOI-HNNXBMFYSA-N 1 2 304.821 4.707 20 0 DJADLO Cc1nc(C(C)C)oc1C[N@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000428219918 338043020 /nfs/dbraw/zinc/04/30/20/338043020.db2.gz NNHDHBZEAXKZOI-HNNXBMFYSA-N 1 2 304.821 4.707 20 0 DJADLO CCCc1ccc([C@H]([NH2+]Cc2cocn2)c2cccs2)cc1 ZINC000428873165 338063970 /nfs/dbraw/zinc/06/39/70/338063970.db2.gz VDVPMUNOEKOMRC-SFHVURJKSA-N 1 2 312.438 4.568 20 0 DJADLO CC1(CC(=O)Nc2ccc(Oc3cc[nH+]cc3)c(Cl)c2)CC1 ZINC000428930570 338065353 /nfs/dbraw/zinc/06/53/53/338065353.db2.gz XGFKNWLEFRERFQ-UHFFFAOYSA-N 1 2 316.788 4.656 20 0 DJADLO Cc1nc(C(C)C)oc1C[N@H+](C)Cc1cc(Cl)ccc1F ZINC000428985082 338067817 /nfs/dbraw/zinc/06/78/17/338067817.db2.gz UNJZRCRJTQIYKH-UHFFFAOYSA-N 1 2 310.800 4.531 20 0 DJADLO Cc1nc(C(C)C)oc1C[N@@H+](C)Cc1cc(Cl)ccc1F ZINC000428985082 338067818 /nfs/dbraw/zinc/06/78/18/338067818.db2.gz UNJZRCRJTQIYKH-UHFFFAOYSA-N 1 2 310.800 4.531 20 0 DJADLO Cc1ccoc1C[N@H+](C)Cc1coc(-c2cccc(Cl)c2)n1 ZINC000429366355 338078750 /nfs/dbraw/zinc/07/87/50/338078750.db2.gz LKLGAMJCWFFEMA-UHFFFAOYSA-N 1 2 316.788 4.528 20 0 DJADLO Cc1ccoc1C[N@@H+](C)Cc1coc(-c2cccc(Cl)c2)n1 ZINC000429366355 338078751 /nfs/dbraw/zinc/07/87/51/338078751.db2.gz LKLGAMJCWFFEMA-UHFFFAOYSA-N 1 2 316.788 4.528 20 0 DJADLO C[C@@H](c1cc2ccccc2o1)[N@H+](C)Cc1cc(C(C)(C)C)on1 ZINC000429708131 338087836 /nfs/dbraw/zinc/08/78/36/338087836.db2.gz KUNBCNZNTVJATH-ZDUSSCGKSA-N 1 2 312.413 4.911 20 0 DJADLO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)Cc1cc(C(C)(C)C)on1 ZINC000429708131 338087837 /nfs/dbraw/zinc/08/78/37/338087837.db2.gz KUNBCNZNTVJATH-ZDUSSCGKSA-N 1 2 312.413 4.911 20 0 DJADLO CCC(CC)n1ccc(C[N@H+](C)Cc2cccc(Cl)c2)n1 ZINC000448470798 338095253 /nfs/dbraw/zinc/09/52/53/338095253.db2.gz IKAZWBUJFFAWKI-UHFFFAOYSA-N 1 2 305.853 4.530 20 0 DJADLO CCC(CC)n1ccc(C[N@@H+](C)Cc2cccc(Cl)c2)n1 ZINC000448470798 338095254 /nfs/dbraw/zinc/09/52/54/338095254.db2.gz IKAZWBUJFFAWKI-UHFFFAOYSA-N 1 2 305.853 4.530 20 0 DJADLO Cc1cc2[nH]c(C[N@@H+]3CC(C)(C)[C@@H]3c3cccnc3)cc2c(C)c1 ZINC000430104354 338096920 /nfs/dbraw/zinc/09/69/20/338096920.db2.gz NFSMOUCIXNJDFS-FQEVSTJZSA-N 1 2 319.452 4.763 20 0 DJADLO Cc1cc2[nH]c(C[N@H+]3CC(C)(C)[C@@H]3c3cccnc3)cc2c(C)c1 ZINC000430104354 338096921 /nfs/dbraw/zinc/09/69/21/338096921.db2.gz NFSMOUCIXNJDFS-FQEVSTJZSA-N 1 2 319.452 4.763 20 0 DJADLO CCc1noc(C)c1C[N@@H+]1CCCC[C@@H]1c1ccc(F)cc1F ZINC000432017359 338143697 /nfs/dbraw/zinc/14/36/97/338143697.db2.gz BYHVXUGQPGNNPA-GOSISDBHSA-N 1 2 320.383 4.551 20 0 DJADLO CCc1noc(C)c1C[N@H+]1CCCC[C@@H]1c1ccc(F)cc1F ZINC000432017359 338143698 /nfs/dbraw/zinc/14/36/98/338143698.db2.gz BYHVXUGQPGNNPA-GOSISDBHSA-N 1 2 320.383 4.551 20 0 DJADLO Cc1noc(C)c1-c1ccc(OCc2ccc(C)[nH+]c2C)cc1 ZINC000432331186 338153218 /nfs/dbraw/zinc/15/32/18/338153218.db2.gz JWBSVUPTDZUKHE-UHFFFAOYSA-N 1 2 308.381 4.549 20 0 DJADLO Cc1ccc(C[N@H+](Cc2cocn2)[C@@H]2CCc3ccccc32)cc1 ZINC000432736213 338165006 /nfs/dbraw/zinc/16/50/06/338165006.db2.gz BXPYJMCCBULESK-OAQYLSRUSA-N 1 2 318.420 4.673 20 0 DJADLO Cc1ccc(C[N@@H+](Cc2cocn2)[C@@H]2CCc3ccccc32)cc1 ZINC000432736213 338165007 /nfs/dbraw/zinc/16/50/07/338165007.db2.gz BXPYJMCCBULESK-OAQYLSRUSA-N 1 2 318.420 4.673 20 0 DJADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2csc(Cl)c2Cl)on1 ZINC000432744619 338165787 /nfs/dbraw/zinc/16/57/87/338165787.db2.gz LEGHOMOAJHTWEU-SNVBAGLBSA-N 1 2 317.241 4.688 20 0 DJADLO Cc1cc([C@H]2CCC[N@H+]2Cc2csc(Cl)c2Cl)on1 ZINC000432744619 338165788 /nfs/dbraw/zinc/16/57/88/338165788.db2.gz LEGHOMOAJHTWEU-SNVBAGLBSA-N 1 2 317.241 4.688 20 0 DJADLO CC[N@H+](Cc1ccccn1)Cc1ccc(F)c(Cl)c1Cl ZINC000432749769 338166164 /nfs/dbraw/zinc/16/61/64/338166164.db2.gz IWOFZAWUBJHNMC-UHFFFAOYSA-N 1 2 313.203 4.550 20 0 DJADLO CC[N@@H+](Cc1ccccn1)Cc1ccc(F)c(Cl)c1Cl ZINC000432749769 338166165 /nfs/dbraw/zinc/16/61/65/338166165.db2.gz IWOFZAWUBJHNMC-UHFFFAOYSA-N 1 2 313.203 4.550 20 0 DJADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1csc(Cl)c1Cl ZINC000432916537 338172977 /nfs/dbraw/zinc/17/29/77/338172977.db2.gz IBLQHWYMRACRSW-VIFPVBQESA-N 1 2 301.242 4.643 20 0 DJADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1csc(Cl)c1Cl ZINC000432916537 338172978 /nfs/dbraw/zinc/17/29/78/338172978.db2.gz IBLQHWYMRACRSW-VIFPVBQESA-N 1 2 301.242 4.643 20 0 DJADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1ccc(F)c(Cl)c1Cl ZINC000432918884 338173135 /nfs/dbraw/zinc/17/31/35/338173135.db2.gz QYQDRVKLFTWCHJ-JTQLQIEISA-N 1 2 313.203 4.721 20 0 DJADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1ccc(F)c(Cl)c1Cl ZINC000432918884 338173136 /nfs/dbraw/zinc/17/31/36/338173136.db2.gz QYQDRVKLFTWCHJ-JTQLQIEISA-N 1 2 313.203 4.721 20 0 DJADLO CC(C)O[C@@H](C[NH2+][C@H](c1ccccc1)C(F)F)c1ccccc1 ZINC000433052557 338178711 /nfs/dbraw/zinc/17/87/11/338178711.db2.gz MRJXGWIEUYSTGT-ZWKOTPCHSA-N 1 2 319.395 4.749 20 0 DJADLO CC(C)(C)c1ccccc1C(=O)Nc1cccc(-c2[nH]cc[nH+]2)c1 ZINC000433754599 338200674 /nfs/dbraw/zinc/20/06/74/338200674.db2.gz XJKPADTVAHHMJT-UHFFFAOYSA-N 1 2 319.408 4.627 20 0 DJADLO c1csc(-c2ccc(CSCCn3cc[nH+]c3)cc2)c1 ZINC000434628166 338221899 /nfs/dbraw/zinc/22/18/99/338221899.db2.gz CZNSEUQGXVKHBM-UHFFFAOYSA-N 1 2 300.452 4.545 20 0 DJADLO CCSCc1cc[nH+]c(NCc2cc3c(cccc3F)[nH]2)c1 ZINC000436025116 338256162 /nfs/dbraw/zinc/25/61/62/338256162.db2.gz UTDWVQCPJNURAK-UHFFFAOYSA-N 1 2 315.417 4.567 20 0 DJADLO CC[C@H](C)c1ccccc1NC(=O)[C@H](C)[NH+]1Cc2ccccc2C1 ZINC000155529202 338287851 /nfs/dbraw/zinc/28/78/51/338287851.db2.gz YXBWUNYDQHAYAN-HOTGVXAUSA-N 1 2 322.452 4.543 20 0 DJADLO c1[nH+]cn(Cc2ccccc2)c1COc1ccc2ccccc2c1 ZINC000437618528 338316387 /nfs/dbraw/zinc/31/63/87/338316387.db2.gz YPYNJIHJYYTYFW-UHFFFAOYSA-N 1 2 314.388 4.664 20 0 DJADLO CSc1ccc(C)c(NCc2c[nH+]cn2Cc2ccccc2)c1 ZINC000438313597 338339357 /nfs/dbraw/zinc/33/93/57/338339357.db2.gz MRYOXUBSFDBCJY-UHFFFAOYSA-N 1 2 323.465 4.574 20 0 DJADLO CC(C)CCc1nc(C[N@H+](C)[C@@H](C)c2cccc(O)c2)cs1 ZINC000440401242 338386808 /nfs/dbraw/zinc/38/68/08/338386808.db2.gz CZTURXCDLKFLAX-AWEZNQCLSA-N 1 2 318.486 4.630 20 0 DJADLO CC(C)CCc1nc(C[N@@H+](C)[C@@H](C)c2cccc(O)c2)cs1 ZINC000440401242 338386809 /nfs/dbraw/zinc/38/68/09/338386809.db2.gz CZTURXCDLKFLAX-AWEZNQCLSA-N 1 2 318.486 4.630 20 0 DJADLO Cc1ccc(NC(=O)C2CCC(c3ccccc3)CC2)c(C)[nH+]1 ZINC000446424519 338527764 /nfs/dbraw/zinc/52/77/64/338527764.db2.gz LKEXXJFASHAPLD-UHFFFAOYSA-N 1 2 308.425 4.611 20 0 DJADLO Cc1ccc(NC(=O)c2cccc(Oc3ccccc3)c2)c(C)[nH+]1 ZINC000446436946 338528119 /nfs/dbraw/zinc/52/81/19/338528119.db2.gz ZKFQURGCZKPSBJ-UHFFFAOYSA-N 1 2 318.376 4.743 20 0 DJADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1cc(Cl)sc1Cl ZINC000449319170 338612374 /nfs/dbraw/zinc/61/23/74/338612374.db2.gz JCNBFCCTRNPVQC-UHFFFAOYSA-N 1 2 319.257 4.685 20 0 DJADLO CC(C)c1nc2ccc(N[C@@H]3C[C@H](C)n4cc[nH+]c43)cc2s1 ZINC000453186078 338804479 /nfs/dbraw/zinc/80/44/79/338804479.db2.gz LRJFOULGTCKNFG-SMDDNHRTSA-N 1 2 312.442 4.734 20 0 DJADLO CCn1cc[nH+]c1[C@H](C)Nc1ccc2nc(C(C)C)sc2c1 ZINC000453191114 338805272 /nfs/dbraw/zinc/80/52/72/338805272.db2.gz WDKXKTHYJIVNRZ-LBPRGKRZSA-N 1 2 314.458 4.809 20 0 DJADLO C[C@H]([NH2+]Cc1cnc(C2CC2)o1)c1cccc(Cl)c1Cl ZINC000453366519 338832445 /nfs/dbraw/zinc/83/24/45/338832445.db2.gz RZPOZZVPLGCZRJ-VIFPVBQESA-N 1 2 311.212 4.710 20 0 DJADLO COc1ccc([C@@H]([NH2+][C@@H]2CCCc3occc32)c2ccco2)cc1 ZINC000453414705 338840423 /nfs/dbraw/zinc/84/04/23/338840423.db2.gz TWPGLXXEFCRDQE-YLJYHZDGSA-N 1 2 323.392 4.638 20 0 DJADLO Cc1cc(F)c(C[NH2+]Cc2nc(C(C)C)cs2)c(Cl)c1 ZINC000459425257 339028557 /nfs/dbraw/zinc/02/85/57/339028557.db2.gz BHUWKWOJKQWCGC-UHFFFAOYSA-N 1 2 312.841 4.657 20 0 DJADLO Cc1nnc([C@@H](C)[N@@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)s1 ZINC000459575932 339036880 /nfs/dbraw/zinc/03/68/80/339036880.db2.gz LDDZNUXAWPOQFE-CJNGLKHVSA-N 1 2 313.470 4.525 20 0 DJADLO Cc1nnc([C@@H](C)[N@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)s1 ZINC000459575932 339036881 /nfs/dbraw/zinc/03/68/81/339036881.db2.gz LDDZNUXAWPOQFE-CJNGLKHVSA-N 1 2 313.470 4.525 20 0 DJADLO CC[C@H]([NH2+][C@@H](C)c1ccn(C)n1)c1ccc(Cl)cc1Cl ZINC000459778468 339048027 /nfs/dbraw/zinc/04/80/27/339048027.db2.gz FLHOMWJIZJYGTB-HZMBPMFUSA-N 1 2 312.244 4.529 20 0 DJADLO COc1ccc(Cl)cc1[C@H](CC(C)C)Nc1cc(C)[nH+]cn1 ZINC000462855804 339094646 /nfs/dbraw/zinc/09/46/46/339094646.db2.gz CRPOJZFTHWIKGO-HNNXBMFYSA-N 1 2 319.836 4.646 20 0 DJADLO c1c[nH+]c([C@@H](Nc2cccc(C3CCC3)c2)c2ccccc2)[nH]1 ZINC000462943731 339098623 /nfs/dbraw/zinc/09/86/23/339098623.db2.gz WYHNGYRZOMCXIP-IBGZPJMESA-N 1 2 303.409 4.879 20 0 DJADLO Fc1ccccc1C1C[NH+](Cc2csc(-c3ccccc3)n2)C1 ZINC000463028683 339101491 /nfs/dbraw/zinc/10/14/91/339101491.db2.gz LSMQBKGSZDDGRA-UHFFFAOYSA-N 1 2 324.424 4.549 20 0 DJADLO Cc1cc(C)c(NC(=O)c2ccc(C3=CCCC3)cc2)c(C)[nH+]1 ZINC000463261130 339112532 /nfs/dbraw/zinc/11/25/32/339112532.db2.gz USRMWORFNRLNMQ-UHFFFAOYSA-N 1 2 306.409 4.826 20 0 DJADLO CCCc1nc(C[N@@H+]2CC[C@H](C)C[C@@H]2c2ccco2)cs1 ZINC000464852989 339157812 /nfs/dbraw/zinc/15/78/12/339157812.db2.gz MXWPRQHEBHXAIM-DZGCQCFKSA-N 1 2 304.459 4.662 20 0 DJADLO CCCc1nc(C[N@H+]2CC[C@H](C)C[C@@H]2c2ccco2)cs1 ZINC000464852989 339157813 /nfs/dbraw/zinc/15/78/13/339157813.db2.gz MXWPRQHEBHXAIM-DZGCQCFKSA-N 1 2 304.459 4.662 20 0 DJADLO CCCc1nc(C[N@@H+]2CC[C@@H](C)C[C@@H]2c2ccco2)cs1 ZINC000464852995 339157996 /nfs/dbraw/zinc/15/79/96/339157996.db2.gz MXWPRQHEBHXAIM-UKRRQHHQSA-N 1 2 304.459 4.662 20 0 DJADLO CCCc1nc(C[N@H+]2CC[C@@H](C)C[C@@H]2c2ccco2)cs1 ZINC000464852995 339157997 /nfs/dbraw/zinc/15/79/97/339157997.db2.gz MXWPRQHEBHXAIM-UKRRQHHQSA-N 1 2 304.459 4.662 20 0 DJADLO C[C@@H]1CC[N@H+](Cc2cc(-c3ccco3)on2)[C@@H](c2ccco2)C1 ZINC000464862257 339158603 /nfs/dbraw/zinc/15/86/03/339158603.db2.gz XBOJLTGPTORGNP-UKRRQHHQSA-N 1 2 312.369 4.501 20 0 DJADLO C[C@@H]1CC[N@@H+](Cc2cc(-c3ccco3)on2)[C@@H](c2ccco2)C1 ZINC000464862257 339158604 /nfs/dbraw/zinc/15/86/04/339158604.db2.gz XBOJLTGPTORGNP-UKRRQHHQSA-N 1 2 312.369 4.501 20 0 DJADLO CCC1(C(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)CCCC1 ZINC000464923497 339161864 /nfs/dbraw/zinc/16/18/64/339161864.db2.gz OEAIVXDETLRQAO-UHFFFAOYSA-N 1 2 310.397 4.783 20 0 DJADLO CCC1(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)CCCC1 ZINC000464963610 339163522 /nfs/dbraw/zinc/16/35/22/339163522.db2.gz XATXQVPELVQFJD-UHFFFAOYSA-N 1 2 310.397 4.783 20 0 DJADLO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2cccc(Cl)c2F)o1 ZINC000467203384 339228008 /nfs/dbraw/zinc/22/80/08/339228008.db2.gz XPLZWFJLCGHFLZ-HNNXBMFYSA-N 1 2 323.795 4.556 20 0 DJADLO COCc1ccc([C@@H]2CCC[N@H+]2Cc2cccc(Cl)c2F)o1 ZINC000467203384 339228009 /nfs/dbraw/zinc/22/80/09/339228009.db2.gz XPLZWFJLCGHFLZ-HNNXBMFYSA-N 1 2 323.795 4.556 20 0 DJADLO Cc1nc2cc(N[C@H]3CCC[C@H](c4[nH+]cccc4C)C3)ccc2o1 ZINC000467369474 339234624 /nfs/dbraw/zinc/23/46/24/339234624.db2.gz YWMYFPWIXXDSNX-HOTGVXAUSA-N 1 2 321.424 4.978 20 0 DJADLO Cc1nc2cc(N[C@@H]3CCC[C@@H](c4[nH+]cccc4C)C3)ccc2o1 ZINC000467369476 339234683 /nfs/dbraw/zinc/23/46/83/339234683.db2.gz YWMYFPWIXXDSNX-HZPDHXFCSA-N 1 2 321.424 4.978 20 0 DJADLO C[C@H](c1cccc(Cl)c1)[N@@H+]1CCO[C@H](c2ccsc2)C1 ZINC000468109231 339254236 /nfs/dbraw/zinc/25/42/36/339254236.db2.gz JODZMBCJEMKISY-WBMJQRKESA-N 1 2 307.846 4.536 20 0 DJADLO C[C@H](c1cccc(Cl)c1)[N@H+]1CCO[C@H](c2ccsc2)C1 ZINC000468109231 339254237 /nfs/dbraw/zinc/25/42/37/339254237.db2.gz JODZMBCJEMKISY-WBMJQRKESA-N 1 2 307.846 4.536 20 0 DJADLO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(F)c(Cl)c2)o1 ZINC000468694798 339268872 /nfs/dbraw/zinc/26/88/72/339268872.db2.gz QIGCJFFBEXKCLH-INIZCTEOSA-N 1 2 323.795 4.556 20 0 DJADLO COCc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(F)c(Cl)c2)o1 ZINC000468694798 339268873 /nfs/dbraw/zinc/26/88/73/339268873.db2.gz QIGCJFFBEXKCLH-INIZCTEOSA-N 1 2 323.795 4.556 20 0 DJADLO C[C@@H]1CC[C@H](CC(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000468841788 339272516 /nfs/dbraw/zinc/27/25/16/339272516.db2.gz GRFQHGIOWVZYRB-CABCVRRESA-N 1 2 310.397 4.639 20 0 DJADLO CCCC1(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)CCC1 ZINC000469099201 339280118 /nfs/dbraw/zinc/28/01/18/339280118.db2.gz YYDSAEKNUFTPAM-UHFFFAOYSA-N 1 2 310.397 4.783 20 0 DJADLO C[C@@H](CCC1CC1)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000469767368 339298362 /nfs/dbraw/zinc/29/83/62/339298362.db2.gz FNTRCLUKSPISCK-HNNXBMFYSA-N 1 2 307.441 4.592 20 0 DJADLO Cc1ccc2c(c1C)OC[C@@H]2[NH2+][C@@H](C)c1csc(C(C)C)n1 ZINC000469789390 339300124 /nfs/dbraw/zinc/30/01/24/339300124.db2.gz YIWNKTOQVFJLAE-ZFWWWQNUSA-N 1 2 316.470 4.668 20 0 DJADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1csc(C2CCCC2)n1 ZINC000470952049 339332391 /nfs/dbraw/zinc/33/23/91/339332391.db2.gz ZYWIGODDOOFYRY-ZWNOBZJWSA-N 1 2 318.408 4.573 20 0 DJADLO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1csc(C2CCCC2)n1 ZINC000470952049 339332392 /nfs/dbraw/zinc/33/23/92/339332392.db2.gz ZYWIGODDOOFYRY-ZWNOBZJWSA-N 1 2 318.408 4.573 20 0 DJADLO Cc1ccc([C@@H]([NH2+]Cc2ccccc2Cl)c2ccccn2)cc1 ZINC000471080085 339336573 /nfs/dbraw/zinc/33/65/73/339336573.db2.gz URALWGDEAPCDHD-HXUWFJFHSA-N 1 2 322.839 4.923 20 0 DJADLO CCSc1cccc(CNc2cccc(-c3[nH+]ccn3C)c2)c1 ZINC000472058893 339361468 /nfs/dbraw/zinc/36/14/68/339361468.db2.gz JNFVXBLHVPHZMZ-UHFFFAOYSA-N 1 2 323.465 4.811 20 0 DJADLO C[N@@H+](Cc1cc(-c2cccs2)on1)Cc1cc2ccccc2o1 ZINC000472269622 339368219 /nfs/dbraw/zinc/36/82/19/339368219.db2.gz XJPFAXRUSUQBCH-UHFFFAOYSA-N 1 2 324.405 4.781 20 0 DJADLO C[N@H+](Cc1cc(-c2cccs2)on1)Cc1cc2ccccc2o1 ZINC000472269622 339368220 /nfs/dbraw/zinc/36/82/20/339368220.db2.gz XJPFAXRUSUQBCH-UHFFFAOYSA-N 1 2 324.405 4.781 20 0 DJADLO CCCCc1nc(C[N@@H+]2CCCC[C@@H]2c2cccn2C)cs1 ZINC000472350273 339370518 /nfs/dbraw/zinc/37/05/18/339370518.db2.gz PUWPSLQQVYDLRN-QGZVFWFLSA-N 1 2 317.502 4.551 20 0 DJADLO CCCCc1nc(C[N@H+]2CCCC[C@@H]2c2cccn2C)cs1 ZINC000472350273 339370519 /nfs/dbraw/zinc/37/05/19/339370519.db2.gz PUWPSLQQVYDLRN-QGZVFWFLSA-N 1 2 317.502 4.551 20 0 DJADLO C[C@@H](CC(C)(C)C)C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000475419722 339451065 /nfs/dbraw/zinc/45/10/65/339451065.db2.gz GLEIUHHOSMIYIX-AWEZNQCLSA-N 1 2 312.413 4.885 20 0 DJADLO C[C@@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1cc2cccc(F)c2o1 ZINC000475701839 339459897 /nfs/dbraw/zinc/45/98/97/339459897.db2.gz LVGVNCPOVJCWQR-LLVKDONJSA-N 1 2 316.376 4.708 20 0 DJADLO CCCc1nc(C[NH2+][C@@H](C)c2cc3cccc(F)c3o2)cs1 ZINC000475722648 339460264 /nfs/dbraw/zinc/46/02/64/339460264.db2.gz LCLPGXXKLPCKEI-NSHDSACASA-N 1 2 318.417 4.832 20 0 DJADLO CC1(C)CCC[C@H]1C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000475913409 339464858 /nfs/dbraw/zinc/46/48/58/339464858.db2.gz XYOXULXQBWPEOJ-KRWDZBQOSA-N 1 2 310.397 4.639 20 0 DJADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)[C@H]1CC12CCCCC2 ZINC000477202854 339489122 /nfs/dbraw/zinc/48/91/22/339489122.db2.gz FVIGOTCDQKNTRR-GOSISDBHSA-N 1 2 322.408 4.783 20 0 DJADLO CCCOc1cccc2c(N[C@H](C)c3ccccn3)cc[nH+]c12 ZINC000478241451 339511218 /nfs/dbraw/zinc/51/12/18/339511218.db2.gz VXBSFFYAIZJIFW-CQSZACIVSA-N 1 2 307.397 4.592 20 0 DJADLO Cc1ccc(CSCc2cc(-c3ccccc3)no2)c(C)[nH+]1 ZINC000478914307 339524576 /nfs/dbraw/zinc/52/45/76/339524576.db2.gz XEPVPVHBXPAVFQ-UHFFFAOYSA-N 1 2 310.422 4.787 20 0 DJADLO C[C@@H](Nc1cc(-c2ccccc2)ccc1Cl)c1[nH+]ccn1C ZINC000479465597 339536650 /nfs/dbraw/zinc/53/66/50/339536650.db2.gz KXLUAVIJQZDSGT-CYBMUJFWSA-N 1 2 311.816 4.914 20 0 DJADLO CCc1ccc([C@H](C)[NH2+][C@H](c2ccc(C)cc2)c2ccccn2)o1 ZINC000479480865 339537384 /nfs/dbraw/zinc/53/73/84/339537384.db2.gz UDDJPDRAKCKUTQ-HRAATJIYSA-N 1 2 320.436 4.986 20 0 DJADLO CC[C@H](C)CC(=O)Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000480042216 339556430 /nfs/dbraw/zinc/55/64/30/339556430.db2.gz PRYKEWFFTXTZRY-LBPRGKRZSA-N 1 2 318.804 4.902 20 0 DJADLO CCSc1cccc(NCc2ccc(N(C)C(C)C)[nH+]c2)c1 ZINC000480261594 339566020 /nfs/dbraw/zinc/56/60/20/339566020.db2.gz KAQYRNXHNKSJID-UHFFFAOYSA-N 1 2 315.486 4.650 20 0 DJADLO CC[C@@H]([NH2+][C@H](C)c1c(F)cccc1OC)c1cc(F)ccc1F ZINC000483728473 339673018 /nfs/dbraw/zinc/67/30/18/339673018.db2.gz PTJFDRGEDHRSDZ-BDJLRTHQSA-N 1 2 323.358 4.914 20 0 DJADLO COc1cc(C)ccc1C[NH2+][C@@H](C)c1c(F)cccc1Cl ZINC000485268226 339700805 /nfs/dbraw/zinc/70/08/05/339700805.db2.gz AXZWHQJGZZRKGC-LBPRGKRZSA-N 1 2 307.796 4.647 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC[C@H]1CC1CCCCC1 ZINC000485449971 339703476 /nfs/dbraw/zinc/70/34/76/339703476.db2.gz GKAKBLCUKCANHW-KRWDZBQOSA-N 1 2 315.461 4.665 20 0 DJADLO CC(C)(SCc1[nH+]ccn1CC(F)(F)F)c1ccccc1 ZINC000485471432 339703994 /nfs/dbraw/zinc/70/39/94/339703994.db2.gz TWNDRHCTZADCII-UHFFFAOYSA-N 1 2 314.376 4.614 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)c1ccc(Oc2ccccc2)cc1 ZINC000485475448 339704109 /nfs/dbraw/zinc/70/41/09/339704109.db2.gz CAAZDPNJUDQOEQ-UHFFFAOYSA-N 1 2 318.376 4.743 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)c1cccc(Oc2ccccc2)c1 ZINC000485491156 339704275 /nfs/dbraw/zinc/70/42/75/339704275.db2.gz MOCLXHBWSMIVTC-UHFFFAOYSA-N 1 2 318.376 4.743 20 0 DJADLO Cc1cccc(C2(NC(=O)Nc3c(C)cc[nH+]c3C)CCCC2)c1 ZINC000485491745 339704426 /nfs/dbraw/zinc/70/44/26/339704426.db2.gz DAUKFGQYTJFWJC-UHFFFAOYSA-N 1 2 323.440 4.598 20 0 DJADLO Cc1c2ccccc2oc1[C@@H](C)NC(=O)Nc1c(C)cc[nH+]c1C ZINC000485545558 339705298 /nfs/dbraw/zinc/70/52/98/339705298.db2.gz PPIZOGDWRBICLV-CQSZACIVSA-N 1 2 323.396 4.636 20 0 DJADLO CCSCc1cc[nH+]c(NCc2cc3ccc(F)cc3[nH]2)c1 ZINC000486343219 339725497 /nfs/dbraw/zinc/72/54/97/339725497.db2.gz RGSGWJDQWKXSIJ-UHFFFAOYSA-N 1 2 315.417 4.567 20 0 DJADLO Fc1ccc(C2=CC[C@H]([NH2+][C@H](C3CC3)C(F)(F)F)CC2)cc1 ZINC000489762283 339817853 /nfs/dbraw/zinc/81/78/53/339817853.db2.gz CPPUDFCEIYJMHE-JKSUJKDBSA-N 1 2 313.338 4.692 20 0 DJADLO c1nc(C[NH2+][C@H](c2ccccc2)c2cccc3ccccc32)co1 ZINC000495011550 339970231 /nfs/dbraw/zinc/97/02/31/339970231.db2.gz XAPUTNIUJSJIOS-OAQYLSRUSA-N 1 2 314.388 4.707 20 0 DJADLO CCCc1nc(C[N@H+](C)[C@H](C)c2ccc(F)c(F)c2)cs1 ZINC000496951095 340016801 /nfs/dbraw/zinc/01/68/01/340016801.db2.gz NHWGPYWCIYFCGX-LLVKDONJSA-N 1 2 310.413 4.567 20 0 DJADLO CCCc1nc(C[N@@H+](C)[C@H](C)c2ccc(F)c(F)c2)cs1 ZINC000496951095 340016802 /nfs/dbraw/zinc/01/68/02/340016802.db2.gz NHWGPYWCIYFCGX-LLVKDONJSA-N 1 2 310.413 4.567 20 0 DJADLO CCc1ccc(-c2ccc(C[NH2+][C@@H](C)c3ncc(C)o3)o2)cc1 ZINC000500394211 340056442 /nfs/dbraw/zinc/05/64/42/340056442.db2.gz LKXGHPULWNEKLM-AWEZNQCLSA-N 1 2 310.397 4.656 20 0 DJADLO CCCc1ccc(-c2ccc(NCc3c[nH+]cn3C)cc2)cc1 ZINC000500743915 340066308 /nfs/dbraw/zinc/06/63/08/340066308.db2.gz CWYMRSORIJVVBY-UHFFFAOYSA-N 1 2 305.425 4.652 20 0 DJADLO CCCc1ccc(-c2ccc(NCc3[nH+]ccn3C)cc2)cc1 ZINC000500754582 340066501 /nfs/dbraw/zinc/06/65/01/340066501.db2.gz XSSMHSLQPVBKLE-UHFFFAOYSA-N 1 2 305.425 4.652 20 0 DJADLO CC(C)c1nc([C@H](C)[NH2+][C@@H](C)c2nc3c(s2)CCC3)cs1 ZINC000502042072 340093892 /nfs/dbraw/zinc/09/38/92/340093892.db2.gz JSBXELUNVWQPLY-QWRGUYRKSA-N 1 2 321.515 4.624 20 0 DJADLO CCCCc1noc([C@@H](C)[NH2+][C@@H](c2ccc(F)cc2)C(C)C)n1 ZINC000502543082 340107258 /nfs/dbraw/zinc/10/72/58/340107258.db2.gz PBVNUGIAYMXLGU-CXAGYDPISA-N 1 2 319.424 4.599 20 0 DJADLO CCCCc1noc([C@@H](C)[NH2+][C@H](c2ccc(F)cc2)C(C)C)n1 ZINC000502543083 340107365 /nfs/dbraw/zinc/10/73/65/340107365.db2.gz PBVNUGIAYMXLGU-DYVFJYSZSA-N 1 2 319.424 4.599 20 0 DJADLO Cc1cc(F)cc2c1C[N@H+]([C@H](C)c1ncc(C(C)(C)C)o1)CC2 ZINC000502874344 340115264 /nfs/dbraw/zinc/11/52/64/340115264.db2.gz FQZZCXILKGOVCD-CYBMUJFWSA-N 1 2 316.420 4.539 20 0 DJADLO Cc1cc(F)cc2c1C[N@@H+]([C@H](C)c1ncc(C(C)(C)C)o1)CC2 ZINC000502874344 340115265 /nfs/dbraw/zinc/11/52/65/340115265.db2.gz FQZZCXILKGOVCD-CYBMUJFWSA-N 1 2 316.420 4.539 20 0 DJADLO CCOc1cccc2cc([C@@H](C)[NH2+][C@@H](C)c3cc(C)on3)oc21 ZINC000503856063 340135335 /nfs/dbraw/zinc/13/53/35/340135335.db2.gz MSTMAAYOPBUDIL-QWHCGFSZSA-N 1 2 314.385 4.540 20 0 DJADLO FC(F)C1([NH2+][C@@H]2CCCc3nc(-c4ccccc4)sc32)CC1 ZINC000503919954 340136900 /nfs/dbraw/zinc/13/69/00/340136900.db2.gz JFFWSRBHJWDXBG-CYBMUJFWSA-N 1 2 320.408 4.575 20 0 DJADLO C[C@H]([NH2+]C1(C(F)F)CC1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000503937761 340137656 /nfs/dbraw/zinc/13/76/56/340137656.db2.gz OZDBUIKBTFAJNN-IUCAKERBSA-N 1 2 324.198 4.537 20 0 DJADLO Cc1ccc(/C=C/CC(=O)Nc2c[nH+]ccc2OC(C)(C)C)cc1 ZINC000504611511 340150178 /nfs/dbraw/zinc/15/01/78/340150178.db2.gz HBYGHHVTGWTKMA-AATRIKPKSA-N 1 2 324.424 4.609 20 0 DJADLO CC(C)n1ccnc1C[N@H+]([C@@H](C)c1ccc(Cl)cc1)C1CC1 ZINC000505801078 340178446 /nfs/dbraw/zinc/17/84/46/340178446.db2.gz GLXBVDGZRIJSIU-AWEZNQCLSA-N 1 2 317.864 4.843 20 0 DJADLO CC(C)n1ccnc1C[N@@H+]([C@@H](C)c1ccc(Cl)cc1)C1CC1 ZINC000505801078 340178447 /nfs/dbraw/zinc/17/84/47/340178447.db2.gz GLXBVDGZRIJSIU-AWEZNQCLSA-N 1 2 317.864 4.843 20 0 DJADLO C[N@H+](Cc1ccccc1Cl)Cc1ccccc1OC(F)F ZINC000506094904 340185429 /nfs/dbraw/zinc/18/54/29/340185429.db2.gz JLOMKNMNXAMZOT-UHFFFAOYSA-N 1 2 311.759 4.573 20 0 DJADLO C[N@@H+](Cc1ccccc1Cl)Cc1ccccc1OC(F)F ZINC000506094904 340185430 /nfs/dbraw/zinc/18/54/30/340185430.db2.gz JLOMKNMNXAMZOT-UHFFFAOYSA-N 1 2 311.759 4.573 20 0 DJADLO CC(C)[N@@H+](Cc1csc(-c2ccccc2)n1)Cc1ccco1 ZINC000506417323 340194284 /nfs/dbraw/zinc/19/42/84/340194284.db2.gz RAUGUSPXLVQAQL-UHFFFAOYSA-N 1 2 312.438 4.814 20 0 DJADLO CC(C)[N@H+](Cc1csc(-c2ccccc2)n1)Cc1ccco1 ZINC000506417323 340194285 /nfs/dbraw/zinc/19/42/85/340194285.db2.gz RAUGUSPXLVQAQL-UHFFFAOYSA-N 1 2 312.438 4.814 20 0 DJADLO CC(C)c1nc(C[N@H+]([C@H](C)c2ccccc2)C2CC2)cs1 ZINC000506546594 340196505 /nfs/dbraw/zinc/19/65/05/340196505.db2.gz MVYXDYCNJJOULD-CQSZACIVSA-N 1 2 300.471 4.992 20 0 DJADLO CC(C)c1nc(C[N@@H+]([C@H](C)c2ccccc2)C2CC2)cs1 ZINC000506546594 340196506 /nfs/dbraw/zinc/19/65/06/340196506.db2.gz MVYXDYCNJJOULD-CQSZACIVSA-N 1 2 300.471 4.992 20 0 DJADLO CCCCc1nc(C[N@@H+]2CCCCC[C@@H]2c2ccccc2)no1 ZINC000506943927 340204077 /nfs/dbraw/zinc/20/40/77/340204077.db2.gz JIWCAQXZTMAPMD-QGZVFWFLSA-N 1 2 313.445 4.530 20 0 DJADLO CCCCc1nc(C[N@H+]2CCCCC[C@@H]2c2ccccc2)no1 ZINC000506943927 340204078 /nfs/dbraw/zinc/20/40/78/340204078.db2.gz JIWCAQXZTMAPMD-QGZVFWFLSA-N 1 2 313.445 4.530 20 0 DJADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1cccc(O)c1Cl ZINC000507089767 340207134 /nfs/dbraw/zinc/20/71/34/340207134.db2.gz VWNAAPGOYYSIIM-JTQLQIEISA-N 1 2 311.759 4.517 20 0 DJADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1cccc(O)c1Cl ZINC000507089767 340207135 /nfs/dbraw/zinc/20/71/35/340207135.db2.gz VWNAAPGOYYSIIM-JTQLQIEISA-N 1 2 311.759 4.517 20 0 DJADLO C[C@H](c1cc2ccccc2o1)[N@H+](C)Cc1c(F)ccc(O)c1F ZINC000507109426 340207604 /nfs/dbraw/zinc/20/76/04/340207604.db2.gz DKVPAZQNYFABLO-LLVKDONJSA-N 1 2 317.335 4.610 20 0 DJADLO C[C@H](c1cc2ccccc2o1)[N@@H+](C)Cc1c(F)ccc(O)c1F ZINC000507109426 340207605 /nfs/dbraw/zinc/20/76/05/340207605.db2.gz DKVPAZQNYFABLO-LLVKDONJSA-N 1 2 317.335 4.610 20 0 DJADLO CCn1nccc1C[N@@H+]1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000507131902 340208874 /nfs/dbraw/zinc/20/88/74/340208874.db2.gz MKGQMVWNPWDIJK-MRXNPFEDSA-N 1 2 324.255 4.547 20 0 DJADLO CCn1nccc1C[N@H+]1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000507131902 340208875 /nfs/dbraw/zinc/20/88/75/340208875.db2.gz MKGQMVWNPWDIJK-MRXNPFEDSA-N 1 2 324.255 4.547 20 0 DJADLO C[C@H](c1c(F)cccc1F)[N@H+](C)Cc1cnc(C2CCC2)s1 ZINC000507204122 340213313 /nfs/dbraw/zinc/21/33/13/340213313.db2.gz PUBGXOGUEMXTEW-LLVKDONJSA-N 1 2 322.424 4.882 20 0 DJADLO C[C@H](c1c(F)cccc1F)[N@@H+](C)Cc1cnc(C2CCC2)s1 ZINC000507204122 340213314 /nfs/dbraw/zinc/21/33/14/340213314.db2.gz PUBGXOGUEMXTEW-LLVKDONJSA-N 1 2 322.424 4.882 20 0 DJADLO Cc1ncsc1C[N@@H+](C)[C@@H](C)c1ccc(Cl)cc1Cl ZINC000507241899 340215163 /nfs/dbraw/zinc/21/51/63/340215163.db2.gz BYUNIZWQVSSWPG-JTQLQIEISA-N 1 2 315.269 4.951 20 0 DJADLO Cc1ncsc1C[N@H+](C)[C@@H](C)c1ccc(Cl)cc1Cl ZINC000507241899 340215164 /nfs/dbraw/zinc/21/51/64/340215164.db2.gz BYUNIZWQVSSWPG-JTQLQIEISA-N 1 2 315.269 4.951 20 0 DJADLO CCc1cccnc1[C@@H](C)[NH2+]Cc1cc(Cl)sc1Cl ZINC000507492919 340222666 /nfs/dbraw/zinc/22/26/66/340222666.db2.gz GGUUHSMVOITKSX-SECBINFHSA-N 1 2 315.269 4.863 20 0 DJADLO CC[N@H+](Cc1csc(C(C)C)n1)[C@H](C)c1ccc(F)cc1 ZINC000507716189 340229304 /nfs/dbraw/zinc/22/93/04/340229304.db2.gz GYTHATNWNVVZHW-CYBMUJFWSA-N 1 2 306.450 4.989 20 0 DJADLO CC[N@@H+](Cc1csc(C(C)C)n1)[C@H](C)c1ccc(F)cc1 ZINC000507716189 340229305 /nfs/dbraw/zinc/22/93/05/340229305.db2.gz GYTHATNWNVVZHW-CYBMUJFWSA-N 1 2 306.450 4.989 20 0 DJADLO C[C@H](c1cccc(F)c1)[N@@H+]1CCO[C@@H](c2ccccc2Cl)C1 ZINC000507786805 340231325 /nfs/dbraw/zinc/23/13/25/340231325.db2.gz BLNFRURUNVLQOZ-FZKQIMNGSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@H](c1cccc(F)c1)[N@H+]1CCO[C@@H](c2ccccc2Cl)C1 ZINC000507786805 340231326 /nfs/dbraw/zinc/23/13/26/340231326.db2.gz BLNFRURUNVLQOZ-FZKQIMNGSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@H](c1ccccn1)[N@H+](C)Cc1c(Cl)oc2ccccc21 ZINC000508637794 340249137 /nfs/dbraw/zinc/24/91/37/340249137.db2.gz MVYAWSMTQTVEON-GFCCVEGCSA-N 1 2 300.789 4.674 20 0 DJADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1c(Cl)oc2ccccc21 ZINC000508637794 340249138 /nfs/dbraw/zinc/24/91/38/340249138.db2.gz MVYAWSMTQTVEON-GFCCVEGCSA-N 1 2 300.789 4.674 20 0 DJADLO Cc1ccc(NC(=O)c2ccccc2Oc2cc[nH+]cc2)cc1F ZINC000509033716 340258853 /nfs/dbraw/zinc/25/88/53/340258853.db2.gz MOPZCFUWLKHIAB-UHFFFAOYSA-N 1 2 322.339 4.574 20 0 DJADLO CC(C)(C)c1nc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)cs1 ZINC000509040491 340259215 /nfs/dbraw/zinc/25/92/15/340259215.db2.gz SMNYIBYXMNOGCZ-MRXNPFEDSA-N 1 2 318.461 4.917 20 0 DJADLO CC(C)(C)c1nc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)cs1 ZINC000509040491 340259216 /nfs/dbraw/zinc/25/92/16/340259216.db2.gz SMNYIBYXMNOGCZ-MRXNPFEDSA-N 1 2 318.461 4.917 20 0 DJADLO CC[N@H+](Cc1csc(C(C)(C)C)n1)Cc1cccc(F)c1 ZINC000509047945 340259508 /nfs/dbraw/zinc/25/95/08/340259508.db2.gz DJIFCKKOMDLWJD-UHFFFAOYSA-N 1 2 306.450 4.602 20 0 DJADLO CC[N@@H+](Cc1csc(C(C)(C)C)n1)Cc1cccc(F)c1 ZINC000509047945 340259509 /nfs/dbraw/zinc/25/95/09/340259509.db2.gz DJIFCKKOMDLWJD-UHFFFAOYSA-N 1 2 306.450 4.602 20 0 DJADLO Cc1nc(C[N@@H+](Cc2ccccc2Cl)CC2CC2)cs1 ZINC000510171259 340291429 /nfs/dbraw/zinc/29/14/29/340291429.db2.gz VHDAUDSHIYJXEM-UHFFFAOYSA-N 1 2 306.862 4.517 20 0 DJADLO Cc1nc(C[N@H+](Cc2ccccc2Cl)CC2CC2)cs1 ZINC000510171259 340291430 /nfs/dbraw/zinc/29/14/30/340291430.db2.gz VHDAUDSHIYJXEM-UHFFFAOYSA-N 1 2 306.862 4.517 20 0 DJADLO CCC1(CC)CCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000510198452 340292287 /nfs/dbraw/zinc/29/22/87/340292287.db2.gz OYRHNEHDHZWUHB-UHFFFAOYSA-N 1 2 324.424 4.526 20 0 DJADLO c1ccc(N2Cc3cccc(N[C@@H]4CC[C@@H]4C4CCC4)c3C2)[nH+]c1 ZINC000510701271 340307239 /nfs/dbraw/zinc/30/72/39/340307239.db2.gz HGNPCRBKOHEPRZ-YLJYHZDGSA-N 1 2 319.452 4.592 20 0 DJADLO Clc1ccc([C@H]2CC[N@@H+]2Cc2nc3ccccc3s2)cc1 ZINC000511587418 340331613 /nfs/dbraw/zinc/33/16/13/340331613.db2.gz WAFGCLVHINXZGM-OAHLLOKOSA-N 1 2 314.841 4.897 20 0 DJADLO Clc1ccc([C@H]2CC[N@H+]2Cc2nc3ccccc3s2)cc1 ZINC000511587418 340331614 /nfs/dbraw/zinc/33/16/14/340331614.db2.gz WAFGCLVHINXZGM-OAHLLOKOSA-N 1 2 314.841 4.897 20 0 DJADLO Clc1ccc([C@H]2CC[N@@H+]2Cc2ncc(-c3ccccc3)o2)cc1 ZINC000511602469 340331986 /nfs/dbraw/zinc/33/19/86/340331986.db2.gz BBWYZQCYGILNIY-QGZVFWFLSA-N 1 2 324.811 4.942 20 0 DJADLO Clc1ccc([C@H]2CC[N@H+]2Cc2ncc(-c3ccccc3)o2)cc1 ZINC000511602469 340331987 /nfs/dbraw/zinc/33/19/87/340331987.db2.gz BBWYZQCYGILNIY-QGZVFWFLSA-N 1 2 324.811 4.942 20 0 DJADLO Cc1ccc(-c2nc(C[N@H+](C)CCC(F)(F)F)cs2)cc1 ZINC000511763271 340337567 /nfs/dbraw/zinc/33/75/67/340337567.db2.gz RPQCBSQMSHNPJQ-UHFFFAOYSA-N 1 2 314.376 4.503 20 0 DJADLO Cc1ccc(-c2nc(C[N@@H+](C)CCC(F)(F)F)cs2)cc1 ZINC000511763271 340337568 /nfs/dbraw/zinc/33/75/68/340337568.db2.gz RPQCBSQMSHNPJQ-UHFFFAOYSA-N 1 2 314.376 4.503 20 0 DJADLO Cc1cccc(C[NH2+][C@@H](C)c2nc(C3CCCCC3)no2)c1C ZINC000173864314 340376379 /nfs/dbraw/zinc/37/63/79/340376379.db2.gz WVKNKYZACDEJDF-HNNXBMFYSA-N 1 2 313.445 4.585 20 0 DJADLO Clc1ccc(CNc2ccc(-n3cc[nH+]c3)cc2)cc1Cl ZINC000512984475 340386960 /nfs/dbraw/zinc/38/69/60/340386960.db2.gz GGJOKVQWORZSOZ-UHFFFAOYSA-N 1 2 318.207 4.791 20 0 DJADLO Cc1cc2cc(C[NH2+][C@@H](C)c3c(F)cncc3F)oc2cc1C ZINC000513056717 340391344 /nfs/dbraw/zinc/39/13/44/340391344.db2.gz KRNQUDKOWZHDCM-LBPRGKRZSA-N 1 2 316.351 4.574 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1cccc(Cl)c1F)c1c(F)cncc1F ZINC000513261466 340399865 /nfs/dbraw/zinc/39/98/65/340399865.db2.gz NGGVMOZCHRBYSO-DTWKUNHWSA-N 1 2 314.738 4.564 20 0 DJADLO Cc1sc(C[NH2+]Cc2cc(Cl)ccc2F)nc1C(C)C ZINC000513543946 340412940 /nfs/dbraw/zinc/41/29/40/340412940.db2.gz BDYZNDSRLLJNPS-UHFFFAOYSA-N 1 2 312.841 4.657 20 0 DJADLO CC[C@H]([NH2+][C@H](C)c1noc(-c2ccccc2)n1)c1cccc(C)c1 ZINC000513659391 340417748 /nfs/dbraw/zinc/41/77/48/340417748.db2.gz BXRAWQOBNXRNIA-QAPCUYQASA-N 1 2 321.424 4.847 20 0 DJADLO Cc1cc(C)c(NC(=O)CCC(C)(C)c2ccccc2)c(C)[nH+]1 ZINC000178992430 340452689 /nfs/dbraw/zinc/45/26/89/340452689.db2.gz FCMMTCPDKRDNDB-UHFFFAOYSA-N 1 2 310.441 4.703 20 0 DJADLO Cc1ccc(CNc2cccc(OCC(F)(F)F)c2C)c(C)[nH+]1 ZINC000184436324 340492847 /nfs/dbraw/zinc/49/28/47/340492847.db2.gz LLHWHCVDEMEYKO-UHFFFAOYSA-N 1 2 324.346 4.560 20 0 DJADLO CCCCN(C(=O)c1ccc(C)c(Oc2cc[nH+]cc2)c1)C1CC1 ZINC000522304459 340598321 /nfs/dbraw/zinc/59/83/21/340598321.db2.gz NPPGPROLMRPZRQ-UHFFFAOYSA-N 1 2 324.424 4.587 20 0 DJADLO C[C@H](CC1CCCCC1)C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000303518191 340637154 /nfs/dbraw/zinc/63/71/54/340637154.db2.gz DQTGUMJQWHBYKW-CQSZACIVSA-N 1 2 311.429 4.622 20 0 DJADLO CC[C@@H]([NH2+][C@H](C)c1nc(C(C)C)no1)c1cc(C)ccc1C ZINC000528802003 340735051 /nfs/dbraw/zinc/73/50/51/340735051.db2.gz PWJWYAFJUFIJPN-GDBMZVCRSA-N 1 2 301.434 4.612 20 0 DJADLO C[C@H]([NH2+]Cc1nc(C2CCCCC2)cs1)c1ncccc1F ZINC000528822474 340735865 /nfs/dbraw/zinc/73/58/65/340735865.db2.gz GQJZXFGAXAAEBC-LBPRGKRZSA-N 1 2 319.449 4.576 20 0 DJADLO CCCc1nc(C[NH2+][C@@H](c2ccc(Cl)cc2)[C@@H](C)CC)no1 ZINC000538188838 340812545 /nfs/dbraw/zinc/81/25/45/340812545.db2.gz ZSQXEHIICIJQOV-YVEFUNNKSA-N 1 2 321.852 4.553 20 0 DJADLO CCC(CC)n1ccc(C[NH2+][C@@H](C)c2c(F)cccc2Cl)n1 ZINC000539376842 340883019 /nfs/dbraw/zinc/88/30/19/340883019.db2.gz KFSMMVKCQWSVGT-LBPRGKRZSA-N 1 2 323.843 4.888 20 0 DJADLO CC(C)COc1cccc(N[C@@H](c2[nH]cc[nH+]2)c2ccccc2)c1 ZINC000128474456 340889130 /nfs/dbraw/zinc/88/91/30/340889130.db2.gz BUOUYPHLZHPPQU-LJQANCHMSA-N 1 2 321.424 4.646 20 0 DJADLO Cc1ccc(NC(=O)Nc2ccc(Cl)cc2Cl)c(C)[nH+]1 ZINC000128689955 340907477 /nfs/dbraw/zinc/90/74/77/340907477.db2.gz MONGRGYBPXAZAR-UHFFFAOYSA-N 1 2 310.184 4.649 20 0 DJADLO C[C@@H]1CCC[C@H](CSCc2[nH+]ccn2CC(F)(F)F)C1 ZINC000539951283 340910790 /nfs/dbraw/zinc/91/07/90/340910790.db2.gz RLAZLXQCNIBSLC-NEPJUHHUSA-N 1 2 306.397 4.505 20 0 DJADLO FC(F)(F)c1cccc(N[C@H](c2[nH]cc[nH+]2)c2ccccc2)c1 ZINC000129176416 340950348 /nfs/dbraw/zinc/95/03/48/340950348.db2.gz IOJAUVOWVCLVCH-HNNXBMFYSA-N 1 2 317.314 4.630 20 0 DJADLO CC(C)C[C@@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)no1)c1cccs1 ZINC000541627128 340978347 /nfs/dbraw/zinc/97/83/47/340978347.db2.gz TZICEGDKOZPLIH-QWHCGFSZSA-N 1 2 321.490 4.867 20 0 DJADLO CC(C)n1cc([C@H](C)[NH2+][C@H](C)c2ncc(-c3ccccc3)o2)cn1 ZINC000542574404 341014236 /nfs/dbraw/zinc/01/42/36/341014236.db2.gz PDDYJGOSRNBJRR-LSDHHAIUSA-N 1 2 324.428 4.531 20 0 DJADLO Cc1cc(C)c(NC(=O)c2ccc(SC3CC3)cc2)c(C)[nH+]1 ZINC000543092126 341031450 /nfs/dbraw/zinc/03/14/50/341031450.db2.gz CQJYRMPUSWURCE-UHFFFAOYSA-N 1 2 312.438 4.514 20 0 DJADLO CCc1cnc(C[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)s1 ZINC000130656184 341037099 /nfs/dbraw/zinc/03/70/99/341037099.db2.gz RRXHDFJMTMAKOT-VIFPVBQESA-N 1 2 315.269 4.863 20 0 DJADLO CC(C)c1cnc(C[N@H+](Cc2cccc(F)c2)C2CC2)s1 ZINC000543393250 341041605 /nfs/dbraw/zinc/04/16/05/341041605.db2.gz CWCNQQQMQRWIQY-UHFFFAOYSA-N 1 2 304.434 4.570 20 0 DJADLO CC(C)c1cnc(C[N@@H+](Cc2cccc(F)c2)C2CC2)s1 ZINC000543393250 341041606 /nfs/dbraw/zinc/04/16/06/341041606.db2.gz CWCNQQQMQRWIQY-UHFFFAOYSA-N 1 2 304.434 4.570 20 0 DJADLO Clc1cccc(Cl)c1CSCCCn1cc[nH+]c1 ZINC000544618414 341089439 /nfs/dbraw/zinc/08/94/39/341089439.db2.gz PSOBQQXUNJFFKN-UHFFFAOYSA-N 1 2 301.242 4.513 20 0 DJADLO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000133522056 341177251 /nfs/dbraw/zinc/17/72/51/341177251.db2.gz HOJDOJKKLNUGIE-ZDUSSCGKSA-N 1 2 318.486 4.608 20 0 DJADLO Cc1nc([C@@H]([NH2+][C@H](C)CCC(C)C)c2ccc(Cl)cc2)no1 ZINC000546655910 341177383 /nfs/dbraw/zinc/17/73/83/341177383.db2.gz DCTVJKPJGNIHPM-WBMJQRKESA-N 1 2 321.852 4.535 20 0 DJADLO CCCC(CCC)c1nc(-c2cccc(Cn3cc[nH+]c3)c2)no1 ZINC000546985779 341189946 /nfs/dbraw/zinc/18/99/46/341189946.db2.gz RFGLZOMEKLSUDB-UHFFFAOYSA-N 1 2 324.428 4.665 20 0 DJADLO Cc1nc(C[N@@H+]2CCCC[C@@H]2c2cc3ccccc3[nH]2)cs1 ZINC000076728854 341213157 /nfs/dbraw/zinc/21/31/57/341213157.db2.gz JWSUPBUPQOQHOL-GOSISDBHSA-N 1 2 311.454 4.660 20 0 DJADLO Cc1nc(C[N@H+]2CCCC[C@@H]2c2cc3ccccc3[nH]2)cs1 ZINC000076728854 341213158 /nfs/dbraw/zinc/21/31/58/341213158.db2.gz JWSUPBUPQOQHOL-GOSISDBHSA-N 1 2 311.454 4.660 20 0 DJADLO C[C@H]([NH2+][C@@H]1CCc2cc(Cl)cc(Cl)c21)c1nccs1 ZINC000134387114 341214492 /nfs/dbraw/zinc/21/44/92/341214492.db2.gz GLCVHJDYWUPZKA-QPUJVOFHSA-N 1 2 313.253 4.788 20 0 DJADLO O=C(Nc1ccc(Oc2cc[nH+]cc2)cc1)C1=CCCCCC1 ZINC000547521415 341220057 /nfs/dbraw/zinc/22/00/57/341220057.db2.gz QUOMCDIVNORXGP-UHFFFAOYSA-N 1 2 308.381 4.703 20 0 DJADLO Cc1nc(C[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)c(C)s1 ZINC000135132527 341231915 /nfs/dbraw/zinc/23/19/15/341231915.db2.gz UHHOMKCLVPJAGS-QMMMGPOBSA-N 1 2 315.269 4.918 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1Cl)c1nc2c(s1)CCC2 ZINC000134978891 341227751 /nfs/dbraw/zinc/22/77/51/341227751.db2.gz XQNKYEOHQUBQJP-VHSXEESVSA-N 1 2 324.852 4.836 20 0 DJADLO Fc1cc(F)c(C[NH2+][C@H](c2ccco2)c2ccccc2)cc1F ZINC000135830120 341246745 /nfs/dbraw/zinc/24/67/45/341246745.db2.gz SPUIIKVELWUSEM-SFHVURJKSA-N 1 2 317.310 4.576 20 0 DJADLO Cc1[nH+]c2cc(NC(=O)Nc3ccccc3C(C)C)ccc2n1C ZINC000548156725 341250075 /nfs/dbraw/zinc/25/00/75/341250075.db2.gz FMUFTNYGOIRZCZ-UHFFFAOYSA-N 1 2 322.412 4.649 20 0 DJADLO C[C@@H]([NH2+][C@H](c1ccco1)c1ccccc1)c1cc(F)ccc1F ZINC000078968695 341250764 /nfs/dbraw/zinc/25/07/64/341250764.db2.gz YSHLFBIDNVJUIG-YJYMSZOUSA-N 1 2 313.347 4.998 20 0 DJADLO CC[C@@H]([NH2+]Cc1c(Cl)cccc1Cl)c1nccs1 ZINC000080261564 341271713 /nfs/dbraw/zinc/27/17/13/341271713.db2.gz RNQMWCKCQPEDJR-GFCCVEGCSA-N 1 2 301.242 4.691 20 0 DJADLO Cc1ccccc1[C@H](C)[N@H+](C)Cc1nc(C(F)(F)F)cs1 ZINC000137801051 341280206 /nfs/dbraw/zinc/28/02/06/341280206.db2.gz PKVHGYKRMDKFPY-NSHDSACASA-N 1 2 314.376 4.663 20 0 DJADLO Cc1ccccc1[C@H](C)[N@@H+](C)Cc1nc(C(F)(F)F)cs1 ZINC000137801051 341280207 /nfs/dbraw/zinc/28/02/07/341280207.db2.gz PKVHGYKRMDKFPY-NSHDSACASA-N 1 2 314.376 4.663 20 0 DJADLO CO[C@@H](C)c1nc(C[N@H+](C)[C@@H](C)c2ccc(Cl)cc2)cs1 ZINC000245459679 341295472 /nfs/dbraw/zinc/29/54/72/341295472.db2.gz DRQUGKUKRWLGFM-RYUDHWBXSA-N 1 2 324.877 4.697 20 0 DJADLO CO[C@@H](C)c1nc(C[N@@H+](C)[C@@H](C)c2ccc(Cl)cc2)cs1 ZINC000245459679 341295473 /nfs/dbraw/zinc/29/54/73/341295473.db2.gz DRQUGKUKRWLGFM-RYUDHWBXSA-N 1 2 324.877 4.697 20 0 DJADLO CCc1nocc1C[N@H+](C)[C@@H](C)c1ccc(Cl)cc1Cl ZINC000549951269 341307794 /nfs/dbraw/zinc/30/77/94/341307794.db2.gz HKAGLNILHDMEMA-JTQLQIEISA-N 1 2 313.228 4.737 20 0 DJADLO CCc1nocc1C[N@@H+](C)[C@@H](C)c1ccc(Cl)cc1Cl ZINC000549951269 341307795 /nfs/dbraw/zinc/30/77/95/341307795.db2.gz HKAGLNILHDMEMA-JTQLQIEISA-N 1 2 313.228 4.737 20 0 DJADLO CC1(C)CC(CC(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000550649129 341320474 /nfs/dbraw/zinc/32/04/74/341320474.db2.gz CIVVRLXKPUNRKV-UHFFFAOYSA-N 1 2 310.397 4.639 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1cn2ccccc2n1)c1c(F)cccc1Cl ZINC000551315316 341338409 /nfs/dbraw/zinc/33/84/09/341338409.db2.gz RBXKFEHPLYIDMZ-NWDGAFQWSA-N 1 2 317.795 4.539 20 0 DJADLO Cc1csc(C[NH2+][C@H](c2cccs2)c2ccc(F)cc2)n1 ZINC000553214472 341420359 /nfs/dbraw/zinc/42/03/59/341420359.db2.gz RMJFFKLBQOACOQ-INIZCTEOSA-N 1 2 318.442 4.531 20 0 DJADLO Cc1cc2cc(CNc3cc(C(F)(F)F)cc[nH+]3)ccc2[nH]1 ZINC000553319158 341425458 /nfs/dbraw/zinc/42/54/58/341425458.db2.gz VWYBWACQUHXARD-UHFFFAOYSA-N 1 2 305.303 4.502 20 0 DJADLO CCc1nc(CNc2cc[nH+]c3c(Cl)cccc23)cs1 ZINC000553387832 341427606 /nfs/dbraw/zinc/42/76/06/341427606.db2.gz KOIAYOBOADZKFT-UHFFFAOYSA-N 1 2 303.818 4.519 20 0 DJADLO C[C@@H]([NH2+][C@H](c1ccccc1)c1cccc(F)c1)c1nccs1 ZINC000091735813 341427898 /nfs/dbraw/zinc/42/78/98/341427898.db2.gz NYMFPYMPGGMZOD-CXAGYDPISA-N 1 2 312.413 4.722 20 0 DJADLO C[C@H]([NH2+][C@H](c1ccccc1)c1cccc(F)c1)c1nccs1 ZINC000091735810 341427944 /nfs/dbraw/zinc/42/79/44/341427944.db2.gz NYMFPYMPGGMZOD-SUMWQHHRSA-N 1 2 312.413 4.722 20 0 DJADLO Cc1cc(N[C@@H](C)c2c(F)cncc2F)c2cccc(F)c2[nH+]1 ZINC000553664139 341433541 /nfs/dbraw/zinc/43/35/41/341433541.db2.gz MXLDOKJPQJJSGB-JTQLQIEISA-N 1 2 317.314 4.529 20 0 DJADLO Cc1cc(C)c([C@H](C)[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)c(C)c1 ZINC000565649751 341534042 /nfs/dbraw/zinc/53/40/42/341534042.db2.gz WDIOIBPIDOHRFW-GJZGRUSLSA-N 1 2 315.461 4.704 20 0 DJADLO Fc1cccc(F)c1C[NH2+]Cc1cc(Cl)sc1Cl ZINC000312775891 341628847 /nfs/dbraw/zinc/62/88/47/341628847.db2.gz XSYUSGYYDIEMJH-UHFFFAOYSA-N 1 2 308.180 4.623 20 0 DJADLO C[C@@H]1[C@@H](C(F)(F)F)CCN1c1cc[nH+]c2c(Cl)cccc12 ZINC000577783165 341936629 /nfs/dbraw/zinc/93/66/29/341936629.db2.gz HKEMUALKVSEFCT-KOLCDFICSA-N 1 2 314.738 4.665 20 0 DJADLO CCCCc1nc(C[NH+]2CCC(CC(F)(F)F)CC2)cs1 ZINC000556508085 517573254 /nfs/dbraw/zinc/57/32/54/517573254.db2.gz RCXQOEBFICUSPA-UHFFFAOYSA-N 1 2 320.424 4.650 20 0 DJADLO C[C@@H](CC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1)C(C)(C)C ZINC000482724777 518176730 /nfs/dbraw/zinc/17/67/30/518176730.db2.gz RRXBYYFCHZCROX-AWEZNQCLSA-N 1 2 312.413 4.885 20 0 DJADLO CC(C)c1csc(C[NH2+][C@H](C)c2cc(F)c(F)c(F)c2)n1 ZINC000128607333 519855246 /nfs/dbraw/zinc/85/52/46/519855246.db2.gz JULJHVDRXUHBPR-SECBINFHSA-N 1 2 314.376 4.535 20 0 DJADLO CC(C)c1nc(C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cc2)no1 ZINC000181425069 519863962 /nfs/dbraw/zinc/86/39/62/519863962.db2.gz XBJYOYPXVLJHMY-HNNXBMFYSA-N 1 2 321.424 4.711 20 0 DJADLO CCC[C@H]([NH2+]Cc1nc([C@H](C)SCC)no1)c1ccccc1 ZINC000181762942 521166631 /nfs/dbraw/zinc/16/66/31/521166631.db2.gz CXFDTFHHCFCIHI-ZFWWWQNUSA-N 1 2 319.474 4.515 20 0 DJADLO CC[N@H+](Cc1ccc2ccccc2c1)[C@H](C)c1nnc(C)s1 ZINC000338238129 521336140 /nfs/dbraw/zinc/33/61/40/521336140.db2.gz ZALGPDIQYVXLCU-CYBMUJFWSA-N 1 2 311.454 4.583 20 0 DJADLO CC[N@@H+](Cc1ccc2ccccc2c1)[C@H](C)c1nnc(C)s1 ZINC000338238129 521336148 /nfs/dbraw/zinc/33/61/48/521336148.db2.gz ZALGPDIQYVXLCU-CYBMUJFWSA-N 1 2 311.454 4.583 20 0 DJADLO CCOc1ccccc1C[NH2+][C@@H](C)c1csc(C(C)C)n1 ZINC000186266597 521504307 /nfs/dbraw/zinc/50/43/07/521504307.db2.gz QCPOQUSVMAQBIH-ZDUSSCGKSA-N 1 2 304.459 4.516 20 0 DJADLO CCc1nc([C@H](C)[NH2+][C@H]2CCSc3ccc(F)cc32)cs1 ZINC000162270609 522458035 /nfs/dbraw/zinc/45/80/35/522458035.db2.gz CYRSFHCZCSJWEU-GWCFXTLKSA-N 1 2 322.474 4.732 20 0 DJADLO CC[C@@H]([NH2+][C@@H](C)c1noc(-c2ccccc2)n1)c1ccccc1 ZINC000124299897 522917145 /nfs/dbraw/zinc/91/71/45/522917145.db2.gz DIEZWMGCOXCMPE-WMLDXEAASA-N 1 2 307.397 4.539 20 0 DJADLO CCc1ccc(-c2nc(C[NH2+][C@@H](C)c3ccccn3)cs2)cc1 ZINC000180727615 523861133 /nfs/dbraw/zinc/86/11/33/523861133.db2.gz LVRQCDPRVPIXPQ-AWEZNQCLSA-N 1 2 323.465 4.618 20 0 DJADLO CO[C@H](C)c1nc(C[N@@H+]2CCCCC[C@H]2c2ccco2)cs1 ZINC000267085940 523912137 /nfs/dbraw/zinc/91/21/37/523912137.db2.gz ZMWGFMPFTPKBJM-HIFRSBDPSA-N 1 2 320.458 4.561 20 0 DJADLO CO[C@H](C)c1nc(C[N@H+]2CCCCC[C@H]2c2ccco2)cs1 ZINC000267085940 523912142 /nfs/dbraw/zinc/91/21/42/523912142.db2.gz ZMWGFMPFTPKBJM-HIFRSBDPSA-N 1 2 320.458 4.561 20 0 DJADLO COc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1ncc(-c2ccccc2)o1 ZINC000266519923 524727018 /nfs/dbraw/zinc/72/70/18/524727018.db2.gz ZJFZPBMEMPKYKS-CABCVRRESA-N 1 2 322.408 4.762 20 0 DJADLO C[C@H]([NH2+]Cc1nc(C2CCCCC2)cs1)c1ccncc1F ZINC000338356827 525485940 /nfs/dbraw/zinc/48/59/40/525485940.db2.gz MZKRSYGOHICCAV-LBPRGKRZSA-N 1 2 319.449 4.576 20 0 DJADLO Cc1cccnc1[C@@H]([NH2+][C@@H](C)c1ncc(C(C)(C)C)o1)C(C)C ZINC000177683581 525548278 /nfs/dbraw/zinc/54/82/78/525548278.db2.gz KNXPMWGUZIQEKO-HOCLYGCPSA-N 1 2 315.461 4.723 20 0 DJADLO Fc1cccc([C@@H]([NH2+][C@H]2CCCc3occc32)c2ccccn2)c1 ZINC000193064326 526397192 /nfs/dbraw/zinc/39/71/92/526397192.db2.gz QITZPVXXZOBXOW-FXAWDEMLSA-N 1 2 322.383 4.570 20 0 DJADLO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)c3ccccc32)o1 ZINC000184925135 526397468 /nfs/dbraw/zinc/39/74/68/526397468.db2.gz TYKGCCJQFSCEMP-GHMZBOCLSA-N 1 2 315.804 4.596 20 0 DJADLO c1sc(C[NH2+]C(c2ccccc2)c2ccccc2)nc1C1CC1 ZINC000180951521 526632633 /nfs/dbraw/zinc/63/26/33/526632633.db2.gz YIYCDSYWCHPEJL-UHFFFAOYSA-N 1 2 320.461 4.900 20 0 DJADLO Cc1nc(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)oc1C ZINC000180074576 526891939 /nfs/dbraw/zinc/89/19/39/526891939.db2.gz LPDDLPAVEXRDSP-MRXNPFEDSA-N 1 2 324.346 4.551 20 0 DJADLO Clc1ccsc1C[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC000365943338 526994625 /nfs/dbraw/zinc/99/46/25/526994625.db2.gz AVZAUQFDLWBZKY-QGZVFWFLSA-N 1 2 314.841 4.676 20 0 DJADLO Clc1sc(Cl)c2c1CCC[C@H]2[NH2+]Cc1nccs1 ZINC000128126299 527013055 /nfs/dbraw/zinc/01/30/55/527013055.db2.gz KWKCWVWWPXXZGH-MRVPVSSYSA-N 1 2 319.282 4.679 20 0 DJADLO FC(F)(F)c1ccccc1CNc1ccc(-n2cc[nH+]c2)cc1 ZINC000338143267 527686852 /nfs/dbraw/zinc/68/68/52/527686852.db2.gz NHMYWWWHHSGTOV-UHFFFAOYSA-N 1 2 317.314 4.503 20 0 DJADLO CCn1ccnc1[C@@H](C)[NH2+][C@H](C)c1cc(Cl)ccc1Cl ZINC000296582781 536117604 /nfs/dbraw/zinc/11/76/04/536117604.db2.gz WEBHQCRJBUKMIJ-GHMZBOCLSA-N 1 2 312.244 4.622 20 0 DJADLO CC(C)c1nc([C@@H](C)[NH2+][C@H]2CCOc3c(F)cccc32)cs1 ZINC000090049888 185279826 /nfs/dbraw/zinc/27/98/26/185279826.db2.gz SAZDLUMAQONOHF-RISCZKNCSA-N 1 2 320.433 4.580 20 0 DJADLO COc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1nc(C2CC2)cs1 ZINC000090458861 185297588 /nfs/dbraw/zinc/29/75/88/185297588.db2.gz QWIIJNYRZFFTSU-SNVBAGLBSA-N 1 2 322.861 4.533 20 0 DJADLO CCc1c2ccccc2oc1[C@H](C)[NH2+][C@H](C)c1cscn1 ZINC000563827398 335033604 /nfs/dbraw/zinc/03/36/04/335033604.db2.gz WKQRMACPWGQRLW-NEPJUHHUSA-N 1 2 300.427 4.864 20 0 DJADLO CCCc1csc(C[N@H+](C)[C@H](C)c2ccc(F)c(F)c2)n1 ZINC000426042545 335053384 /nfs/dbraw/zinc/05/33/84/335053384.db2.gz CYWDUURYPQAPEA-LLVKDONJSA-N 1 2 310.413 4.567 20 0 DJADLO CCCc1csc(C[N@@H+](C)[C@H](C)c2ccc(F)c(F)c2)n1 ZINC000426042545 335053385 /nfs/dbraw/zinc/05/33/85/335053385.db2.gz CYWDUURYPQAPEA-LLVKDONJSA-N 1 2 310.413 4.567 20 0 DJADLO Cc1cc([C@H](C)[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)c(C)o1 ZINC000274544210 130244407 /nfs/dbraw/zinc/24/44/07/130244407.db2.gz CGNUYPOCEVOABP-DTWKUNHWSA-N 1 2 318.364 4.784 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1ccccc1F)c1nc(C(F)(F)F)cs1 ZINC000274586932 130247187 /nfs/dbraw/zinc/24/71/87/130247187.db2.gz JKOUZBKTOXGMNA-DTWKUNHWSA-N 1 2 318.339 4.713 20 0 DJADLO Cc1ccc([C@H](C)[NH2+][C@@H](c2ccc(C)cc2)c2ccccn2)o1 ZINC000280020476 130777240 /nfs/dbraw/zinc/77/72/40/130777240.db2.gz HLIGDTYELYBOBT-JXFKEZNVSA-N 1 2 306.409 4.732 20 0 DJADLO Cc1cc([C@H](C)[NH2+]C(c2cccs2)c2cccs2)no1 ZINC000284977604 131128216 /nfs/dbraw/zinc/12/82/16/131128216.db2.gz FZGYYTOSBJCTSV-NSHDSACASA-N 1 2 304.440 4.546 20 0 DJADLO Cc1ccc(-c2csc(C[N@@H+](C)[C@@H](C)c3ccccn3)n2)cc1 ZINC000285554265 131180400 /nfs/dbraw/zinc/18/04/00/131180400.db2.gz IOIBQIQRIKNTTN-HNNXBMFYSA-N 1 2 323.465 4.707 20 0 DJADLO Cc1ccc(-c2csc(C[N@H+](C)[C@@H](C)c3ccccn3)n2)cc1 ZINC000285554265 131180402 /nfs/dbraw/zinc/18/04/02/131180402.db2.gz IOIBQIQRIKNTTN-HNNXBMFYSA-N 1 2 323.465 4.707 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1ccc(F)c(Cl)c1 ZINC000285738096 131197945 /nfs/dbraw/zinc/19/79/45/131197945.db2.gz QFQJPRQZOXAVEO-IUCAKERBSA-N 1 2 314.738 4.564 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N1C[C@@H](C)CC[C@@H]1c1ccccc1 ZINC000286963993 131258301 /nfs/dbraw/zinc/25/83/01/131258301.db2.gz AYBNYUPXWJPJOD-KBXCAEBGSA-N 1 2 323.440 4.704 20 0 DJADLO CC[C@@H](NC(=O)Nc1c(C)cc[nH+]c1C)c1ccc(Cl)s1 ZINC000287433813 131280072 /nfs/dbraw/zinc/28/00/72/131280072.db2.gz GVTZOZMBPORJCN-LLVKDONJSA-N 1 2 323.849 4.686 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)[C@H](C)c1ccc(Cl)cc1 ZINC000287645031 131292509 /nfs/dbraw/zinc/29/25/09/131292509.db2.gz VWNWUXDQAOLKCL-CYBMUJFWSA-N 1 2 317.820 4.577 20 0 DJADLO Cc1nc([C@H](C)[NH2+][C@H](C)c2ccc(Oc3ccccc3)cc2)no1 ZINC000289372569 131379540 /nfs/dbraw/zinc/37/95/40/131379540.db2.gz OPZMMPOZLHLXQH-KGLIPLIRSA-N 1 2 323.396 4.582 20 0 DJADLO Cc1nc([C@@H](C)[NH2+][C@H](C)c2ccc(Oc3ccccc3)cc2)no1 ZINC000289372571 131379832 /nfs/dbraw/zinc/37/98/32/131379832.db2.gz OPZMMPOZLHLXQH-ZIAGYGMSSA-N 1 2 323.396 4.582 20 0 DJADLO C[C@H]([NH2+][C@H]1C[C@H](C)n2ccnc21)c1cccc(Cl)c1Cl ZINC000297490332 132018854 /nfs/dbraw/zinc/01/88/54/132018854.db2.gz BIINRWXFOQPHFP-KWBADKCTSA-N 1 2 310.228 4.547 20 0 DJADLO Cc1cc(C)c(NC(=O)[C@@H]2CC[C@H]3CCCC[C@H]3C2)c(C)[nH+]1 ZINC000533757919 331683214 /nfs/dbraw/zinc/68/32/14/331683214.db2.gz ZSUQTSAOIJLORN-IXDOHACOSA-N 1 2 300.446 4.552 20 0 DJADLO Cc1cc(C[NH2+][C@H](c2ccccc2)c2ccc(Cl)cc2)no1 ZINC000557202296 331776294 /nfs/dbraw/zinc/77/62/94/331776294.db2.gz QGHZZSWZGFWCNQ-GOSISDBHSA-N 1 2 312.800 4.516 20 0 DJADLO CC[C@@H]([NH2+]Cc1cc(Cl)ccc1Cl)c1nccs1 ZINC000087759444 331791756 /nfs/dbraw/zinc/79/17/56/331791756.db2.gz ZSNZWAZLXATUII-GFCCVEGCSA-N 1 2 301.242 4.691 20 0 DJADLO CC(C)CCc1nc(C[NH2+]C2(c3ccccc3)CC2)cs1 ZINC000557500652 331794995 /nfs/dbraw/zinc/79/49/95/331794995.db2.gz AIJLHRVFIGYLME-UHFFFAOYSA-N 1 2 300.471 4.511 20 0 DJADLO CC(C)c1nc([C@H](C)[NH2+][C@H](C)c2ccc(F)cc2F)cs1 ZINC000090049738 331976475 /nfs/dbraw/zinc/97/64/75/331976475.db2.gz QTYHQLBNZNDBLI-MNOVXSKESA-N 1 2 310.413 4.957 20 0 DJADLO CCCC[C@H]([NH2+]Cc1ncccn1)c1ccc(Cl)cc1Cl ZINC000521069391 332014792 /nfs/dbraw/zinc/01/47/92/332014792.db2.gz ILQBBANZARHDSO-HNNXBMFYSA-N 1 2 324.255 4.805 20 0 DJADLO C[C@@H](c1ccco1)[N@H+](Cc1ncc(-c2cccs2)o1)C1CC1 ZINC000086234181 332019288 /nfs/dbraw/zinc/01/92/88/332019288.db2.gz SCVBRNHPSSFRRZ-LBPRGKRZSA-N 1 2 314.410 4.722 20 0 DJADLO C[C@@H](c1ccco1)[N@@H+](Cc1ncc(-c2cccs2)o1)C1CC1 ZINC000086234181 332019290 /nfs/dbraw/zinc/01/92/90/332019290.db2.gz SCVBRNHPSSFRRZ-LBPRGKRZSA-N 1 2 314.410 4.722 20 0 DJADLO Cc1c(Cl)c(C[N@@H+](C)[C@H](C)c2ccco2)nc2ccccc12 ZINC000521198875 332074597 /nfs/dbraw/zinc/07/45/97/332074597.db2.gz PTLHVUBWSLSASC-CYBMUJFWSA-N 1 2 314.816 4.983 20 0 DJADLO Cc1c(Cl)c(C[N@H+](C)[C@H](C)c2ccco2)nc2ccccc12 ZINC000521198875 332074598 /nfs/dbraw/zinc/07/45/98/332074598.db2.gz PTLHVUBWSLSASC-CYBMUJFWSA-N 1 2 314.816 4.983 20 0 DJADLO CC[C@H]([NH2+]Cc1c(Cl)oc2ccccc21)c1nccs1 ZINC000133202936 332138177 /nfs/dbraw/zinc/13/81/77/332138177.db2.gz ZAYPQCMCFLZABZ-LBPRGKRZSA-N 1 2 306.818 4.784 20 0 DJADLO CC/C(=C/c1nc(Cc2ccc(C)[nH+]c2)no1)c1ccc(C)cc1 ZINC000445209471 332143786 /nfs/dbraw/zinc/14/37/86/332143786.db2.gz GREYYGFDOXTHCV-ATVHPVEESA-N 1 2 319.408 4.623 20 0 DJADLO C[C@H](c1nc2ccccc2o1)[N@H+](C)Cc1nc2ccccc2s1 ZINC000180949934 332169191 /nfs/dbraw/zinc/16/91/91/332169191.db2.gz PFRMTIQYVRXIPT-GFCCVEGCSA-N 1 2 323.421 4.631 20 0 DJADLO C[C@H](c1nc2ccccc2o1)[N@@H+](C)Cc1nc2ccccc2s1 ZINC000180949934 332169192 /nfs/dbraw/zinc/16/91/92/332169192.db2.gz PFRMTIQYVRXIPT-GFCCVEGCSA-N 1 2 323.421 4.631 20 0 DJADLO Cc1c[nH]c(-c2ccccc2NC(=O)c2ccc(C(C)C)cc2)[nH+]1 ZINC000427181273 332181948 /nfs/dbraw/zinc/18/19/48/332181948.db2.gz DRBSTOGWUQUMJW-UHFFFAOYSA-N 1 2 319.408 4.761 20 0 DJADLO CC(C)c1csc(C[NH2+][C@H](C)c2ccc(F)cc2Cl)n1 ZINC000128576560 332208945 /nfs/dbraw/zinc/20/89/45/332208945.db2.gz XRUKZEDOVBYHNY-SNVBAGLBSA-N 1 2 312.841 4.910 20 0 DJADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+](C)Cc1ccc(Cl)c(F)c1 ZINC000536486522 332252111 /nfs/dbraw/zinc/25/21/11/332252111.db2.gz SDUGANZHKDFWDD-LLVKDONJSA-N 1 2 324.827 4.958 20 0 DJADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+](C)Cc1ccc(Cl)c(F)c1 ZINC000536486522 332252113 /nfs/dbraw/zinc/25/21/13/332252113.db2.gz SDUGANZHKDFWDD-LLVKDONJSA-N 1 2 324.827 4.958 20 0 DJADLO O=C(CC/C=C\c1ccccc1)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000255028342 332267158 /nfs/dbraw/zinc/26/71/58/332267158.db2.gz IXZXOIQEWPDXFO-YWEYNIOJSA-N 1 2 317.392 4.509 20 0 DJADLO Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]CC(C)(F)F ZINC000559891746 332289963 /nfs/dbraw/zinc/28/99/63/332289963.db2.gz SZAQMYAOVCSXMP-VIFPVBQESA-N 1 2 314.376 4.563 20 0 DJADLO Cc1cc([C@@H](C)[NH2+]Cc2ccccc2Oc2cccc(C)c2)no1 ZINC000559892286 332290273 /nfs/dbraw/zinc/29/02/73/332290273.db2.gz CVPLSYZYDPEPTK-MRXNPFEDSA-N 1 2 322.408 4.935 20 0 DJADLO Cc1cc(OCc2ccc(C(F)(F)F)cn2)c2ccccc2[nH+]1 ZINC000559950356 332296033 /nfs/dbraw/zinc/29/60/33/332296033.db2.gz QHTKJEWSSCNLMD-UHFFFAOYSA-N 1 2 318.298 4.536 20 0 DJADLO CCCc1ccc([C@H]([NH2+]Cc2nnsc2Cl)C(C)C)cc1 ZINC000096982053 332299753 /nfs/dbraw/zinc/29/97/53/332299753.db2.gz JTVUVGOQDGHJRU-OAHLLOKOSA-N 1 2 323.893 4.631 20 0 DJADLO CC(C)Oc1ccc([C@@H](C)[NH2+][C@H](C)c2ccon2)cc1Cl ZINC000560237179 332321307 /nfs/dbraw/zinc/32/13/07/332321307.db2.gz AYKLTILZIMLJKP-VXGBXAGGSA-N 1 2 308.809 4.527 20 0 DJADLO CC(C)Oc1ccc([C@H](C)[NH2+][C@@H](C)c2ccon2)cc1Cl ZINC000560237178 332321435 /nfs/dbraw/zinc/32/14/35/332321435.db2.gz AYKLTILZIMLJKP-RYUDHWBXSA-N 1 2 308.809 4.527 20 0 DJADLO CC(C)Oc1ccc([C@H](C)[NH2+][C@H](C)c2ccon2)cc1Cl ZINC000560237177 332321481 /nfs/dbraw/zinc/32/14/81/332321481.db2.gz AYKLTILZIMLJKP-NWDGAFQWSA-N 1 2 308.809 4.527 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)CCCc1csc2ccccc12 ZINC000425589624 335108262 /nfs/dbraw/zinc/10/82/62/335108262.db2.gz UTNCQXBXTLMWNT-UHFFFAOYSA-N 1 2 324.449 4.875 20 0 DJADLO FC(F)(F)C1(CNc2cc[nH+]c3c(Cl)cccc23)CC1 ZINC000561383910 332444634 /nfs/dbraw/zinc/44/46/34/332444634.db2.gz IXNGHZVVYSCUGZ-UHFFFAOYSA-N 1 2 300.711 4.643 20 0 DJADLO CCc1oc(C(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)cc1C ZINC000151485646 332579822 /nfs/dbraw/zinc/57/98/22/332579822.db2.gz XUQFFLQLKMJBSC-UHFFFAOYSA-N 1 2 322.364 4.590 20 0 DJADLO CC(C)c1cccc(C(C)C)c1NC(=O)C[C@H](C)n1cc[nH+]c1 ZINC000569813787 332682166 /nfs/dbraw/zinc/68/21/66/332682166.db2.gz MMUCJLWJCLGZQI-HNNXBMFYSA-N 1 2 313.445 4.720 20 0 DJADLO Cc1nc([C@H](C)[N@@H+]2CCC[C@H]2CF)oc1-c1ccc(Cl)cc1 ZINC000580219567 333020109 /nfs/dbraw/zinc/02/01/09/333020109.db2.gz RBYNPJNVJOKXER-WFASDCNBSA-N 1 2 322.811 4.798 20 0 DJADLO Cc1nc([C@H](C)[N@H+]2CCC[C@H]2CF)oc1-c1ccc(Cl)cc1 ZINC000580219567 333020110 /nfs/dbraw/zinc/02/01/10/333020110.db2.gz RBYNPJNVJOKXER-WFASDCNBSA-N 1 2 322.811 4.798 20 0 DJADLO C[C@H]([NH2+][C@H](c1ccco1)c1ccccc1)c1cccc(F)c1F ZINC000183212554 333053079 /nfs/dbraw/zinc/05/30/79/333053079.db2.gz GWFRMRKUGSFRSK-DJJJIMSYSA-N 1 2 313.347 4.998 20 0 DJADLO CCCc1nc(C[NH2+][C@@H](C)c2ccc(F)cc2Cl)cs1 ZINC000183773885 333062609 /nfs/dbraw/zinc/06/26/09/333062609.db2.gz GNEWSABOVGLTDI-JTQLQIEISA-N 1 2 312.841 4.739 20 0 DJADLO CC(C)Oc1ccccc1C[NH2+][C@H](C)c1c(F)cccc1F ZINC000314407597 333108992 /nfs/dbraw/zinc/10/89/92/333108992.db2.gz APENXXLYXVTFAK-CYBMUJFWSA-N 1 2 305.368 4.603 20 0 DJADLO C[C@@H]([NH2+]Cc1nc(C(F)(F)F)cs1)c1ccccc1Cl ZINC000177362135 333127785 /nfs/dbraw/zinc/12/77/85/333127785.db2.gz QSGPPDVFLLCOLD-MRVPVSSYSA-N 1 2 320.767 4.666 20 0 DJADLO Cc1nc(N[C@@H](c2ccccc2)c2ccc(Cl)cc2)cc[nH+]1 ZINC000462921998 333131817 /nfs/dbraw/zinc/13/18/17/333131817.db2.gz FPPAVOSAWBRKBG-SFHVURJKSA-N 1 2 309.800 4.640 20 0 DJADLO COc1ccc([C@H](C)[NH2+][C@H](C)c2c(F)cccc2F)c(F)c1 ZINC000314530184 333138159 /nfs/dbraw/zinc/13/81/59/333138159.db2.gz HBBBGHSDJQEQRM-WDEREUQCSA-N 1 2 309.331 4.524 20 0 DJADLO COc1cc(C)[nH+]c(CSCc2ccc(C(F)F)cc2)c1 ZINC000460777077 333139373 /nfs/dbraw/zinc/13/93/73/333139373.db2.gz KOULRAZJFZADCL-UHFFFAOYSA-N 1 2 309.381 4.770 20 0 DJADLO Cc1cc(N2CCC[C@@H]2c2ccc(Cl)cc2)nc(C2CC2)[nH+]1 ZINC000582084357 333205638 /nfs/dbraw/zinc/20/56/38/333205638.db2.gz OPIASLXCDUXZQJ-MRXNPFEDSA-N 1 2 313.832 4.657 20 0 DJADLO Cc1ccc(SCc2[nH+]ccn2Cc2ccccc2)c(C)c1 ZINC000497309682 333234648 /nfs/dbraw/zinc/23/46/48/333234648.db2.gz HDZOUBMVKZUOLB-UHFFFAOYSA-N 1 2 308.450 4.841 20 0 DJADLO CCC[C@@H](Nc1cc(C)[nH+]cn1)c1cccc(C(F)(F)F)c1 ZINC000498901035 333311144 /nfs/dbraw/zinc/31/11/44/333311144.db2.gz LIVQFZKLHHAKLO-CQSZACIVSA-N 1 2 309.335 4.757 20 0 DJADLO Cc1ccc(NC(=O)N(C)[C@@H](c2ccccc2)C(C)C)c(C)[nH+]1 ZINC000152169588 333636310 /nfs/dbraw/zinc/63/63/10/333636310.db2.gz DOCUXOIZBCDVPF-GOSISDBHSA-N 1 2 311.429 4.559 20 0 DJADLO CC[C@@H]([NH2+][C@@H](C)c1nccs1)c1cc(Cl)ccc1OC ZINC000153328316 333700583 /nfs/dbraw/zinc/70/05/83/333700583.db2.gz KEDKSWHFYXSDTN-GXFFZTMASA-N 1 2 310.850 4.607 20 0 DJADLO CC[C@H]([NH2+][C@@H](C)c1csc(C(C)C)n1)c1c(C)noc1C ZINC000186434608 335158153 /nfs/dbraw/zinc/15/81/53/335158153.db2.gz AISXFCOYUBJDNF-GWCFXTLKSA-N 1 2 307.463 4.673 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1Cl)c1cc2n(n1)CCC2 ZINC000414059528 333888909 /nfs/dbraw/zinc/88/89/09/333888909.db2.gz WLCHRGXLAKOOKH-QWRGUYRKSA-N 1 2 324.255 4.548 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1nccs1)c1csc(-c2ccccc2)n1 ZINC000414228250 333926058 /nfs/dbraw/zinc/92/60/58/333926058.db2.gz XSHLSMKJVCACFI-RYUDHWBXSA-N 1 2 315.467 4.678 20 0 DJADLO C[C@H]1CC[N@H+](Cc2nc(C3CC3)cs2)[C@H](c2ccco2)C1 ZINC000343597788 335175869 /nfs/dbraw/zinc/17/58/69/335175869.db2.gz DEAOLWOMTXHEGW-WFASDCNBSA-N 1 2 302.443 4.587 20 0 DJADLO C[C@H]1CC[N@@H+](Cc2nc(C3CC3)cs2)[C@H](c2ccco2)C1 ZINC000343597788 335175870 /nfs/dbraw/zinc/17/58/70/335175870.db2.gz DEAOLWOMTXHEGW-WFASDCNBSA-N 1 2 302.443 4.587 20 0 DJADLO CC(C)Oc1cccc(C[N@H+](C)Cc2csc(C(C)C)n2)c1 ZINC000534478158 334276065 /nfs/dbraw/zinc/27/60/65/334276065.db2.gz TYOLYKYVKLVUAT-UHFFFAOYSA-N 1 2 318.486 4.686 20 0 DJADLO CC(C)Oc1cccc(C[N@@H+](C)Cc2csc(C(C)C)n2)c1 ZINC000534478158 334276066 /nfs/dbraw/zinc/27/60/66/334276066.db2.gz TYOLYKYVKLVUAT-UHFFFAOYSA-N 1 2 318.486 4.686 20 0 DJADLO Cn1cc[nH+]c1-c1cccc(N[C@@H]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000187557811 334265025 /nfs/dbraw/zinc/26/50/25/334265025.db2.gz MYAWWANXISQWGD-UKRRQHHQSA-N 1 2 323.362 4.620 20 0 DJADLO CC(C)c1nc([C@H](C)[NH2+]Cc2ccc(Cl)cc2F)cs1 ZINC000187579456 334265355 /nfs/dbraw/zinc/26/53/55/334265355.db2.gz GXHIFWZWEPHLNU-JTQLQIEISA-N 1 2 312.841 4.910 20 0 DJADLO Cc1cnc(C[N@@H+](CC(C)C)[C@@H](C)c2ccccc2Cl)nc1 ZINC000580339282 334266003 /nfs/dbraw/zinc/26/60/03/334266003.db2.gz REPYFHDTCUXZRN-HNNXBMFYSA-N 1 2 317.864 4.658 20 0 DJADLO Cc1cnc(C[N@H+](CC(C)C)[C@@H](C)c2ccccc2Cl)nc1 ZINC000580339282 334266004 /nfs/dbraw/zinc/26/60/04/334266004.db2.gz REPYFHDTCUXZRN-HNNXBMFYSA-N 1 2 317.864 4.658 20 0 DJADLO Cc1ccccc1-c1cnc(CSc2[nH+]cc3ccccn32)o1 ZINC000534527967 334278850 /nfs/dbraw/zinc/27/88/50/334278850.db2.gz YSPAVOSUSUSZLU-UHFFFAOYSA-N 1 2 321.405 4.590 20 0 DJADLO Cc1ccccc1-c1cnc(C[N@@H+]2CC[C@@H]2c2ccccc2)o1 ZINC000534529164 334279042 /nfs/dbraw/zinc/27/90/42/334279042.db2.gz WYAPLLWGMIRPNK-GOSISDBHSA-N 1 2 304.393 4.597 20 0 DJADLO Cc1ccccc1-c1cnc(C[N@H+]2CC[C@@H]2c2ccccc2)o1 ZINC000534529164 334279043 /nfs/dbraw/zinc/27/90/43/334279043.db2.gz WYAPLLWGMIRPNK-GOSISDBHSA-N 1 2 304.393 4.597 20 0 DJADLO C[C@@H](c1nc2ccccc2s1)[N@H+](C)Cc1cccc(F)c1F ZINC000302806703 334295868 /nfs/dbraw/zinc/29/58/68/334295868.db2.gz BTVHLCOBKDFRNC-NSHDSACASA-N 1 2 318.392 4.768 20 0 DJADLO C[C@@H](c1nc2ccccc2s1)[N@@H+](C)Cc1cccc(F)c1F ZINC000302806703 334295870 /nfs/dbraw/zinc/29/58/70/334295870.db2.gz BTVHLCOBKDFRNC-NSHDSACASA-N 1 2 318.392 4.768 20 0 DJADLO Fc1ccc(NCc2ccc(-n3cc[nH+]c3)cc2)cc1C1CC1 ZINC000341508298 334449512 /nfs/dbraw/zinc/44/95/12/334449512.db2.gz DHYKPBFPQGUYLX-UHFFFAOYSA-N 1 2 307.372 4.501 20 0 DJADLO CCC[C@@H]([NH2+]Cc1ncc(C)cn1)c1ccc(Cl)c(Cl)c1 ZINC000341642409 334467994 /nfs/dbraw/zinc/46/79/94/334467994.db2.gz UZZJYKQDVWPZPJ-OAHLLOKOSA-N 1 2 324.255 4.723 20 0 DJADLO CCC[C@H]([NH2+]Cc1ncc(C)cn1)c1ccc(Cl)c(Cl)c1 ZINC000341642402 334468006 /nfs/dbraw/zinc/46/80/06/334468006.db2.gz UZZJYKQDVWPZPJ-HNNXBMFYSA-N 1 2 324.255 4.723 20 0 DJADLO Fc1ccc([C@H](Nc2cc(F)cc(Cl)c2)c2[nH]cc[nH+]2)cc1 ZINC000188396323 334709279 /nfs/dbraw/zinc/70/92/79/334709279.db2.gz GBAJWKHDPKEVTJ-HNNXBMFYSA-N 1 2 319.742 4.543 20 0 DJADLO c1ccc2c(c1)CN(c1cc[nH+]c3ccncc31)Cc1ccccc1-2 ZINC000444088956 338468179 /nfs/dbraw/zinc/46/81/79/338468179.db2.gz WPNUMKXDSSNWFU-UHFFFAOYSA-N 1 2 323.399 4.817 20 0 DJADLO Cc1cccc(C[NH+]2Cc3ccccc3-c3ccccc3C2)n1 ZINC000346653965 335426777 /nfs/dbraw/zinc/42/67/77/335426777.db2.gz XWXHIZBOSGGESJ-UHFFFAOYSA-N 1 2 300.405 4.573 20 0 DJADLO COc1ccccc1[C@H](CC(C)C)[NH2+]Cc1ncc(Cl)s1 ZINC000349598209 335683436 /nfs/dbraw/zinc/68/34/36/335683436.db2.gz LLXOVNRKHASCEN-ZDUSSCGKSA-N 1 2 324.877 4.682 20 0 DJADLO CCSCc1ccc(C(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC000518977579 335760205 /nfs/dbraw/zinc/76/02/05/335760205.db2.gz DIKSWWMNWZSXCX-UHFFFAOYSA-N 1 2 314.454 4.512 20 0 DJADLO CC(C)c1[nH+]c2ccccc2n1Cc1noc(/C=C/C(C)(C)C)n1 ZINC000445657702 338504855 /nfs/dbraw/zinc/50/48/55/338504855.db2.gz OLOWSKNDRSJLRZ-ZHACJKMWSA-N 1 2 324.428 4.650 20 0 DJADLO C[C@@H]([NH2+]Cc1sccc1Cl)c1ncc(-c2ccccc2)o1 ZINC000367126540 336049416 /nfs/dbraw/zinc/04/94/16/336049416.db2.gz NCAXIHXHRFCCLX-LLVKDONJSA-N 1 2 318.829 4.907 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1CCC(C)(C)c2ccccc21 ZINC000351923449 336178962 /nfs/dbraw/zinc/17/89/62/336178962.db2.gz WGBKRUHPLCODPZ-QGZVFWFLSA-N 1 2 323.440 4.633 20 0 DJADLO Cc1ccc2oc(C[N@H+](Cc3ccco3)Cc3ccno3)cc2c1 ZINC000532572234 336255940 /nfs/dbraw/zinc/25/59/40/336255940.db2.gz KTJIPWLWRAYQKV-UHFFFAOYSA-N 1 2 322.364 4.525 20 0 DJADLO Cc1ccc2oc(C[N@@H+](Cc3ccco3)Cc3ccno3)cc2c1 ZINC000532572234 336255941 /nfs/dbraw/zinc/25/59/41/336255941.db2.gz KTJIPWLWRAYQKV-UHFFFAOYSA-N 1 2 322.364 4.525 20 0 DJADLO Clc1ccc2c(c1)C[N@@H+](Cc1ccno1)[C@H](c1ccccc1)C2 ZINC000532646347 336265587 /nfs/dbraw/zinc/26/55/87/336265587.db2.gz VMUCVDFQAFLIIE-IBGZPJMESA-N 1 2 324.811 4.628 20 0 DJADLO Clc1ccc2c(c1)C[N@H+](Cc1ccno1)[C@H](c1ccccc1)C2 ZINC000532646347 336265588 /nfs/dbraw/zinc/26/55/88/336265588.db2.gz VMUCVDFQAFLIIE-IBGZPJMESA-N 1 2 324.811 4.628 20 0 DJADLO COc1ccccc1[C@@H]([NH2+]Cc1ccc(C)c(C)c1)c1ccco1 ZINC000532675620 336266299 /nfs/dbraw/zinc/26/62/99/336266299.db2.gz URRZQNFHCYOOCY-OAQYLSRUSA-N 1 2 321.420 4.784 20 0 DJADLO FC(F)(F)c1cscc1CNc1cccc(-n2cc[nH+]c2)c1 ZINC000352835703 336271319 /nfs/dbraw/zinc/27/13/19/336271319.db2.gz IWUVKBAMONNINB-UHFFFAOYSA-N 1 2 323.343 4.565 20 0 DJADLO CC(C)(C)Oc1cc[nH+]cc1NCc1csc(C(C)(C)C)n1 ZINC000532805185 336271823 /nfs/dbraw/zinc/27/18/23/336271823.db2.gz QKFPRWMPZBOLPV-UHFFFAOYSA-N 1 2 319.474 4.625 20 0 DJADLO CCCOc1ccccc1N[C@@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC000325120552 336279432 /nfs/dbraw/zinc/27/94/32/336279432.db2.gz UPCZASAHHXGQAN-INIZCTEOSA-N 1 2 321.424 4.834 20 0 DJADLO CCCC(=O)Nc1ccc(CNc2ccc3ccccc3[nH+]2)cc1 ZINC000301065951 336288064 /nfs/dbraw/zinc/28/80/64/336288064.db2.gz CDTKBWLHBRZXAE-UHFFFAOYSA-N 1 2 319.408 4.586 20 0 DJADLO c1csc(-c2nc(CNc3ccc4ccccc4[nH+]3)co2)c1 ZINC000301078754 336288831 /nfs/dbraw/zinc/28/88/31/336288831.db2.gz ISNRHFZDIFXWMA-UHFFFAOYSA-N 1 2 307.378 4.563 20 0 DJADLO C[C@H](Nc1cc[nH+]c(C2CC2)n1)c1cccc(C(F)(F)F)c1 ZINC000301222855 336295512 /nfs/dbraw/zinc/29/55/12/336295512.db2.gz BPJCFGXMDCNEHY-JTQLQIEISA-N 1 2 307.319 4.546 20 0 DJADLO CCOc1cccc2cc([C@H](C)Nc3cc[nH+]c(C4CC4)n3)oc21 ZINC000301283123 336298634 /nfs/dbraw/zinc/29/86/34/336298634.db2.gz YFNHBKLQZNGZGE-LBPRGKRZSA-N 1 2 323.396 4.672 20 0 DJADLO C[C@H](Nc1cc[nH+]c(C2CC2)n1)c1ccc(-c2cccnc2)cc1 ZINC000301480056 336309504 /nfs/dbraw/zinc/30/95/04/336309504.db2.gz RLVSPARZFJYOFG-AWEZNQCLSA-N 1 2 316.408 4.589 20 0 DJADLO CC(C)(C)c1nc(NCc2nc(-c3ccccc3)cs2)cc[nH+]1 ZINC000301522743 336312246 /nfs/dbraw/zinc/31/22/46/336312246.db2.gz MBIYNZWKULQHLL-UHFFFAOYSA-N 1 2 324.453 4.510 20 0 DJADLO Cc1cc2ccccc2[nH+]c1N[C@H](C)c1nc2ccccc2[nH]1 ZINC000301700824 336324463 /nfs/dbraw/zinc/32/44/63/336324463.db2.gz PRJQYBQLCZJWJD-CYBMUJFWSA-N 1 2 302.381 4.593 20 0 DJADLO Cc1cc2ccccc2[nH+]c1NC[C@@H]1CCO[C@H]1c1ccccc1 ZINC000301719530 336325472 /nfs/dbraw/zinc/32/54/72/336325472.db2.gz MACHUWGJODJMCG-ICSRJNTNSA-N 1 2 318.420 4.733 20 0 DJADLO Cc1cc2ccccc2[nH+]c1NCc1coc(-c2ccccc2)n1 ZINC000301734104 336326321 /nfs/dbraw/zinc/32/63/21/336326321.db2.gz UKOWVWMOYKZABH-UHFFFAOYSA-N 1 2 315.376 4.810 20 0 DJADLO CCCO[C@@H]1CCCN(c2cc(C(C)C)[nH+]c(C(C)C)n2)CC1 ZINC000301867852 336335194 /nfs/dbraw/zinc/33/51/94/336335194.db2.gz NVYBSKRRIYCFLS-MRXNPFEDSA-N 1 2 319.493 4.509 20 0 DJADLO CC(C)c1cc(N2C[C@@H](C)C[C@H]2c2cccnc2)nc(C(C)C)[nH+]1 ZINC000302164540 336351785 /nfs/dbraw/zinc/35/17/85/336351785.db2.gz ZLQNSGJYLRZCBO-YJBOKZPZSA-N 1 2 324.472 4.706 20 0 DJADLO Cc1cc(N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)nc[nH+]1 ZINC000302214560 336354384 /nfs/dbraw/zinc/35/43/84/336354384.db2.gz GPGUFEYFIPFRQO-HNNXBMFYSA-N 1 2 321.346 4.535 20 0 DJADLO CCc1ccc([C@@H]2COCC[N@@H+]2Cc2ccc3ccccc3c2)o1 ZINC000514594597 336385342 /nfs/dbraw/zinc/38/53/42/336385342.db2.gz UJERWBFDKWQBIX-FQEVSTJZSA-N 1 2 321.420 4.569 20 0 DJADLO CCc1ccc([C@@H]2COCC[N@H+]2Cc2ccc3ccccc3c2)o1 ZINC000514594597 336385343 /nfs/dbraw/zinc/38/53/43/336385343.db2.gz UJERWBFDKWQBIX-FQEVSTJZSA-N 1 2 321.420 4.569 20 0 DJADLO Cc1cc(C)c(NC(=O)c2cccc(OC3CCCC3)c2)c(C)[nH+]1 ZINC000108685266 336393356 /nfs/dbraw/zinc/39/33/56/336393356.db2.gz KXZIIXOXXNVLRU-UHFFFAOYSA-N 1 2 324.424 4.581 20 0 DJADLO CC(C)[C@H]([NH2+][C@@H](c1nccs1)c1ccccc1)c1cccnc1 ZINC000359371251 336669886 /nfs/dbraw/zinc/66/98/86/336669886.db2.gz KNRGWBWAGVFSMX-ZWKOTPCHSA-N 1 2 323.465 4.614 20 0 DJADLO Cc1nc2cc(Cl)c(NCc3[nH+]ccn3C(C)C)cc2s1 ZINC000359702416 336684189 /nfs/dbraw/zinc/68/41/89/336684189.db2.gz YLPAZCXOAQJXHT-UHFFFAOYSA-N 1 2 320.849 4.648 20 0 DJADLO Fc1ccc2cc[nH+]c(NCc3c(F)cc(F)c(F)c3F)c2c1 ZINC000362366580 336793815 /nfs/dbraw/zinc/79/38/15/336793815.db2.gz WDACPXSSGXKUTD-UHFFFAOYSA-N 1 2 324.252 4.542 20 0 DJADLO C[C@@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1cccc(F)c1F ZINC000371509816 336906594 /nfs/dbraw/zinc/90/65/94/336906594.db2.gz QYGNNUMPRKCQSK-JLTOFOAXSA-N 1 2 324.374 4.800 20 0 DJADLO Cc1nc([C@H](C)[NH2+][C@@H]2CC(C)(C)Oc3cc(F)ccc32)cs1 ZINC000372059846 336920874 /nfs/dbraw/zinc/92/08/74/336920874.db2.gz BNQMVBNECUXHKS-IINYFYTJSA-N 1 2 320.433 4.544 20 0 DJADLO C/C=C/c1ccc(NCc2c[nH+]cn2Cc2ccccc2)cc1 ZINC000582325485 336921833 /nfs/dbraw/zinc/92/18/33/336921833.db2.gz LMYOYVDCKFTTSL-QHHAFSJGSA-N 1 2 303.409 4.577 20 0 DJADLO CC(C)n1cccc1C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000121887564 336982287 /nfs/dbraw/zinc/98/22/87/336982287.db2.gz JNFFTSBALQYOBH-UHFFFAOYSA-N 1 2 321.380 4.509 20 0 DJADLO CC(C)([NH2+]Cc1coc(-c2cccs2)n1)c1ccccc1F ZINC000429228520 337031521 /nfs/dbraw/zinc/03/15/21/337031521.db2.gz SPZKNLUWWJEFPB-UHFFFAOYSA-N 1 2 316.401 4.567 20 0 DJADLO Cc1ccc([C@@H](C)[NH2+][C@H](c2nccs2)c2ccccc2)s1 ZINC000123070198 337035124 /nfs/dbraw/zinc/03/51/24/337035124.db2.gz VXTWELNTRMJWMZ-CJNGLKHVSA-N 1 2 314.479 4.953 20 0 DJADLO Cc1ccccc1[C@H](C)[NH2+][C@@H](c1nccs1)c1ccccc1 ZINC000123263637 337041632 /nfs/dbraw/zinc/04/16/32/337041632.db2.gz ZWKUCDCEANEHGY-MAUKXSAKSA-N 1 2 308.450 4.892 20 0 DJADLO Cc1ccc2c(c1)[C@H]([NH2+][C@H](c1nccs1)c1ccccc1)CC2 ZINC000123269320 337041790 /nfs/dbraw/zinc/04/17/90/337041790.db2.gz DJZFQRGUYSFATJ-MOPGFXCFSA-N 1 2 320.461 4.818 20 0 DJADLO Cc1nc([C@@H](C)[NH2+][C@H]2CCCOc3c(Cl)cccc32)cs1 ZINC000378449051 337073055 /nfs/dbraw/zinc/07/30/55/337073055.db2.gz FFFHOGDNTWMSOY-YGRLFVJLSA-N 1 2 322.861 4.669 20 0 DJADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+][C@@H](c2ccccc2)c2cccnc2)o1 ZINC000171440409 337087244 /nfs/dbraw/zinc/08/72/44/337087244.db2.gz HWTXCOUIHPZQSW-VMRPVKRXSA-N 1 2 318.420 4.677 20 0 DJADLO Cc1cc(C)c(NC(=O)c2cc3cccc(C)c3s2)c(C)[nH+]1 ZINC000582553717 337108395 /nfs/dbraw/zinc/10/83/95/337108395.db2.gz AFUICUHJESNAHS-UHFFFAOYSA-N 1 2 310.422 4.782 20 0 DJADLO CCO[C@@H](C)c1nc(C[N@H+](C)Cc2cc(C)sc2C)cs1 ZINC000174006674 337140549 /nfs/dbraw/zinc/14/05/49/337140549.db2.gz DZQKUBLQBLIVKU-LBPRGKRZSA-N 1 2 324.515 4.551 20 0 DJADLO CCO[C@@H](C)c1nc(C[N@@H+](C)Cc2cc(C)sc2C)cs1 ZINC000174006674 337140550 /nfs/dbraw/zinc/14/05/50/337140550.db2.gz DZQKUBLQBLIVKU-LBPRGKRZSA-N 1 2 324.515 4.551 20 0 DJADLO C[C@@H]([NH2+][C@H](c1nccs1)c1ccccc1)c1ccsc1 ZINC000178197782 337161308 /nfs/dbraw/zinc/16/13/08/337161308.db2.gz GKIWLJXYDMSMKW-DOMZBBRYSA-N 1 2 300.452 4.645 20 0 DJADLO Cc1ccc(CSCc2coc(-c3cccs3)n2)c(C)[nH+]1 ZINC000184813002 337200353 /nfs/dbraw/zinc/20/03/53/337200353.db2.gz BIPKFLDWIYQACX-UHFFFAOYSA-N 1 2 316.451 4.848 20 0 DJADLO Cc1ccc(F)cc1C[NH2+][C@@H](C)c1ncc(-c2ccccc2)o1 ZINC000189452053 337279874 /nfs/dbraw/zinc/27/98/74/337279874.db2.gz ZFKIHTAGZNAAHC-AWEZNQCLSA-N 1 2 310.372 4.640 20 0 DJADLO Cc1nc([C@@H](C)[NH2+][C@@H](C)c2ccccc2OC(C)C)cs1 ZINC000037118917 337363180 /nfs/dbraw/zinc/36/31/80/337363180.db2.gz NYCQYTUEQRMHFX-QWHCGFSZSA-N 1 2 304.459 4.651 20 0 DJADLO Cc1cc([C@H](C)[NH2+][C@H](COCC(C)C)c2ccco2)c(C)o1 ZINC000584569553 337363370 /nfs/dbraw/zinc/36/33/70/337363370.db2.gz LHEMXUJIGOHNJV-WMLDXEAASA-N 1 2 305.418 4.554 20 0 DJADLO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1csc(C(C)C)n1)CCC2 ZINC000111311319 337389614 /nfs/dbraw/zinc/38/96/14/337389614.db2.gz BUCBWQQKUXPAPE-CQSZACIVSA-N 1 2 321.515 4.541 20 0 DJADLO Cc1nc2c(s1)[C@H]([N@H+](C)Cc1csc(C(C)C)n1)CCC2 ZINC000111311319 337389615 /nfs/dbraw/zinc/38/96/15/337389615.db2.gz BUCBWQQKUXPAPE-CQSZACIVSA-N 1 2 321.515 4.541 20 0 DJADLO CCc1nc(C[N@@H+](C)[C@@H](CC)c2ccc(F)cc2F)cs1 ZINC000532925582 337393020 /nfs/dbraw/zinc/39/30/20/337393020.db2.gz BCLSDPPNLBPRIY-HNNXBMFYSA-N 1 2 310.413 4.567 20 0 DJADLO CCc1nc(C[N@H+](C)[C@@H](CC)c2ccc(F)cc2F)cs1 ZINC000532925582 337393021 /nfs/dbraw/zinc/39/30/21/337393021.db2.gz BCLSDPPNLBPRIY-HNNXBMFYSA-N 1 2 310.413 4.567 20 0 DJADLO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)cc2Cl)cs1 ZINC000162315346 337614567 /nfs/dbraw/zinc/61/45/67/337614567.db2.gz PRLKBYCGIGWFLP-VHSXEESVSA-N 1 2 312.841 4.910 20 0 DJADLO CCOc1ccc(Cl)cc1[C@H](C)[NH2+][C@@H](C)c1nc(C)cs1 ZINC000162339728 337615018 /nfs/dbraw/zinc/61/50/18/337615018.db2.gz MYVLMVUIEFHAKF-RYUDHWBXSA-N 1 2 324.877 4.915 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)cs1)c1ccncc1Cl ZINC000421828485 337647134 /nfs/dbraw/zinc/64/71/34/337647134.db2.gz DAGOGGSMZDWRTM-MNOVXSKESA-N 1 2 323.893 4.901 20 0 DJADLO CC(F)(F)c1ccccc1N[C@@H]1CCc2ccc[nH+]c2CC1 ZINC000421861336 337655989 /nfs/dbraw/zinc/65/59/89/337655989.db2.gz VFGNMSKCWHSAAB-CQSZACIVSA-N 1 2 302.368 4.553 20 0 DJADLO CC(F)(F)c1ccccc1N[C@H]1CCc2ccc[nH+]c2CC1 ZINC000421861332 337656013 /nfs/dbraw/zinc/65/60/13/337656013.db2.gz VFGNMSKCWHSAAB-AWEZNQCLSA-N 1 2 302.368 4.553 20 0 DJADLO CC[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccccc1OC(F)F ZINC000423212930 337704544 /nfs/dbraw/zinc/70/45/44/337704544.db2.gz JGKHRYAIGODCLI-OAHLLOKOSA-N 1 2 318.367 4.819 20 0 DJADLO Clc1cccc2c1OCCC[C@@H]2Nc1ccc2c(c1)CC[NH2+]2 ZINC000423214671 337704791 /nfs/dbraw/zinc/70/47/91/337704791.db2.gz LSEGEUDIACXYKN-KRWDZBQOSA-N 1 2 314.816 4.634 20 0 DJADLO CCc1nc(C[NH2+][C@H](C)c2ccc(Cl)cc2Cl)cs1 ZINC000054917966 337746556 /nfs/dbraw/zinc/74/65/56/337746556.db2.gz LVDRSBVHWYRWKU-SECBINFHSA-N 1 2 315.269 4.863 20 0 DJADLO CC[C@H]([NH2+]Cc1c(F)ccc(F)c1Cl)c1nc(C)cs1 ZINC000527655713 337756602 /nfs/dbraw/zinc/75/66/02/337756602.db2.gz NUSMIEOURKMHSO-LBPRGKRZSA-N 1 2 316.804 4.624 20 0 DJADLO CC[C@@H](C)c1ccc([C@H](C)[NH2+]Cc2nnc(C3CC3)s2)cc1 ZINC000527909442 337770497 /nfs/dbraw/zinc/77/04/97/337770497.db2.gz QVXLQEVIPFQZSY-OLZOCXBDSA-N 1 2 315.486 4.780 20 0 DJADLO Cc1cc2cc([C@H](C)[NH2+][C@@H](C)c3ncccc3F)oc2cc1C ZINC000528035618 337782313 /nfs/dbraw/zinc/78/23/13/337782313.db2.gz IMHAWUVDRWEDLP-KBPBESRZSA-N 1 2 312.388 4.996 20 0 DJADLO CCc1nc(C[NH2+][C@H](c2ccc([C@@H](C)CC)cc2)C(C)C)no1 ZINC000533334317 337842708 /nfs/dbraw/zinc/84/27/08/337842708.db2.gz UYJMJSUNJVSIBJ-LIRRHRJNSA-N 1 2 315.461 4.632 20 0 DJADLO Cc1nc(C[NH2+][C@@H](C)c2ccccc2Oc2ccccc2)oc1C ZINC000537053488 337884568 /nfs/dbraw/zinc/88/45/68/337884568.db2.gz RXJQQFAZBWVJCH-HNNXBMFYSA-N 1 2 322.408 4.935 20 0 DJADLO Cc1c[nH+]ccc1NC(=O)N[C@H](C)c1cccc(Cl)c1Cl ZINC000121536643 337895087 /nfs/dbraw/zinc/89/50/87/337895087.db2.gz WDXWARSNVXBHKG-SNVBAGLBSA-N 1 2 324.211 4.580 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1cccc(Cl)c1)c1ccccn1)c1cccnc1 ZINC000092767885 337908074 /nfs/dbraw/zinc/90/80/74/337908074.db2.gz JIARQEPVBQTNLI-KUHUBIRLSA-N 1 2 323.827 4.570 20 0 DJADLO FC(F)(F)c1ccccc1CNc1ccc2ccccc2[nH+]1 ZINC000314949720 337975908 /nfs/dbraw/zinc/97/59/08/337975908.db2.gz CEKNHUNFMUJRSV-UHFFFAOYSA-N 1 2 302.299 4.866 20 0 DJADLO CC(C)Oc1cccc([C@H]([NH2+]CCCC(C)(F)F)C(F)F)c1 ZINC000516193999 338006473 /nfs/dbraw/zinc/00/64/73/338006473.db2.gz VJXZXIIWKFDHRH-AWEZNQCLSA-N 1 2 321.358 4.805 20 0 DJADLO C[C@H](c1ccco1)[N@H+](Cc1ncc(-c2cccs2)o1)C1CC1 ZINC000086234183 338013681 /nfs/dbraw/zinc/01/36/81/338013681.db2.gz SCVBRNHPSSFRRZ-GFCCVEGCSA-N 1 2 314.410 4.722 20 0 DJADLO C[C@H](c1ccco1)[N@@H+](Cc1ncc(-c2cccs2)o1)C1CC1 ZINC000086234183 338013682 /nfs/dbraw/zinc/01/36/82/338013682.db2.gz SCVBRNHPSSFRRZ-GFCCVEGCSA-N 1 2 314.410 4.722 20 0 DJADLO Cc1nc(C(C)C)oc1C[N@@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000428219919 338042913 /nfs/dbraw/zinc/04/29/13/338042913.db2.gz NNHDHBZEAXKZOI-OAHLLOKOSA-N 1 2 304.821 4.707 20 0 DJADLO Cc1nc(C(C)C)oc1C[N@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000428219919 338042914 /nfs/dbraw/zinc/04/29/14/338042914.db2.gz NNHDHBZEAXKZOI-OAHLLOKOSA-N 1 2 304.821 4.707 20 0 DJADLO CC(C)(C)c1csc(C[NH2+]C(C)(C)c2ccccc2F)n1 ZINC000429233588 338074143 /nfs/dbraw/zinc/07/41/43/338074143.db2.gz DYWOPEDVEPVDJV-UHFFFAOYSA-N 1 2 306.450 4.605 20 0 DJADLO Cc1ccoc1C[N@@H+](C)Cc1csc(-c2ccc(C)cc2)n1 ZINC000429359209 338078434 /nfs/dbraw/zinc/07/84/34/338078434.db2.gz BRCCEXCJBVGZMR-UHFFFAOYSA-N 1 2 312.438 4.652 20 0 DJADLO Cc1ccoc1C[N@H+](C)Cc1csc(-c2ccc(C)cc2)n1 ZINC000429359209 338078435 /nfs/dbraw/zinc/07/84/35/338078435.db2.gz BRCCEXCJBVGZMR-UHFFFAOYSA-N 1 2 312.438 4.652 20 0 DJADLO Cc1ccoc1C[N@H+](C)Cc1nc(C2CCCCC2)cs1 ZINC000429410952 338080089 /nfs/dbraw/zinc/08/00/89/338080089.db2.gz SENBKBMGVHHTBC-UHFFFAOYSA-N 1 2 304.459 4.724 20 0 DJADLO Cc1ccoc1C[N@@H+](C)Cc1nc(C2CCCCC2)cs1 ZINC000429410952 338080090 /nfs/dbraw/zinc/08/00/90/338080090.db2.gz SENBKBMGVHHTBC-UHFFFAOYSA-N 1 2 304.459 4.724 20 0 DJADLO C[C@@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1ccccc1Cl ZINC000429788537 338089967 /nfs/dbraw/zinc/08/99/67/338089967.db2.gz QSYSUWVNFZGSKJ-MRVPVSSYSA-N 1 2 317.713 4.747 20 0 DJADLO CCC(CC)n1ccc(C[N@H+](C)Cc2ccc(Cl)cc2)n1 ZINC000448489318 338112799 /nfs/dbraw/zinc/11/27/99/338112799.db2.gz HGMPXABRJBSSKA-UHFFFAOYSA-N 1 2 305.853 4.530 20 0 DJADLO CCC(CC)n1ccc(C[N@@H+](C)Cc2ccc(Cl)cc2)n1 ZINC000448489318 338112800 /nfs/dbraw/zinc/11/28/00/338112800.db2.gz HGMPXABRJBSSKA-UHFFFAOYSA-N 1 2 305.853 4.530 20 0 DJADLO Cc1cc(OCc2ncccc2C(F)(F)F)c2ccccc2[nH+]1 ZINC000431868453 338140606 /nfs/dbraw/zinc/14/06/06/338140606.db2.gz BSFYZNYRZAVUTP-UHFFFAOYSA-N 1 2 318.298 4.536 20 0 DJADLO Fc1ccc(C[NH2+]Cc2csc(Cl)c2Cl)c(F)c1 ZINC000432230067 338149259 /nfs/dbraw/zinc/14/92/59/338149259.db2.gz XIAZJGLJFUNZQQ-UHFFFAOYSA-N 1 2 308.180 4.623 20 0 DJADLO Clc1scc(C[NH2+][C@@H]2CSc3ccccc32)c1Cl ZINC000432255473 338151446 /nfs/dbraw/zinc/15/14/46/338151446.db2.gz PVVQNGHDKWCGIV-SNVBAGLBSA-N 1 2 316.278 4.992 20 0 DJADLO C[N@H+](CCC(F)(F)F)Cc1ccc(F)c(Cl)c1Cl ZINC000432737062 338165121 /nfs/dbraw/zinc/16/51/21/338165121.db2.gz IWWYROUMSQELQK-UHFFFAOYSA-N 1 2 304.114 4.517 20 0 DJADLO C[N@@H+](CCC(F)(F)F)Cc1ccc(F)c(Cl)c1Cl ZINC000432737062 338165122 /nfs/dbraw/zinc/16/51/22/338165122.db2.gz IWWYROUMSQELQK-UHFFFAOYSA-N 1 2 304.114 4.517 20 0 DJADLO C[C@@H](c1ccco1)[N@H+](Cc1nc2ccc(F)cc2s1)C1CC1 ZINC000432739185 338165168 /nfs/dbraw/zinc/16/51/68/338165168.db2.gz WTPVRWNDPZWWRR-NSHDSACASA-N 1 2 316.401 4.754 20 0 DJADLO C[C@@H](c1ccco1)[N@@H+](Cc1nc2ccc(F)cc2s1)C1CC1 ZINC000432739185 338165169 /nfs/dbraw/zinc/16/51/69/338165169.db2.gz WTPVRWNDPZWWRR-NSHDSACASA-N 1 2 316.401 4.754 20 0 DJADLO CC(C)(C)OC1CC[NH+](Cc2csc(Cl)c2Cl)CC1 ZINC000432741339 338165397 /nfs/dbraw/zinc/16/53/97/338165397.db2.gz KZSDVVQBEFKORZ-UHFFFAOYSA-N 1 2 322.301 4.834 20 0 DJADLO Cn1cccc1[C@H]1CCC[N@@H+]1Cc1csc(Cl)c1Cl ZINC000432748553 338166116 /nfs/dbraw/zinc/16/61/16/338166116.db2.gz PMXWNCALBMHUJL-GFCCVEGCSA-N 1 2 315.269 4.731 20 0 DJADLO Cn1cccc1[C@H]1CCC[N@H+]1Cc1csc(Cl)c1Cl ZINC000432748553 338166117 /nfs/dbraw/zinc/16/61/17/338166117.db2.gz PMXWNCALBMHUJL-GFCCVEGCSA-N 1 2 315.269 4.731 20 0 DJADLO CC(C)n1cc[nH+]c1CN1CC[C@@H](C(F)(F)F)c2ccccc21 ZINC000433023562 338176904 /nfs/dbraw/zinc/17/69/04/338176904.db2.gz RDBJKNVPCDOLLZ-CQSZACIVSA-N 1 2 323.362 4.520 20 0 DJADLO Cc1ccc([C@H]([NH2+]Cc2nccs2)c2ccccc2)c(C)c1 ZINC000194293901 338190953 /nfs/dbraw/zinc/19/09/53/338190953.db2.gz HWFVTGNFZIZGOK-LJQANCHMSA-N 1 2 308.450 4.639 20 0 DJADLO C[C@H]([NH2+]Cc1ncc(C(F)(F)F)s1)c1ccc(Cl)cc1 ZINC000433325228 338192577 /nfs/dbraw/zinc/19/25/77/338192577.db2.gz HQHWJPLJXROHRS-QMMMGPOBSA-N 1 2 320.767 4.666 20 0 DJADLO Cc1cc2cc([C@@H](C)[NH2+][C@@H](C)c3nccs3)oc2cc1C ZINC000153329536 338222471 /nfs/dbraw/zinc/22/24/71/338222471.db2.gz XYSQUMYLHSIKQT-OLZOCXBDSA-N 1 2 300.427 4.918 20 0 DJADLO CC(C)[N@H+](Cc1cccs1)Cc1ncc(C(F)(F)F)s1 ZINC000435136382 338233073 /nfs/dbraw/zinc/23/30/73/338233073.db2.gz BJDNEIDFWHTPFT-UHFFFAOYSA-N 1 2 320.405 4.634 20 0 DJADLO CC(C)[N@@H+](Cc1cccs1)Cc1ncc(C(F)(F)F)s1 ZINC000435136382 338233074 /nfs/dbraw/zinc/23/30/74/338233074.db2.gz BJDNEIDFWHTPFT-UHFFFAOYSA-N 1 2 320.405 4.634 20 0 DJADLO Cc1nc(C[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)sc1C ZINC000153961281 338234483 /nfs/dbraw/zinc/23/44/83/338234483.db2.gz DEBSZSPADWFQGX-VIFPVBQESA-N 1 2 315.269 4.918 20 0 DJADLO Cc1cc(C)c(NC(=O)N2CCC[C@@H]2C2CCCCC2)c(C)[nH+]1 ZINC000436485187 338273809 /nfs/dbraw/zinc/27/38/09/338273809.db2.gz AAKFXNMGJVHSDE-QGZVFWFLSA-N 1 2 315.461 4.583 20 0 DJADLO Cc1cc(C)c(NC(=O)N[C@@H](C)c2ccccc2Cl)c(C)[nH+]1 ZINC000436489013 338274084 /nfs/dbraw/zinc/27/40/84/338274084.db2.gz FCIMBKCJZSWSEW-LBPRGKRZSA-N 1 2 317.820 4.543 20 0 DJADLO CCC(CC)n1ccc(C[N@H+](CC)[C@@H](C)c2cccc(O)c2)n1 ZINC000438132268 338333926 /nfs/dbraw/zinc/33/39/26/338333926.db2.gz YKMYGBCZWXJNPZ-HNNXBMFYSA-N 1 2 315.461 4.533 20 0 DJADLO CCC(CC)n1ccc(C[N@@H+](CC)[C@@H](C)c2cccc(O)c2)n1 ZINC000438132268 338333927 /nfs/dbraw/zinc/33/39/27/338333927.db2.gz YKMYGBCZWXJNPZ-HNNXBMFYSA-N 1 2 315.461 4.533 20 0 DJADLO Cc1cccc(C(C)C)c1NCc1c[nH+]cn1Cc1ccccc1 ZINC000438302686 338339144 /nfs/dbraw/zinc/33/91/44/338339144.db2.gz IJNJQQZXFWUYLE-UHFFFAOYSA-N 1 2 319.452 4.975 20 0 DJADLO CCSc1ccccc1OCc1c[nH+]cn1Cc1ccccc1 ZINC000438326223 338339782 /nfs/dbraw/zinc/33/97/82/338339782.db2.gz VQISPVOFMHTBQZ-UHFFFAOYSA-N 1 2 324.449 4.622 20 0 DJADLO Cc1ccc(N[C@@H](c2ccc(Br)s2)C2CC2)c[nH+]1 ZINC000439133447 338362103 /nfs/dbraw/zinc/36/21/03/338362103.db2.gz SGANELPSJGJAFT-CQSZACIVSA-N 1 2 323.259 4.777 20 0 DJADLO C[C@H](SCc1c[nH+]cn1C)c1ccc(Cl)c(Cl)c1 ZINC000439541114 338372808 /nfs/dbraw/zinc/37/28/08/338372808.db2.gz KSDZYPWLONONEX-VIFPVBQESA-N 1 2 301.242 4.721 20 0 DJADLO Cc1cnc(C[N@@H+]2CCCC[C@H]2c2ccccc2C(F)(F)F)o1 ZINC000439806880 338378833 /nfs/dbraw/zinc/37/88/33/338378833.db2.gz SBSJMKFPMUHRKV-HNNXBMFYSA-N 1 2 324.346 4.729 20 0 DJADLO Cc1cnc(C[N@H+]2CCCC[C@H]2c2ccccc2C(F)(F)F)o1 ZINC000439806880 338378834 /nfs/dbraw/zinc/37/88/34/338378834.db2.gz SBSJMKFPMUHRKV-HNNXBMFYSA-N 1 2 324.346 4.729 20 0 DJADLO CC(C)CCc1nc(C[N@H+](C)[C@H](C)c2cccc(O)c2)cs1 ZINC000440401243 338386766 /nfs/dbraw/zinc/38/67/66/338386766.db2.gz CZTURXCDLKFLAX-CQSZACIVSA-N 1 2 318.486 4.630 20 0 DJADLO CC(C)CCc1nc(C[N@@H+](C)[C@H](C)c2cccc(O)c2)cs1 ZINC000440401243 338386767 /nfs/dbraw/zinc/38/67/67/338386767.db2.gz CZTURXCDLKFLAX-CQSZACIVSA-N 1 2 318.486 4.630 20 0 DJADLO CC[C@@H](F)C[N@@H+]1CCC[C@H]1c1nc(-c2ccc(Cl)cc2)c[nH]1 ZINC000440795299 338397698 /nfs/dbraw/zinc/39/76/98/338397698.db2.gz ICTBYFHEPCFXFT-ZBFHGGJFSA-N 1 2 321.827 4.615 20 0 DJADLO CC[C@@H](F)C[N@H+]1CCC[C@H]1c1nc(-c2ccc(Cl)cc2)c[nH]1 ZINC000440795299 338397699 /nfs/dbraw/zinc/39/76/99/338397699.db2.gz ICTBYFHEPCFXFT-ZBFHGGJFSA-N 1 2 321.827 4.615 20 0 DJADLO Cc1ccc(NC(=O)c2ccc(Oc3ccccc3)cc2)c(C)[nH+]1 ZINC000446436141 338528136 /nfs/dbraw/zinc/52/81/36/338528136.db2.gz LRMBRHDBSISPOY-UHFFFAOYSA-N 1 2 318.376 4.743 20 0 DJADLO CCCN(C(=O)Nc1ccc(C)[nH+]c1C)[C@H]1CCc2ccccc21 ZINC000447193315 338547326 /nfs/dbraw/zinc/54/73/26/338547326.db2.gz OPIFCWIZQUSWNB-IBGZPJMESA-N 1 2 323.440 4.630 20 0 DJADLO CCCc1csc(C[NH2+][C@H](C)c2ccc(F)cc2Cl)n1 ZINC000449349943 338616275 /nfs/dbraw/zinc/61/62/75/338616275.db2.gz SIPBAKWNENIYOX-SNVBAGLBSA-N 1 2 312.841 4.739 20 0 DJADLO CCCOc1cccc2c(NCc3cnc(C4CC4)o3)cc[nH+]c12 ZINC000450919219 338712512 /nfs/dbraw/zinc/71/25/12/338712512.db2.gz YFGMEONUYQZEGV-UHFFFAOYSA-N 1 2 323.396 4.501 20 0 DJADLO Cc1ccc([C@H]([NH2+][C@@H]2C[C@H](C)n3ccnc32)c2ccccc2)cc1 ZINC000453056394 338788384 /nfs/dbraw/zinc/78/83/84/338788384.db2.gz KYEXFIOGNPEZQI-PWIZWCRZSA-N 1 2 317.436 4.577 20 0 DJADLO CCn1cc[nH+]c1[C@@H](C)Nc1ccc2nc(C(C)C)sc2c1 ZINC000453191112 338805266 /nfs/dbraw/zinc/80/52/66/338805266.db2.gz WDKXKTHYJIVNRZ-GFCCVEGCSA-N 1 2 314.458 4.809 20 0 DJADLO CCn1ccnc1[C@H](C)[NH2+][C@H]1CCc2cc(Cl)cc(Cl)c21 ZINC000453331733 338826152 /nfs/dbraw/zinc/82/61/52/338826152.db2.gz ADOZPEOBEBXTKI-HZMBPMFUSA-N 1 2 324.255 4.548 20 0 DJADLO CCCc1ncc(C[NH2+][C@@H](C)c2cc(Cl)ccc2OCC)o1 ZINC000453388127 338836307 /nfs/dbraw/zinc/83/63/07/338836307.db2.gz OYIQIVQRBNLHAN-LBPRGKRZSA-N 1 2 322.836 4.530 20 0 DJADLO Cc1ccc(NC(=O)c2ccc([C@H](C)C(F)(F)F)cc2)c(C)[nH+]1 ZINC000455959345 338915340 /nfs/dbraw/zinc/91/53/40/338915340.db2.gz WKWCXXMOURVBMQ-NSHDSACASA-N 1 2 322.330 4.617 20 0 DJADLO Cc1nnc([C@H](C)[N@@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)s1 ZINC000459575928 339036936 /nfs/dbraw/zinc/03/69/36/339036936.db2.gz LDDZNUXAWPOQFE-BBRMVZONSA-N 1 2 313.470 4.525 20 0 DJADLO Cc1nnc([C@H](C)[N@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)s1 ZINC000459575928 339036937 /nfs/dbraw/zinc/03/69/37/339036937.db2.gz LDDZNUXAWPOQFE-BBRMVZONSA-N 1 2 313.470 4.525 20 0 DJADLO Cc1cc(C)c(NC(=O)c2ccc(C)c(Cl)c2Cl)c(C)[nH+]1 ZINC000459927788 339050779 /nfs/dbraw/zinc/05/07/79/339050779.db2.gz IBOGXAPQBJWOSC-UHFFFAOYSA-N 1 2 323.223 4.874 20 0 DJADLO Cc1nc([C@H](C)[NH2+][C@@H](C)c2oc3ccccc3c2C)cs1 ZINC000462823581 339092255 /nfs/dbraw/zinc/09/22/55/339092255.db2.gz VZAZVYYKVHYGQY-RYUDHWBXSA-N 1 2 300.427 4.918 20 0 DJADLO COc1ccccc1[C@H](Nc1cccc[nH+]1)c1ccccc1Cl ZINC000462886003 339096170 /nfs/dbraw/zinc/09/61/70/339096170.db2.gz DECWDNBJZDYRJG-LJQANCHMSA-N 1 2 324.811 4.945 20 0 DJADLO CC(C)(C)Oc1ccc(CNc2cccc[nH+]2)c(C(F)(F)F)c1 ZINC000463013296 339100509 /nfs/dbraw/zinc/10/05/09/339100509.db2.gz QVXCGLIUYBMKEL-UHFFFAOYSA-N 1 2 324.346 4.890 20 0 DJADLO CCc1ccc([C@H]2C[C@@H](C)CCN2c2cc[nH+]c(C(C)C)n2)o1 ZINC000463068352 339103954 /nfs/dbraw/zinc/10/39/54/339103954.db2.gz KNZALFQUVQITBL-GOEBONIOSA-N 1 2 313.445 4.733 20 0 DJADLO Cc1cc(C)c(NC(=O)CCCc2ccccc2Cl)c(C)[nH+]1 ZINC000463260693 339112434 /nfs/dbraw/zinc/11/24/34/339112434.db2.gz RTKOXEUCJKXSPU-UHFFFAOYSA-N 1 2 316.832 4.622 20 0 DJADLO C[C@@H]1C[C@H]1CC(=O)Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000463605010 339122570 /nfs/dbraw/zinc/12/25/70/339122570.db2.gz UVZTWWOAUQCJGG-NEPJUHHUSA-N 1 2 316.788 4.512 20 0 DJADLO Cc1ccccc1[C@@H](C)[N@H+](C)Cc1nnc(-c2ccccc2)s1 ZINC000464110050 339134552 /nfs/dbraw/zinc/13/45/52/339134552.db2.gz RUBJSANFYMLCNC-OAHLLOKOSA-N 1 2 323.465 4.707 20 0 DJADLO Cc1ccccc1[C@@H](C)[N@@H+](C)Cc1nnc(-c2ccccc2)s1 ZINC000464110050 339134553 /nfs/dbraw/zinc/13/45/53/339134553.db2.gz RUBJSANFYMLCNC-OAHLLOKOSA-N 1 2 323.465 4.707 20 0 DJADLO CC(C)c1nc(C[N@@H+]2C[C@H](C)C[C@@H]2c2ccccc2F)cs1 ZINC000464731968 339150220 /nfs/dbraw/zinc/15/02/20/339150220.db2.gz HRDZZARPJFGSCJ-CXAGYDPISA-N 1 2 318.461 4.989 20 0 DJADLO CC(C)c1nc(C[N@H+]2C[C@H](C)C[C@@H]2c2ccccc2F)cs1 ZINC000464731968 339150221 /nfs/dbraw/zinc/15/02/21/339150221.db2.gz HRDZZARPJFGSCJ-CXAGYDPISA-N 1 2 318.461 4.989 20 0 DJADLO CC(C)c1nc(C[N@@H+]2C[C@H](C)C[C@H]2c2ccccc2F)cs1 ZINC000464731969 339150228 /nfs/dbraw/zinc/15/02/28/339150228.db2.gz HRDZZARPJFGSCJ-DYVFJYSZSA-N 1 2 318.461 4.989 20 0 DJADLO CC(C)c1nc(C[N@H+]2C[C@H](C)C[C@H]2c2ccccc2F)cs1 ZINC000464731969 339150229 /nfs/dbraw/zinc/15/02/29/339150229.db2.gz HRDZZARPJFGSCJ-DYVFJYSZSA-N 1 2 318.461 4.989 20 0 DJADLO FC(F)(F)C1CC[NH+](Cc2ccc(Cl)cc2Cl)CC1 ZINC000464780164 339153187 /nfs/dbraw/zinc/15/31/87/339153187.db2.gz XUVWXYVABLRAPR-UHFFFAOYSA-N 1 2 312.162 4.768 20 0 DJADLO FC(F)(F)C1CCC(CNc2cccc(-n3cc[nH+]c3)c2)CC1 ZINC000466475447 339206534 /nfs/dbraw/zinc/20/65/34/339206534.db2.gz TZZHCOLDWWYEHK-UHFFFAOYSA-N 1 2 323.362 4.653 20 0 DJADLO c1ccc(-c2ccc[nH+]c2NCc2ccc3ncccc3c2)cc1 ZINC000466636403 339211303 /nfs/dbraw/zinc/21/13/03/339211303.db2.gz TZYFKUIVCBFWDC-UHFFFAOYSA-N 1 2 311.388 4.909 20 0 DJADLO Cc1cccn2cc(-c3ccc(NC(=O)[C@@H](C)C(C)C)cc3)[nH+]c12 ZINC000498262915 339229769 /nfs/dbraw/zinc/22/97/69/339229769.db2.gz ITILAGOEPOCSQK-HNNXBMFYSA-N 1 2 321.424 4.540 20 0 DJADLO COCCc1ccccc1N[C@H]1CCC[C@@H](c2[nH+]cccc2C)C1 ZINC000467360687 339234064 /nfs/dbraw/zinc/23/40/64/339234064.db2.gz ZFCJZEDFQFQIRW-MOPGFXCFSA-N 1 2 324.468 4.717 20 0 DJADLO COc1cc(N[C@H]2CCC[C@@H](c3[nH+]cccc3C)C2)ccc1F ZINC000467368373 339234605 /nfs/dbraw/zinc/23/46/05/339234605.db2.gz VDHAKVSDSCKHQS-CABCVRRESA-N 1 2 314.404 4.676 20 0 DJADLO FC(F)(F)c1ccc(C[N@H+]2CCC[C@@H](C(F)(F)F)C2)s1 ZINC000467554295 339242338 /nfs/dbraw/zinc/24/23/38/339242338.db2.gz OVLHFAMPVJPVTM-MRVPVSSYSA-N 1 2 317.298 4.541 20 0 DJADLO FC(F)(F)c1ccc(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)s1 ZINC000467554295 339242339 /nfs/dbraw/zinc/24/23/39/339242339.db2.gz OVLHFAMPVJPVTM-MRVPVSSYSA-N 1 2 317.298 4.541 20 0 DJADLO Fc1ccc(C[NH+](Cc2cccs2)Cc2cccs2)nc1 ZINC000469367205 339287040 /nfs/dbraw/zinc/28/70/40/339287040.db2.gz KJZHTPNVIMSMFR-UHFFFAOYSA-N 1 2 318.442 4.546 20 0 DJADLO C[C@H]1CCC[C@H]1CC(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000469485322 339291246 /nfs/dbraw/zinc/29/12/46/339291246.db2.gz FKESQSMADPYXQS-GJZGRUSLSA-N 1 2 310.397 4.639 20 0 DJADLO Cc1cc(C[N@@H+]2CCCC[C@H]2c2cccc(C(F)(F)F)c2)no1 ZINC000469514742 339292254 /nfs/dbraw/zinc/29/22/54/339292254.db2.gz BJBVTVOPHLYDEY-INIZCTEOSA-N 1 2 324.346 4.729 20 0 DJADLO Cc1cc(C[N@H+]2CCCC[C@H]2c2cccc(C(F)(F)F)c2)no1 ZINC000469514742 339292255 /nfs/dbraw/zinc/29/22/55/339292255.db2.gz BJBVTVOPHLYDEY-INIZCTEOSA-N 1 2 324.346 4.729 20 0 DJADLO CC(C)(C)c1nc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2(C)C)cs1 ZINC000470007529 339308293 /nfs/dbraw/zinc/30/82/93/339308293.db2.gz CCCSXJLZCCEIGU-LLVKDONJSA-N 1 2 320.424 4.603 20 0 DJADLO CC(C)(C)c1nc(C[N@H+]2CC[C@@H](C(F)(F)F)C2(C)C)cs1 ZINC000470007529 339308294 /nfs/dbraw/zinc/30/82/94/339308294.db2.gz CCCSXJLZCCEIGU-LLVKDONJSA-N 1 2 320.424 4.603 20 0 DJADLO C[C@H](c1ccc(F)cc1F)[N@@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000470194444 339313706 /nfs/dbraw/zinc/31/37/06/339313706.db2.gz KJVIYEHTJNOORR-PSTGCABASA-N 1 2 323.408 4.549 20 0 DJADLO C[C@H](c1ccc(F)cc1F)[N@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000470194444 339313707 /nfs/dbraw/zinc/31/37/07/339313707.db2.gz KJVIYEHTJNOORR-PSTGCABASA-N 1 2 323.408 4.549 20 0 DJADLO C[C@H]1COC[C@@H](c2ccccc2)[N@@H+]1Cc1cccc(C(F)F)c1 ZINC000470762092 339327050 /nfs/dbraw/zinc/32/70/50/339327050.db2.gz OPGFEDSJROAEJR-KSSFIOAISA-N 1 2 317.379 4.586 20 0 DJADLO C[C@H]1COC[C@@H](c2ccccc2)[N@H+]1Cc1cccc(C(F)F)c1 ZINC000470762092 339327051 /nfs/dbraw/zinc/32/70/51/339327051.db2.gz OPGFEDSJROAEJR-KSSFIOAISA-N 1 2 317.379 4.586 20 0 DJADLO C[C@H]1COC[C@H](c2ccccc2)[N@@H+]1Cc1cccc(C(F)F)c1 ZINC000470762090 339327062 /nfs/dbraw/zinc/32/70/62/339327062.db2.gz OPGFEDSJROAEJR-KBXCAEBGSA-N 1 2 317.379 4.586 20 0 DJADLO C[C@H]1COC[C@H](c2ccccc2)[N@H+]1Cc1cccc(C(F)F)c1 ZINC000470762090 339327063 /nfs/dbraw/zinc/32/70/63/339327063.db2.gz OPGFEDSJROAEJR-KBXCAEBGSA-N 1 2 317.379 4.586 20 0 DJADLO CSc1ccccc1C[N@H+](C)Cc1coc(-c2ccccc2)n1 ZINC000471016278 339334427 /nfs/dbraw/zinc/33/44/27/339334427.db2.gz CTLYXRUFENKLHX-UHFFFAOYSA-N 1 2 324.449 4.696 20 0 DJADLO CSc1ccccc1C[N@@H+](C)Cc1coc(-c2ccccc2)n1 ZINC000471016278 339334428 /nfs/dbraw/zinc/33/44/28/339334428.db2.gz CTLYXRUFENKLHX-UHFFFAOYSA-N 1 2 324.449 4.696 20 0 DJADLO CCC(CC)n1ccc(C[N@H+](C)Cc2ccccc2SC)n1 ZINC000471024106 339334753 /nfs/dbraw/zinc/33/47/53/339334753.db2.gz XXBOFMPHSXWORZ-UHFFFAOYSA-N 1 2 317.502 4.598 20 0 DJADLO CCC(CC)n1ccc(C[N@@H+](C)Cc2ccccc2SC)n1 ZINC000471024106 339334754 /nfs/dbraw/zinc/33/47/54/339334754.db2.gz XXBOFMPHSXWORZ-UHFFFAOYSA-N 1 2 317.502 4.598 20 0 DJADLO Clc1ccc(C[N@H+](Cc2ccncc2Cl)C2CC2)cc1 ZINC000472430712 339371747 /nfs/dbraw/zinc/37/17/47/339371747.db2.gz JCMWNLRFRBMNSC-UHFFFAOYSA-N 1 2 307.224 4.553 20 0 DJADLO Clc1ccc(C[N@@H+](Cc2ccncc2Cl)C2CC2)cc1 ZINC000472430712 339371748 /nfs/dbraw/zinc/37/17/48/339371748.db2.gz JCMWNLRFRBMNSC-UHFFFAOYSA-N 1 2 307.224 4.553 20 0 DJADLO COc1c2ccccc2oc1C[NH2+][C@H](C)c1cccc(F)c1F ZINC000474048631 339399021 /nfs/dbraw/zinc/39/90/21/339399021.db2.gz SLCNYKMZGSDNCD-LLVKDONJSA-N 1 2 317.335 4.570 20 0 DJADLO Cc1ccc(CCCNc2cccc(CC(F)(F)F)c2)c[nH+]1 ZINC000474462711 339415497 /nfs/dbraw/zinc/41/54/97/339415497.db2.gz UARUEHPRIBLXFR-UHFFFAOYSA-N 1 2 308.347 4.540 20 0 DJADLO Cc1ccc(CNc2ccc(COc3ccccc3)cc2)c(C)[nH+]1 ZINC000478333898 339513694 /nfs/dbraw/zinc/51/36/94/339513694.db2.gz BYPBYLFCBQOOGP-UHFFFAOYSA-N 1 2 318.420 4.890 20 0 DJADLO Cc1ccc(CSCc2ccccc2OC(F)F)c(C)[nH+]1 ZINC000478904785 339524286 /nfs/dbraw/zinc/52/42/86/339524286.db2.gz BNJTZOPWDDVSAK-UHFFFAOYSA-N 1 2 309.381 4.733 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)NC1CCC2(CCCCC2)CC1 ZINC000485565837 339705785 /nfs/dbraw/zinc/70/57/85/339705785.db2.gz BEEVGDRWKZLJCJ-UHFFFAOYSA-N 1 2 315.461 4.713 20 0 DJADLO Cc1cc(OCc2ncc(-c3ccccc3)o2)c2ccccc2[nH+]1 ZINC000486198715 339723154 /nfs/dbraw/zinc/72/31/54/339723154.db2.gz UXGIFSQRENXKCE-UHFFFAOYSA-N 1 2 316.360 4.777 20 0 DJADLO O=C(Nc1cccc(Cl)c1)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000496073373 339997779 /nfs/dbraw/zinc/99/77/79/339997779.db2.gz QYMRBKZOLYZJFI-UHFFFAOYSA-N 1 2 324.767 4.780 20 0 DJADLO CC(C)n1ccnc1C[N@H+](Cc1ccc2ccccc2c1)C1CC1 ZINC000501350786 340078927 /nfs/dbraw/zinc/07/89/27/340078927.db2.gz KEXWGFYHPABKRZ-UHFFFAOYSA-N 1 2 319.452 4.782 20 0 DJADLO CC(C)n1ccnc1C[N@@H+](Cc1ccc2ccccc2c1)C1CC1 ZINC000501350786 340078928 /nfs/dbraw/zinc/07/89/28/340078928.db2.gz KEXWGFYHPABKRZ-UHFFFAOYSA-N 1 2 319.452 4.782 20 0 DJADLO c1c(-c2ccc(N[C@H]3CCC34CCC4)cc2)[nH+]c2n1CCCC2 ZINC000502405564 340102087 /nfs/dbraw/zinc/10/20/87/340102087.db2.gz JPWQGQLJMZQXKC-SFHVURJKSA-N 1 2 307.441 4.631 20 0 DJADLO Cc1cc([C@H](C)[NH2+]Cc2csc(-c3ccccc3)n2)oc1C ZINC000502408551 340102217 /nfs/dbraw/zinc/10/22/17/340102217.db2.gz UWBCVLJHMBONDT-ZDUSSCGKSA-N 1 2 312.438 4.871 20 0 DJADLO Cc1cc([C@H](C)[NH2+]Cc2coc(-c3ccc(C)cc3)n2)oc1C ZINC000502411441 340102401 /nfs/dbraw/zinc/10/24/01/340102401.db2.gz AMELIVJJWNYZSL-AWEZNQCLSA-N 1 2 310.397 4.711 20 0 DJADLO COCC[C@@H]1CCC[C@H]1Nc1cccc([NH+]2CCCCCC2)c1 ZINC000502461203 340104681 /nfs/dbraw/zinc/10/46/81/340104681.db2.gz IYLDFDKZNZGLKA-FXAWDEMLSA-N 1 2 316.489 4.684 20 0 DJADLO O=C(CCCC1CCCCC1)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000502571996 340108067 /nfs/dbraw/zinc/10/80/67/340108067.db2.gz VMAXEWVDZBWCDW-UHFFFAOYSA-N 1 2 311.429 4.766 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1cnn(C2CCCC2)c1)c1c(F)cccc1F ZINC000502696783 340111052 /nfs/dbraw/zinc/11/10/52/340111052.db2.gz FZZACTUUULBPRA-QWHCGFSZSA-N 1 2 319.399 4.688 20 0 DJADLO CC[C@@H]1c2ccsc2CC[N@H+]1Cc1ncc(C(C)(C)C)o1 ZINC000503164519 340122334 /nfs/dbraw/zinc/12/23/34/340122334.db2.gz KWGPLRFPJFJHBE-CYBMUJFWSA-N 1 2 304.459 4.543 20 0 DJADLO CC[C@@H]1c2ccsc2CC[N@@H+]1Cc1ncc(C(C)(C)C)o1 ZINC000503164519 340122335 /nfs/dbraw/zinc/12/23/35/340122335.db2.gz KWGPLRFPJFJHBE-CYBMUJFWSA-N 1 2 304.459 4.543 20 0 DJADLO CCc1ncc(C[N@H+](Cc2ccco2)Cc2cccs2)s1 ZINC000505553314 340170908 /nfs/dbraw/zinc/17/09/08/340170908.db2.gz KRPHPEKOWONXPN-UHFFFAOYSA-N 1 2 318.467 4.562 20 0 DJADLO CCc1ncc(C[N@@H+](Cc2ccco2)Cc2cccs2)s1 ZINC000505553314 340170909 /nfs/dbraw/zinc/17/09/09/340170909.db2.gz KRPHPEKOWONXPN-UHFFFAOYSA-N 1 2 318.467 4.562 20 0 DJADLO CC[N@H+](Cc1csc(-c2ccco2)n1)Cc1cccc(F)c1 ZINC000506055986 340184541 /nfs/dbraw/zinc/18/45/41/340184541.db2.gz PZBODGPTGMBYQY-UHFFFAOYSA-N 1 2 316.401 4.564 20 0 DJADLO CC[N@@H+](Cc1csc(-c2ccco2)n1)Cc1cccc(F)c1 ZINC000506055986 340184542 /nfs/dbraw/zinc/18/45/42/340184542.db2.gz PZBODGPTGMBYQY-UHFFFAOYSA-N 1 2 316.401 4.564 20 0 DJADLO C[C@H]1C[C@H]1c1ccc(C[NH+](Cc2ccco2)Cc2ccco2)o1 ZINC000506085936 340185249 /nfs/dbraw/zinc/18/52/49/340185249.db2.gz LFSRDQSAAPWLFF-KBXCAEBGSA-N 1 2 311.381 4.791 20 0 DJADLO CC(C)c1nc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)cs1 ZINC000506478205 340195392 /nfs/dbraw/zinc/19/53/92/340195392.db2.gz SKIIBMNEARVTHS-MRXNPFEDSA-N 1 2 318.511 4.557 20 0 DJADLO CC(C)c1nc(C[N@H+]2CCSC[C@@H]2c2ccccc2)cs1 ZINC000506478205 340195393 /nfs/dbraw/zinc/19/53/93/340195393.db2.gz SKIIBMNEARVTHS-MRXNPFEDSA-N 1 2 318.511 4.557 20 0 DJADLO CC(C)c1nc(C[N@H+](Cc2ccc(F)cc2)C(C)C)cs1 ZINC000507115057 340207891 /nfs/dbraw/zinc/20/78/91/340207891.db2.gz CSUBZECSDZJSSL-UHFFFAOYSA-N 1 2 306.450 4.816 20 0 DJADLO CC(C)c1nc(C[N@@H+](Cc2ccc(F)cc2)C(C)C)cs1 ZINC000507115057 340207892 /nfs/dbraw/zinc/20/78/92/340207892.db2.gz CSUBZECSDZJSSL-UHFFFAOYSA-N 1 2 306.450 4.816 20 0 DJADLO CSCc1cnc(C[N@H+](C)[C@H](C)c2ccc(C)cc2)s1 ZINC000507192014 340212303 /nfs/dbraw/zinc/21/23/03/340212303.db2.gz QPTRJZDPGNGHFG-CYBMUJFWSA-N 1 2 306.500 4.508 20 0 DJADLO CSCc1cnc(C[N@@H+](C)[C@H](C)c2ccc(C)cc2)s1 ZINC000507192014 340212304 /nfs/dbraw/zinc/21/23/04/340212304.db2.gz QPTRJZDPGNGHFG-CYBMUJFWSA-N 1 2 306.500 4.508 20 0 DJADLO CSCc1cnc(C[N@H+](C)[C@H](C)c2cc(C)ccc2C)s1 ZINC000507193107 340212468 /nfs/dbraw/zinc/21/24/68/340212468.db2.gz NBQIRVABLFWOMP-CQSZACIVSA-N 1 2 320.527 4.816 20 0 DJADLO CSCc1cnc(C[N@@H+](C)[C@H](C)c2cc(C)ccc2C)s1 ZINC000507193107 340212469 /nfs/dbraw/zinc/21/24/69/340212469.db2.gz NBQIRVABLFWOMP-CQSZACIVSA-N 1 2 320.527 4.816 20 0 DJADLO C[C@@H](c1cc(F)ccc1F)[N@H+](C)Cc1cnc(C2CCC2)s1 ZINC000507205922 340213135 /nfs/dbraw/zinc/21/31/35/340213135.db2.gz AEMKTVAEHSOTQM-NSHDSACASA-N 1 2 322.424 4.882 20 0 DJADLO C[C@@H](c1cc(F)ccc1F)[N@@H+](C)Cc1cnc(C2CCC2)s1 ZINC000507205922 340213136 /nfs/dbraw/zinc/21/31/36/340213136.db2.gz AEMKTVAEHSOTQM-NSHDSACASA-N 1 2 322.424 4.882 20 0 DJADLO Cc1nc2sccn2c1C[N@@H+](C)[C@H](C)c1ccccc1Cl ZINC000507222149 340214433 /nfs/dbraw/zinc/21/44/33/340214433.db2.gz RMYGQPKQZVOXNT-GFCCVEGCSA-N 1 2 319.861 4.551 20 0 DJADLO Cc1nc2sccn2c1C[N@H+](C)[C@H](C)c1ccccc1Cl ZINC000507222149 340214434 /nfs/dbraw/zinc/21/44/34/340214434.db2.gz RMYGQPKQZVOXNT-GFCCVEGCSA-N 1 2 319.861 4.551 20 0 DJADLO CSCc1cnc(C[N@H+](Cc2cccc(F)c2)C(C)C)s1 ZINC000507226940 340214763 /nfs/dbraw/zinc/21/47/63/340214763.db2.gz HMTTVHWFWGHRGV-UHFFFAOYSA-N 1 2 324.490 4.556 20 0 DJADLO CSCc1cnc(C[N@@H+](Cc2cccc(F)c2)C(C)C)s1 ZINC000507226940 340214764 /nfs/dbraw/zinc/21/47/64/340214764.db2.gz HMTTVHWFWGHRGV-UHFFFAOYSA-N 1 2 324.490 4.556 20 0 DJADLO Cc1nocc1C[N@@H+]1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000507227975 340214766 /nfs/dbraw/zinc/21/47/66/340214766.db2.gz JPGZIDWTYCFOEZ-OAHLLOKOSA-N 1 2 311.212 4.627 20 0 DJADLO Cc1nocc1C[N@H+]1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000507227975 340214767 /nfs/dbraw/zinc/21/47/67/340214767.db2.gz JPGZIDWTYCFOEZ-OAHLLOKOSA-N 1 2 311.212 4.627 20 0 DJADLO CCc1cccnc1[C@@H](C)[NH2+][C@H](c1nccs1)c1ccccc1 ZINC000507486779 340222294 /nfs/dbraw/zinc/22/22/94/340222294.db2.gz PHEQKVLHMPHTMI-KDOFPFPSSA-N 1 2 323.465 4.541 20 0 DJADLO CCc1cccnc1[C@@H](C)[NH2+][C@@H](c1nccs1)c1ccccc1 ZINC000507486781 340222318 /nfs/dbraw/zinc/22/23/18/340222318.db2.gz PHEQKVLHMPHTMI-RDTXWAMCSA-N 1 2 323.465 4.541 20 0 DJADLO CCc1cccnc1[C@H](C)[NH2+][C@H](C)c1nc(C(C)(C)C)cs1 ZINC000507517871 340223920 /nfs/dbraw/zinc/22/39/20/340223920.db2.gz ZAYHGJCTNNAOTP-QWHCGFSZSA-N 1 2 317.502 4.810 20 0 DJADLO C[C@H](c1ccc(F)cc1)[N@@H+]1CCO[C@H](c2ccccc2Cl)C1 ZINC000507789193 340231524 /nfs/dbraw/zinc/23/15/24/340231524.db2.gz SBKRWDOOSSAUET-ACJLOTCBSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@H](c1ccc(F)cc1)[N@H+]1CCO[C@H](c2ccccc2Cl)C1 ZINC000507789193 340231525 /nfs/dbraw/zinc/23/15/25/340231525.db2.gz SBKRWDOOSSAUET-ACJLOTCBSA-N 1 2 319.807 4.614 20 0 DJADLO Clc1cccc(C[N@@H+]2CCO[C@@H](c3ccccc3Cl)C2)c1 ZINC000507803565 340232081 /nfs/dbraw/zinc/23/20/81/340232081.db2.gz ANMZVLCWMZKZKC-QGZVFWFLSA-N 1 2 322.235 4.567 20 0 DJADLO Clc1cccc(C[N@H+]2CCO[C@@H](c3ccccc3Cl)C2)c1 ZINC000507803565 340232082 /nfs/dbraw/zinc/23/20/82/340232082.db2.gz ANMZVLCWMZKZKC-QGZVFWFLSA-N 1 2 322.235 4.567 20 0 DJADLO Cc1noc([C@H](C)[NH2+][C@H](C)c2ccc(Oc3ccccc3)cc2)n1 ZINC000507898172 340235497 /nfs/dbraw/zinc/23/54/97/340235497.db2.gz YGVIGZGQGZATLQ-KGLIPLIRSA-N 1 2 323.396 4.582 20 0 DJADLO Cc1c2cccc(Cl)c2sc1C[N@H+](C)Cc1nccs1 ZINC000508704308 340250940 /nfs/dbraw/zinc/25/09/40/340250940.db2.gz SPQMCNQNNGYMLP-UHFFFAOYSA-N 1 2 322.886 4.952 20 0 DJADLO Cc1c2cccc(Cl)c2sc1C[N@@H+](C)Cc1nccs1 ZINC000508704308 340250941 /nfs/dbraw/zinc/25/09/41/340250941.db2.gz SPQMCNQNNGYMLP-UHFFFAOYSA-N 1 2 322.886 4.952 20 0 DJADLO Cc1cc(C)cc(NC(=O)c2ccccc2Oc2cc[nH+]cc2)c1 ZINC000509018183 340258488 /nfs/dbraw/zinc/25/84/88/340258488.db2.gz YRGZFVPHBCWWDX-UHFFFAOYSA-N 1 2 318.376 4.743 20 0 DJADLO Cc1ccc(F)cc1NC(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000509026333 340258586 /nfs/dbraw/zinc/25/85/86/340258586.db2.gz JBULYVMWXWAALJ-UHFFFAOYSA-N 1 2 322.339 4.574 20 0 DJADLO O=C(Nc1ccccc1Cl)c1ccccc1Oc1cc[nH+]cc1 ZINC000509026323 340258688 /nfs/dbraw/zinc/25/86/88/340258688.db2.gz IVJAGCDZWATRCL-UHFFFAOYSA-N 1 2 324.767 4.780 20 0 DJADLO Cc1ccc(F)c(NC(=O)c2ccccc2Oc2cc[nH+]cc2)c1 ZINC000509032078 340258950 /nfs/dbraw/zinc/25/89/50/340258950.db2.gz HJZAKHPJCFHXQA-UHFFFAOYSA-N 1 2 322.339 4.574 20 0 DJADLO Cc1cc(N2[C@@H]3CC[C@H]2C[C@@H](c2ccccc2)C3)nc(C2CC2)[nH+]1 ZINC000509488536 340271266 /nfs/dbraw/zinc/27/12/66/340271266.db2.gz XCMYCWXSULAPNL-REPLKXPHSA-N 1 2 319.452 4.577 20 0 DJADLO CC[C@@H]1CCC[C@H](NC(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000509949486 340283664 /nfs/dbraw/zinc/28/36/64/340283664.db2.gz QMOXCNXYSHHALV-CVEARBPZSA-N 1 2 324.424 4.573 20 0 DJADLO CC(C)[N@H+](Cc1nccs1)Cc1ccc(Cl)c(Cl)c1 ZINC000510187675 340292029 /nfs/dbraw/zinc/29/20/29/340292029.db2.gz ZIYNJYLQJDTFLE-UHFFFAOYSA-N 1 2 315.269 4.861 20 0 DJADLO CC(C)[N@@H+](Cc1nccs1)Cc1ccc(Cl)c(Cl)c1 ZINC000510187675 340292030 /nfs/dbraw/zinc/29/20/30/340292030.db2.gz ZIYNJYLQJDTFLE-UHFFFAOYSA-N 1 2 315.269 4.861 20 0 DJADLO Clc1ccccc1C[N@@H+](Cc1ncc(C2CC2)o1)CC1CC1 ZINC000510255154 340294146 /nfs/dbraw/zinc/29/41/46/340294146.db2.gz HXGWUAXUVVLFII-UHFFFAOYSA-N 1 2 316.832 4.618 20 0 DJADLO Clc1ccccc1C[N@H+](Cc1ncc(C2CC2)o1)CC1CC1 ZINC000510255154 340294147 /nfs/dbraw/zinc/29/41/47/340294147.db2.gz HXGWUAXUVVLFII-UHFFFAOYSA-N 1 2 316.832 4.618 20 0 DJADLO Cc1csc(C[N@@H+](Cc2ccccc2Cl)CC2CC2)n1 ZINC000510258391 340294394 /nfs/dbraw/zinc/29/43/94/340294394.db2.gz ZCMSQROSFLBTNF-UHFFFAOYSA-N 1 2 306.862 4.517 20 0 DJADLO Cc1csc(C[N@H+](Cc2ccccc2Cl)CC2CC2)n1 ZINC000510258391 340294395 /nfs/dbraw/zinc/29/43/95/340294395.db2.gz ZCMSQROSFLBTNF-UHFFFAOYSA-N 1 2 306.862 4.517 20 0 DJADLO c1ccc(N2Cc3cccc(N[C@H]4CC[C@H]4C4CCC4)c3C2)[nH+]c1 ZINC000510701267 340307184 /nfs/dbraw/zinc/30/71/84/340307184.db2.gz HGNPCRBKOHEPRZ-PXNSSMCTSA-N 1 2 319.452 4.592 20 0 DJADLO Fc1ccccc1C[N@H+](Cc1cc(-c2ccccc2)on1)C1CC1 ZINC000510905754 340314445 /nfs/dbraw/zinc/31/44/45/340314445.db2.gz IKGYZPKCJUDUAG-UHFFFAOYSA-N 1 2 322.383 4.645 20 0 DJADLO Fc1ccccc1C[N@@H+](Cc1cc(-c2ccccc2)on1)C1CC1 ZINC000510905754 340314446 /nfs/dbraw/zinc/31/44/46/340314446.db2.gz IKGYZPKCJUDUAG-UHFFFAOYSA-N 1 2 322.383 4.645 20 0 DJADLO Cc1cnc(C[N@H+]2CC=C(c3ccc(Cl)c(Cl)c3)CC2)o1 ZINC000511190484 340323580 /nfs/dbraw/zinc/32/35/80/340323580.db2.gz YNWFJAROQFVBBX-UHFFFAOYSA-N 1 2 323.223 4.579 20 0 DJADLO Cc1cnc(C[N@@H+]2CC=C(c3ccc(Cl)c(Cl)c3)CC2)o1 ZINC000511190484 340323581 /nfs/dbraw/zinc/32/35/81/340323581.db2.gz YNWFJAROQFVBBX-UHFFFAOYSA-N 1 2 323.223 4.579 20 0 DJADLO Cc1cc(C[N@H+]2CC=C(c3ccc(Cl)c(Cl)c3)CC2)no1 ZINC000511202792 340323827 /nfs/dbraw/zinc/32/38/27/340323827.db2.gz YPQJMROPIAJRNH-UHFFFAOYSA-N 1 2 323.223 4.579 20 0 DJADLO Cc1cc(C[N@@H+]2CC=C(c3ccc(Cl)c(Cl)c3)CC2)no1 ZINC000511202792 340323828 /nfs/dbraw/zinc/32/38/28/340323828.db2.gz YPQJMROPIAJRNH-UHFFFAOYSA-N 1 2 323.223 4.579 20 0 DJADLO C[C@H](c1nc2ccccc2o1)[N@@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000511546259 340330207 /nfs/dbraw/zinc/33/02/07/340330207.db2.gz PHYFUNDXMKIXFL-WBMJQRKESA-N 1 2 312.800 4.989 20 0 DJADLO C[C@H](c1nc2ccccc2o1)[N@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000511546259 340330208 /nfs/dbraw/zinc/33/02/08/340330208.db2.gz PHYFUNDXMKIXFL-WBMJQRKESA-N 1 2 312.800 4.989 20 0 DJADLO Fc1ccc2oc(C[N@@H+]3CC[C@@H]3c3ccc(Cl)cc3)nc2c1 ZINC000511560795 340330729 /nfs/dbraw/zinc/33/07/29/340330729.db2.gz GUVLJHKAORDTNH-OAHLLOKOSA-N 1 2 316.763 4.567 20 0 DJADLO Fc1ccc2oc(C[N@H+]3CC[C@@H]3c3ccc(Cl)cc3)nc2c1 ZINC000511560795 340330730 /nfs/dbraw/zinc/33/07/30/340330730.db2.gz GUVLJHKAORDTNH-OAHLLOKOSA-N 1 2 316.763 4.567 20 0 DJADLO Fc1ccc2nc(C[N@@H+]3CC[C@@H]3c3ccc(Cl)cc3)oc2c1 ZINC000511625155 340332866 /nfs/dbraw/zinc/33/28/66/340332866.db2.gz RGRHFBDWUTXGHV-OAHLLOKOSA-N 1 2 316.763 4.567 20 0 DJADLO Fc1ccc2nc(C[N@H+]3CC[C@@H]3c3ccc(Cl)cc3)oc2c1 ZINC000511625155 340332867 /nfs/dbraw/zinc/33/28/67/340332867.db2.gz RGRHFBDWUTXGHV-OAHLLOKOSA-N 1 2 316.763 4.567 20 0 DJADLO Cc1occc1C[N@H+](C)Cc1csc(-c2ccc(C)cc2)n1 ZINC000511639496 340333412 /nfs/dbraw/zinc/33/34/12/340333412.db2.gz HGHHFRFCOMCFHO-UHFFFAOYSA-N 1 2 312.438 4.652 20 0 DJADLO Cc1occc1C[N@@H+](C)Cc1csc(-c2ccc(C)cc2)n1 ZINC000511639496 340333413 /nfs/dbraw/zinc/33/34/13/340333413.db2.gz HGHHFRFCOMCFHO-UHFFFAOYSA-N 1 2 312.438 4.652 20 0 DJADLO CCn1cc[nH+]c1CSCc1ccc(SC(C)C)cc1 ZINC000511950368 340343625 /nfs/dbraw/zinc/34/36/25/340343625.db2.gz YIBWOCVVAFINRP-UHFFFAOYSA-N 1 2 306.500 4.837 20 0 DJADLO Cc1sccc1C[N@H+]1CCCCC[C@H]1c1noc(C(C)C)n1 ZINC000512313548 340356625 /nfs/dbraw/zinc/35/66/25/340356625.db2.gz LIOWTRBHLACDSB-HNNXBMFYSA-N 1 2 319.474 4.680 20 0 DJADLO Cc1sccc1C[N@@H+]1CCCCC[C@H]1c1noc(C(C)C)n1 ZINC000512313548 340356626 /nfs/dbraw/zinc/35/66/26/340356626.db2.gz LIOWTRBHLACDSB-HNNXBMFYSA-N 1 2 319.474 4.680 20 0 DJADLO C[C@@H](CC1CCCCC1)C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000303518190 340637038 /nfs/dbraw/zinc/63/70/38/340637038.db2.gz DQTGUMJQWHBYKW-AWEZNQCLSA-N 1 2 311.429 4.622 20 0 DJADLO C[C@@H](Nc1ccc(N2CCCC2)[nH+]c1)c1ccc(Cl)cc1 ZINC000036982162 340726139 /nfs/dbraw/zinc/72/61/39/340726139.db2.gz SXAFICLHANMOQU-CYBMUJFWSA-N 1 2 301.821 4.508 20 0 DJADLO C[C@@H](C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1)c1ccccc1 ZINC000124153454 340797490 /nfs/dbraw/zinc/79/74/90/340797490.db2.gz IMWHRVVGRZDNPS-OAHLLOKOSA-N 1 2 318.376 4.616 20 0 DJADLO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2noc(-c3ccccc3)n2)c(C)c1 ZINC000124422931 340799020 /nfs/dbraw/zinc/79/90/20/340799020.db2.gz YYMKMWMDYCEDMQ-CVEARBPZSA-N 1 2 321.424 4.765 20 0 DJADLO CCc1cnc(C[NH2+][C@@H](c2oc3ccccc3c2C)C(C)C)o1 ZINC000540359469 340928409 /nfs/dbraw/zinc/92/84/09/340928409.db2.gz QXNDYUGNQSUMGE-GOSISDBHSA-N 1 2 312.413 4.779 20 0 DJADLO Cc1ccc([C@H](C)Nc2ccc(-c3[nH+]cc4n3CCCC4)cc2)o1 ZINC000540841739 340948525 /nfs/dbraw/zinc/94/85/25/340948525.db2.gz JLSJTDWUHMLSOJ-HNNXBMFYSA-N 1 2 321.424 4.961 20 0 DJADLO CCCC(CCC)[NH2+][C@H](c1noc(C)n1)c1ccc(Cl)cc1 ZINC000541206672 340961723 /nfs/dbraw/zinc/96/17/23/340961723.db2.gz DLHSWBNIBGSQHJ-INIZCTEOSA-N 1 2 321.852 4.679 20 0 DJADLO CC(C)c1cc(N2CCC[C@H](C(F)(F)F)C2)nc(C(C)C)[nH+]1 ZINC000541207384 340961763 /nfs/dbraw/zinc/96/17/63/340961763.db2.gz LNIYVUVOPDYISO-LBPRGKRZSA-N 1 2 315.383 4.502 20 0 DJADLO CC(C)C[C@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)no1)c1cccs1 ZINC000541627129 340978317 /nfs/dbraw/zinc/97/83/17/340978317.db2.gz TZICEGDKOZPLIH-STQMWFEESA-N 1 2 321.490 4.867 20 0 DJADLO c1coc([C@@H]([NH2+]Cc2cnc(C3CCC3)s2)c2ccccc2)c1 ZINC000130182868 341005410 /nfs/dbraw/zinc/00/54/10/341005410.db2.gz PLUBRIPTPJDRDD-SFHVURJKSA-N 1 2 324.449 4.883 20 0 DJADLO CC(C)c1cnc(C[N@H+](Cc2ccccc2F)C(C)C)s1 ZINC000542465061 341008240 /nfs/dbraw/zinc/00/82/40/341008240.db2.gz REIWCVXDUBZFLI-UHFFFAOYSA-N 1 2 306.450 4.816 20 0 DJADLO CC(C)c1cnc(C[N@@H+](Cc2ccccc2F)C(C)C)s1 ZINC000542465061 341008241 /nfs/dbraw/zinc/00/82/41/341008241.db2.gz REIWCVXDUBZFLI-UHFFFAOYSA-N 1 2 306.450 4.816 20 0 DJADLO Cc1cc([C@H]([NH2+]Cc2ccccc2F)c2cccnc2)ccc1F ZINC000542477976 341009067 /nfs/dbraw/zinc/00/90/67/341009067.db2.gz CFZRISFQIGCPBH-FQEVSTJZSA-N 1 2 324.374 4.547 20 0 DJADLO CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1ncc(CC)s1 ZINC000130486400 341022858 /nfs/dbraw/zinc/02/28/58/341022858.db2.gz PIMGLFYATKGLNM-LLVKDONJSA-N 1 2 324.877 4.608 20 0 DJADLO Fc1cccc(C=C2CC[NH+](Cc3nc4ccccc4o3)CC2)c1 ZINC000542939539 341026777 /nfs/dbraw/zinc/02/67/77/341026777.db2.gz JUKLVLMKANZDOK-UHFFFAOYSA-N 1 2 322.383 4.646 20 0 DJADLO CC(C)c1ccccc1NC(=O)[C@@H](C)[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000543059711 341029614 /nfs/dbraw/zinc/02/96/14/341029614.db2.gz CIBMUMPVTFLQPA-JKSUJKDBSA-N 1 2 322.452 4.714 20 0 DJADLO CC(C)c1ccccc1NC(=O)[C@@H](C)[N@H+]1Cc2ccccc2[C@@H]1C ZINC000543059711 341029615 /nfs/dbraw/zinc/02/96/15/341029615.db2.gz CIBMUMPVTFLQPA-JKSUJKDBSA-N 1 2 322.452 4.714 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1cc2c(ccc3ccccc23)o1)c1ccon1 ZINC000543627158 341051898 /nfs/dbraw/zinc/05/18/98/341051898.db2.gz SJQNPFZDDGEZFD-CHWSQXEVSA-N 1 2 306.365 4.986 20 0 DJADLO Cc1ccc2[nH+]c(CNc3cccc(C(F)F)c3Cl)cn2c1 ZINC000543656706 341053093 /nfs/dbraw/zinc/05/30/93/341053093.db2.gz HIEYUXCNTBPRQW-UHFFFAOYSA-N 1 2 321.758 4.846 20 0 DJADLO CCCc1csc(C[NH2+]Cc2c(Cl)cccc2Cl)n1 ZINC000564274006 341062881 /nfs/dbraw/zinc/06/28/81/341062881.db2.gz FCJZUJVHFGDBGF-UHFFFAOYSA-N 1 2 315.269 4.692 20 0 DJADLO C[C@@H]([NH2+]Cc1ccc(Sc2ccccc2)cc1)c1ccon1 ZINC000544617341 341089460 /nfs/dbraw/zinc/08/94/60/341089460.db2.gz NCFJUODXBZVLFF-CQSZACIVSA-N 1 2 310.422 4.677 20 0 DJADLO Cc1ccc(C[N@@H+](C)[C@@H](C)c2nc3ccccc3n2C(F)F)o1 ZINC000073605886 341118950 /nfs/dbraw/zinc/11/89/50/341118950.db2.gz FLLOXXWJUNJTDY-LBPRGKRZSA-N 1 2 319.355 4.526 20 0 DJADLO Cc1ccc(C[N@H+](C)[C@@H](C)c2nc3ccccc3n2C(F)F)o1 ZINC000073605886 341118951 /nfs/dbraw/zinc/11/89/51/341118951.db2.gz FLLOXXWJUNJTDY-LBPRGKRZSA-N 1 2 319.355 4.526 20 0 DJADLO CC(C)c1nc([C@H](C)[NH2+][C@@H]2COc3ccc(Cl)cc32)cs1 ZINC000545279226 341118979 /nfs/dbraw/zinc/11/89/79/341118979.db2.gz OFGZWODJNVWXFN-GXFFZTMASA-N 1 2 322.861 4.704 20 0 DJADLO CC(C)c1nc([C@@H](C)[NH2+][C@@H]2COc3ccc(Cl)cc32)cs1 ZINC000545279228 341119079 /nfs/dbraw/zinc/11/90/79/341119079.db2.gz OFGZWODJNVWXFN-ZWNOBZJWSA-N 1 2 322.861 4.704 20 0 DJADLO CC(C)c1ccc([C@H](C)[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)cc1 ZINC000073984264 341124557 /nfs/dbraw/zinc/12/45/57/341124557.db2.gz CZTFHEQTDBNRRV-KBPBESRZSA-N 1 2 315.461 4.902 20 0 DJADLO CC(C)(C)[C@H]([NH2+]CC1CCC(C(F)(F)F)CC1)C(F)(F)F ZINC000546028797 341151925 /nfs/dbraw/zinc/15/19/25/341151925.db2.gz MROXBACAKWXYIG-ILDUYXDCSA-N 1 2 319.333 4.922 20 0 DJADLO CC(C)=CCSc1ccccc1C(=O)Nc1cc[nH+]cc1C ZINC000133142268 341157342 /nfs/dbraw/zinc/15/73/42/341157342.db2.gz CNALWLRDTFRKCO-UHFFFAOYSA-N 1 2 312.438 4.701 20 0 DJADLO CC[C@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1ccc(F)cc1F ZINC000133539478 341177775 /nfs/dbraw/zinc/17/77/75/341177775.db2.gz FJGBBKBIKZIRAE-AWEZNQCLSA-N 1 2 324.440 4.960 20 0 DJADLO CCOc1ccccc1[C@@H](C)[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000133574818 341178654 /nfs/dbraw/zinc/17/86/54/341178654.db2.gz NUIAYPJUPITPAN-CYBMUJFWSA-N 1 2 318.486 4.690 20 0 DJADLO CCOc1ccccc1[C@H](C)[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000133575027 341178809 /nfs/dbraw/zinc/17/88/09/341178809.db2.gz NUIAYPJUPITPAN-ZDUSSCGKSA-N 1 2 318.486 4.690 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1nc2c(s1)CCC2)c1ccc(F)cc1Cl ZINC000134978874 341227753 /nfs/dbraw/zinc/22/77/53/341227753.db2.gz XQNKYEOHQUBQJP-ZJUUUORDSA-N 1 2 324.852 4.836 20 0 DJADLO CC[C@@H]([NH2+]Cc1ccc(-c2ccc(F)cc2)o1)c1nccs1 ZINC000078004160 341233640 /nfs/dbraw/zinc/23/36/40/341233640.db2.gz DMEQFWBJNSDBEW-OAHLLOKOSA-N 1 2 316.401 4.783 20 0 DJADLO Fc1cc(F)c(C[NH2+][C@@H](c2ccco2)c2ccccc2)cc1F ZINC000135830143 341246650 /nfs/dbraw/zinc/24/66/50/341246650.db2.gz SPUIIKVELWUSEM-GOSISDBHSA-N 1 2 317.310 4.576 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1ccco1)c1ccccc1)c1cc(F)ccc1F ZINC000078968712 341250874 /nfs/dbraw/zinc/25/08/74/341250874.db2.gz YSHLFBIDNVJUIG-BFUOFWGJSA-N 1 2 313.347 4.998 20 0 DJADLO C[C@@H]([NH2+][C@H](c1ccco1)c1ccccc1)c1c(F)cccc1F ZINC000078991473 341251523 /nfs/dbraw/zinc/25/15/23/341251523.db2.gz WMVGVMSXTGEPLG-YJYMSZOUSA-N 1 2 313.347 4.998 20 0 DJADLO CCc1cc(C)c(C(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)o1 ZINC000136378597 341257803 /nfs/dbraw/zinc/25/78/03/341257803.db2.gz OYVUEKOPYBOZAV-UHFFFAOYSA-N 1 2 322.364 4.590 20 0 DJADLO CC(C)c1nc(C[NH2+][C@H](C)c2cc3ccccc3o2)cs1 ZINC000079914894 341267521 /nfs/dbraw/zinc/26/75/21/341267521.db2.gz GXIIAYPNFMMWFX-GFCCVEGCSA-N 1 2 300.427 4.864 20 0 DJADLO CCCC(C)(C)[N@H+](Cc1cccs1)Cc1noc(C(C)C)n1 ZINC000549080330 341285686 /nfs/dbraw/zinc/28/56/86/341285686.db2.gz WRJGQSHAXHGEDP-UHFFFAOYSA-N 1 2 321.490 4.835 20 0 DJADLO CCCC(C)(C)[N@@H+](Cc1cccs1)Cc1noc(C(C)C)n1 ZINC000549080330 341285687 /nfs/dbraw/zinc/28/56/87/341285687.db2.gz WRJGQSHAXHGEDP-UHFFFAOYSA-N 1 2 321.490 4.835 20 0 DJADLO C[C@@H]1C[N@H+](Cc2ncc(-c3cccs3)o2)[C@H]1c1ccccc1 ZINC000245434126 341293576 /nfs/dbraw/zinc/29/35/76/341293576.db2.gz PQEPDHUFQNXNEB-FZKQIMNGSA-N 1 2 310.422 4.596 20 0 DJADLO C[C@@H]1C[N@@H+](Cc2ncc(-c3cccs3)o2)[C@H]1c1ccccc1 ZINC000245434126 341293577 /nfs/dbraw/zinc/29/35/77/341293577.db2.gz PQEPDHUFQNXNEB-FZKQIMNGSA-N 1 2 310.422 4.596 20 0 DJADLO C[C@H]1C[N@H+](Cc2ncc(-c3cccs3)o2)[C@H]1c1ccccc1 ZINC000245434127 341293656 /nfs/dbraw/zinc/29/36/56/341293656.db2.gz PQEPDHUFQNXNEB-SCLBCKFNSA-N 1 2 310.422 4.596 20 0 DJADLO C[C@H]1C[N@@H+](Cc2ncc(-c3cccs3)o2)[C@H]1c1ccccc1 ZINC000245434127 341293657 /nfs/dbraw/zinc/29/36/57/341293657.db2.gz PQEPDHUFQNXNEB-SCLBCKFNSA-N 1 2 310.422 4.596 20 0 DJADLO Clc1cccc(C[N@H+](Cc2cccnc2)C2CC2)c1Cl ZINC000549792060 341303161 /nfs/dbraw/zinc/30/31/61/341303161.db2.gz VYTVLOPKWDPKMD-UHFFFAOYSA-N 1 2 307.224 4.553 20 0 DJADLO Clc1cccc(C[N@@H+](Cc2cccnc2)C2CC2)c1Cl ZINC000549792060 341303162 /nfs/dbraw/zinc/30/31/62/341303162.db2.gz VYTVLOPKWDPKMD-UHFFFAOYSA-N 1 2 307.224 4.553 20 0 DJADLO COc1cc(C)[nH+]c(CSc2ncc(C(C)C)n2C(C)C)c1 ZINC000550430441 341316795 /nfs/dbraw/zinc/31/67/95/341316795.db2.gz AEIBVZDTVSIIMB-UHFFFAOYSA-N 1 2 319.474 4.592 20 0 DJADLO C[C@H](Nc1ccc2nc(C3CC3)oc2c1)c1cn2ccccc2[nH+]1 ZINC000550919212 341326701 /nfs/dbraw/zinc/32/67/01/341326701.db2.gz HFBZPZYSFMULSN-LBPRGKRZSA-N 1 2 318.380 4.526 20 0 DJADLO FC(F)(F)CC1CC[NH+](Cc2ncc(-c3ccccc3)o2)CC1 ZINC000551407495 341340889 /nfs/dbraw/zinc/34/08/89/341340889.db2.gz WKIHGYPZJBWYOM-UHFFFAOYSA-N 1 2 324.346 4.506 20 0 DJADLO Cc1ccnc([C@H](C)[NH2+][C@H](C)c2nc(C(C)(C)C)cs2)c1 ZINC000552046488 341364802 /nfs/dbraw/zinc/36/48/02/341364802.db2.gz IZBMEOXNAJORCA-QWHCGFSZSA-N 1 2 303.475 4.556 20 0 DJADLO Cc1cccc(C[N@H+](C)Cc2cnc(C3CCCCC3)s2)n1 ZINC000552071502 341367503 /nfs/dbraw/zinc/36/75/03/341367503.db2.gz KEHIOJFMXGMEMP-UHFFFAOYSA-N 1 2 315.486 4.526 20 0 DJADLO Cc1cccc(C[N@@H+](C)Cc2cnc(C3CCCCC3)s2)n1 ZINC000552071502 341367504 /nfs/dbraw/zinc/36/75/04/341367504.db2.gz KEHIOJFMXGMEMP-UHFFFAOYSA-N 1 2 315.486 4.526 20 0 DJADLO CCc1nc(C[NH2+]C2(c3ccc(F)cc3F)CCCC2)cs1 ZINC000089801720 341408987 /nfs/dbraw/zinc/40/89/87/341408987.db2.gz RKMSQBLSYXWRDU-UHFFFAOYSA-N 1 2 322.424 4.543 20 0 DJADLO Cc1csc(C[NH2+][C@@H](c2cccs2)c2ccc(F)cc2)n1 ZINC000553214473 341420241 /nfs/dbraw/zinc/42/02/41/341420241.db2.gz RMJFFKLBQOACOQ-MRXNPFEDSA-N 1 2 318.442 4.531 20 0 DJADLO CC1=CC[C@@H](Nc2cccc3c2CN(c2cccc[nH+]2)C3)CC1 ZINC000556254032 341499482 /nfs/dbraw/zinc/49/94/82/341499482.db2.gz KZCIGGOHFOLJPZ-QGZVFWFLSA-N 1 2 305.425 4.513 20 0 DJADLO COC[C@H]([NH2+][C@H](C)c1ccc(Cl)cc1Cl)c1ccco1 ZINC000156639475 341624243 /nfs/dbraw/zinc/62/42/43/341624243.db2.gz AXXSJWGKOAIAPI-YGRLFVJLSA-N 1 2 314.212 4.625 20 0 DJADLO Clc1sccc1C[NH2+]Cc1c(Cl)cccc1Cl ZINC000312739517 341628238 /nfs/dbraw/zinc/62/82/38/341628238.db2.gz ADQZKOGNNVBGLY-UHFFFAOYSA-N 1 2 306.645 4.998 20 0 DJADLO CCC(C)(C)OCc1cccc(NCc2[nH]c(C)c(C)[nH+]2)c1C ZINC000577125788 341888324 /nfs/dbraw/zinc/88/83/24/341888324.db2.gz YANKMOJFJMFKGL-UHFFFAOYSA-N 1 2 315.461 4.652 20 0 DJADLO CC(C)OCc1ccc(N[C@H](c2[nH]cc[nH+]2)c2ccccc2)cc1 ZINC000128600347 519775886 /nfs/dbraw/zinc/77/58/86/519775886.db2.gz VTMFFSQGXCMEGD-IBGZPJMESA-N 1 2 321.424 4.536 20 0 DJADLO CCCc1nc(C[NH2+][C@@H](C)c2cc3ccccc3o2)cs1 ZINC000182628083 521514030 /nfs/dbraw/zinc/51/40/30/521514030.db2.gz RGPNGWZRSMKBLA-LBPRGKRZSA-N 1 2 300.427 4.693 20 0 DJADLO CCc1cnc(C[NH2+][C@H](C)c2cc(Cl)sc2Cl)s1 ZINC000130510372 522038232 /nfs/dbraw/zinc/03/82/32/522038232.db2.gz AYJNIWFBEJKZAY-SSDOTTSWSA-N 1 2 321.298 4.925 20 0 DJADLO CCc1nc([C@@H](C)[NH2+][C@@H]2CCSc3ccc(F)cc32)cs1 ZINC000162270225 522423503 /nfs/dbraw/zinc/42/35/03/522423503.db2.gz CYRSFHCZCSJWEU-ZWNOBZJWSA-N 1 2 322.474 4.732 20 0 DJADLO CCc1nc([C@H](C)[NH2+][C@@H]2CCSc3ccc(F)cc32)cs1 ZINC000162270350 522453640 /nfs/dbraw/zinc/45/36/40/522453640.db2.gz CYRSFHCZCSJWEU-GXFFZTMASA-N 1 2 322.474 4.732 20 0 DJADLO CC[C@@H]([NH2+][C@@H](C)c1nc2ccccc2o1)c1cc(F)ccc1F ZINC000181230212 522916925 /nfs/dbraw/zinc/91/69/25/522916925.db2.gz IEZKIGSEEPUBGE-XHDPSFHLSA-N 1 2 316.351 4.908 20 0 DJADLO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1cc(-c2ccccc2)on1 ZINC000161551644 523853447 /nfs/dbraw/zinc/85/34/47/523853447.db2.gz PMPGXXSYQDUMTJ-OAHLLOKOSA-N 1 2 322.408 4.509 20 0 DJADLO CCc1ccc([C@H](C)[NH2+][C@H](c2ccccc2)c2ccccn2)o1 ZINC000154657838 524047540 /nfs/dbraw/zinc/04/75/40/524047540.db2.gz KJZKGRZZZUBTQN-MGPUTAFESA-N 1 2 306.409 4.677 20 0 DJADLO COc1ccc(F)cc1[C@H](C)[NH2+][C@H](C)c1csc(C(C)C)n1 ZINC000181019480 524333676 /nfs/dbraw/zinc/33/36/76/524333676.db2.gz BRWZCZPTYRXOFM-NWDGAFQWSA-N 1 2 322.449 4.826 20 0 DJADLO C[C@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1cc(F)cc(F)c1 ZINC000154631220 525545832 /nfs/dbraw/zinc/54/58/32/525545832.db2.gz XRMKPBUURSHEHO-XOBRGWDASA-N 1 2 324.374 4.800 20 0 DJADLO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2noc(-c3ccccc3)n2)s1 ZINC000124252124 525746234 /nfs/dbraw/zinc/74/62/34/525746234.db2.gz ITNXOFSCTSYHNM-CHWSQXEVSA-N 1 2 313.426 4.518 20 0 DJADLO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2noc(-c3ccccc3)n2)s1 ZINC000124251838 525938124 /nfs/dbraw/zinc/93/81/24/525938124.db2.gz ITNXOFSCTSYHNM-STQMWFEESA-N 1 2 313.426 4.518 20 0 DJADLO Cc1c[nH]c(-c2ccccc2NC(=O)C[C@H](C)c2ccccc2)[nH+]1 ZINC000366354209 525963023 /nfs/dbraw/zinc/96/30/23/525963023.db2.gz GNNQLBXVWDIPIR-AWEZNQCLSA-N 1 2 319.408 4.517 20 0 DJADLO Cc1csc(C2([NH2+][C@H](C)c3ccccc3Cl)CCC2)n1 ZINC000264839139 526328395 /nfs/dbraw/zinc/32/83/95/526328395.db2.gz GKFFPIDNZVGRGQ-GFCCVEGCSA-N 1 2 306.862 4.835 20 0 DJADLO Clc1ccsc1C[NH2+][C@@H](c1ccccc1)c1ccccn1 ZINC000365943337 526995041 /nfs/dbraw/zinc/99/50/41/526995041.db2.gz AVZAUQFDLWBZKY-KRWDZBQOSA-N 1 2 314.841 4.676 20 0 DJADLO FC(F)(F)c1csc(C[N@@H+]2CCC[C@@H]2c2cccs2)n1 ZINC000130552819 527690131 /nfs/dbraw/zinc/69/01/31/527690131.db2.gz LUEOEVHWLQSNSU-SECBINFHSA-N 1 2 318.389 4.561 20 0 DJADLO FC(F)(F)c1csc(C[N@H+]2CCC[C@@H]2c2cccs2)n1 ZINC000130552819 527690132 /nfs/dbraw/zinc/69/01/32/527690132.db2.gz LUEOEVHWLQSNSU-SECBINFHSA-N 1 2 318.389 4.561 20 0 DJADLO CCCCCC[C@@H](C)C(=O)N1CCCC[C@@H]1c1[nH+]ccn1CC ZINC000366606175 534999289 /nfs/dbraw/zinc/99/92/89/534999289.db2.gz FUGHMMUAMNIZKO-IAGOWNOFSA-N 1 2 319.493 4.563 20 0 DJADLO CC[N@H+](Cc1nccn1C(F)F)[C@@H](C)c1cc2ccccc2o1 ZINC000299206374 535392383 /nfs/dbraw/zinc/39/23/83/535392383.db2.gz RCRFICFVFZGHFR-LBPRGKRZSA-N 1 2 319.355 4.608 20 0 DJADLO CC[N@@H+](Cc1nccn1C(F)F)[C@@H](C)c1cc2ccccc2o1 ZINC000299206374 535392388 /nfs/dbraw/zinc/39/23/88/535392388.db2.gz RCRFICFVFZGHFR-LBPRGKRZSA-N 1 2 319.355 4.608 20 0 DJADLO CC[N@H+](Cc1nccn1C(F)F)[C@H](C)c1cc2ccccc2o1 ZINC000299206372 535393381 /nfs/dbraw/zinc/39/33/81/535393381.db2.gz RCRFICFVFZGHFR-GFCCVEGCSA-N 1 2 319.355 4.608 20 0 DJADLO CC[N@@H+](Cc1nccn1C(F)F)[C@H](C)c1cc2ccccc2o1 ZINC000299206372 535393382 /nfs/dbraw/zinc/39/33/82/535393382.db2.gz RCRFICFVFZGHFR-GFCCVEGCSA-N 1 2 319.355 4.608 20 0 DJADLO CCn1cc[nH+]c1[C@@H](C)Nc1ccc2nc(C3CC3)sc2c1 ZINC000296607976 536117331 /nfs/dbraw/zinc/11/73/31/536117331.db2.gz YEOBVXGOIHCOKB-LLVKDONJSA-N 1 2 312.442 4.563 20 0 DJADLO COc1ccccc1[C@H](CC(C)C)[NH2+]Cc1csc(Cl)n1 ZINC000294883955 537107920 /nfs/dbraw/zinc/10/79/20/537107920.db2.gz CGHVDOCNIAUZRO-AWEZNQCLSA-N 1 2 324.877 4.682 20 0 DJADLO c1ccc(C[C@H](Nc2cc[nH+]c(C3CC3)n2)c2ccccc2)cc1 ZINC000170624591 563908835 /nfs/dbraw/zinc/90/88/35/563908835.db2.gz LIVHRFUHDQDSON-IBGZPJMESA-N 1 2 315.420 4.750 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1Cl)c1nccs1 ZINC000080266468 192018896 /nfs/dbraw/zinc/01/88/96/192018896.db2.gz SNPALJDCTMNOPT-DTWKUNHWSA-N 1 2 301.242 4.862 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1cc(Cl)ccc1Cl)c1nccs1 ZINC000080266459 192019313 /nfs/dbraw/zinc/01/93/13/192019313.db2.gz QHFULOKPYVRMLD-RKDXNWHRSA-N 1 2 301.242 4.862 20 0 DJADLO C[C@H]([NH2+]Cc1nccs1)c1ccc(Cl)c(Cl)c1Cl ZINC000041012703 183156435 /nfs/dbraw/zinc/15/64/35/183156435.db2.gz KGNCKBYQBBYHCD-ZETCQYMHSA-N 1 2 321.660 4.954 20 0 DJADLO C[C@@H]([NH2+]Cc1nccs1)c1ccc(Cl)c(Cl)c1Cl ZINC000041012705 183156699 /nfs/dbraw/zinc/15/66/99/183156699.db2.gz KGNCKBYQBBYHCD-SSDOTTSWSA-N 1 2 321.660 4.954 20 0 DJADLO CC[C@H]([NH2+][C@@H](C)c1nnc(C(C)C)[nH]1)c1cccc(Cl)c1F ZINC000274092062 130205974 /nfs/dbraw/zinc/20/59/74/130205974.db2.gz UFAJPMJVJMRYQN-GWCFXTLKSA-N 1 2 324.831 4.523 20 0 DJADLO Cc1nnc([C@H](C)[NH2+][C@H](C)c2ccc(SC(C)C)cc2)s1 ZINC000274133953 130209605 /nfs/dbraw/zinc/20/96/05/130209605.db2.gz CFGPJLVZMAVRLZ-NEPJUHHUSA-N 1 2 321.515 4.759 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1nc(C(F)(F)F)cs1)c1ccccc1F ZINC000274586923 130246871 /nfs/dbraw/zinc/24/68/71/130246871.db2.gz JKOUZBKTOXGMNA-BDAKNGLRSA-N 1 2 318.339 4.713 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1ccccc1F)c1nc(C(F)(F)F)cs1 ZINC000274586940 130247829 /nfs/dbraw/zinc/24/78/29/130247829.db2.gz JKOUZBKTOXGMNA-IUCAKERBSA-N 1 2 318.339 4.713 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1cc(Cl)ccc1Cl)c1cscn1 ZINC000275145611 130296067 /nfs/dbraw/zinc/29/60/67/130296067.db2.gz UHDYRZUEGRWQTI-IUCAKERBSA-N 1 2 301.242 4.862 20 0 DJADLO Cc1cc([C@@H](C)[NH2+]C2(c3ccc(Cl)c(Cl)c3)CC2)no1 ZINC000285310365 131156723 /nfs/dbraw/zinc/15/67/23/131156723.db2.gz SMZIQVQHAMEEHQ-SNVBAGLBSA-N 1 2 311.212 4.630 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1ccc(F)c(Cl)c1)c1c(F)cncc1F ZINC000285738090 131198043 /nfs/dbraw/zinc/19/80/43/131198043.db2.gz QFQJPRQZOXAVEO-DTWKUNHWSA-N 1 2 314.738 4.564 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N1C[C@H](C)CC[C@@H]1c1ccccc1 ZINC000286964006 131258311 /nfs/dbraw/zinc/25/83/11/131258311.db2.gz AYBNYUPXWJPJOD-RDTXWAMCSA-N 1 2 323.440 4.704 20 0 DJADLO CCCC[C@@H](CC)CC(=O)N1CCCC[C@H]1c1[nH+]ccn1CC ZINC000366646709 131266959 /nfs/dbraw/zinc/26/69/59/131266959.db2.gz HTMLJJOISLMBND-SJORKVTESA-N 1 2 319.493 4.563 20 0 DJADLO Cc1ccc(CN(C(=O)Nc2c(C)cc[nH+]c2C)C(C)C)s1 ZINC000287531874 131284845 /nfs/dbraw/zinc/28/48/45/131284845.db2.gz NMQZTPFVENLSAT-UHFFFAOYSA-N 1 2 317.458 4.511 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1c(Cl)cccc1Cl)C1CC1)c1cnccn1 ZINC000289366535 131378913 /nfs/dbraw/zinc/37/89/13/131378913.db2.gz AHYYVTVPKJEASZ-QLJPJBMISA-N 1 2 322.239 4.585 20 0 DJADLO Cc1nc([C@@H](C)[NH2+][C@@H](C)c2ccc(Oc3ccccc3)cc2)no1 ZINC000289372570 131379917 /nfs/dbraw/zinc/37/99/17/131379917.db2.gz OPZMMPOZLHLXQH-UONOGXRCSA-N 1 2 323.396 4.582 20 0 DJADLO C[C@H]([NH2+][C@H]1C[C@@H](C)n2ccnc21)c1cccc(Cl)c1Cl ZINC000297490340 132018982 /nfs/dbraw/zinc/01/89/82/132018982.db2.gz BIINRWXFOQPHFP-NRUUGDAUSA-N 1 2 310.228 4.547 20 0 DJADLO Cc1nc(C[NH+](Cc2ccccc2)Cc2ccccc2)cs1 ZINC000340664079 132123001 /nfs/dbraw/zinc/12/30/01/132123001.db2.gz ZBUIHKHWIUKJKB-UHFFFAOYSA-N 1 2 308.450 4.654 20 0 DJADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CC[C@@](F)(c2ccccc2)C1 ZINC000563861673 335068705 /nfs/dbraw/zinc/06/87/05/335068705.db2.gz PCOSRDTVEYPXMB-KUHUBIRLSA-N 1 2 316.420 4.604 20 0 DJADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1CC[C@@](F)(c2ccccc2)C1 ZINC000563861673 335068706 /nfs/dbraw/zinc/06/87/06/335068706.db2.gz PCOSRDTVEYPXMB-KUHUBIRLSA-N 1 2 316.420 4.604 20 0 DJADLO C[C@@H]([NH2+]Cc1coc(-c2cccs2)n1)c1ccccc1Cl ZINC000007499487 331599248 /nfs/dbraw/zinc/59/92/48/331599248.db2.gz XBJPOCBTCHIFLV-LLVKDONJSA-N 1 2 318.829 4.907 20 0 DJADLO CC(C)n1cc[nH+]c1CNc1ccc(Cl)c(C(F)(F)F)c1 ZINC000123650527 331637199 /nfs/dbraw/zinc/63/71/99/331637199.db2.gz KWAPHJZNJKRPNW-UHFFFAOYSA-N 1 2 317.742 4.748 20 0 DJADLO Cc1csc([C@H](C)[NH2+]Cc2cc(Cl)sc2Cl)n1 ZINC000312555594 331643094 /nfs/dbraw/zinc/64/30/94/331643094.db2.gz HJBZOEUVYCDQJL-ZETCQYMHSA-N 1 2 307.271 4.671 20 0 DJADLO Cc1cc([C@@H](C)[NH2+][C@@H](c2ccccc2)c2cccc(F)c2)no1 ZINC000558499423 331913706 /nfs/dbraw/zinc/91/37/06/331913706.db2.gz YWXKFUBRDPCYQJ-KUHUBIRLSA-N 1 2 310.372 4.562 20 0 DJADLO Cc1cc2cc([C@H](C)[NH2+]Cc3ccn(C(C)C)n3)oc2cc1C ZINC000558828386 331947599 /nfs/dbraw/zinc/94/75/99/331947599.db2.gz AZVPMXGLERISAF-HNNXBMFYSA-N 1 2 311.429 4.678 20 0 DJADLO Clc1scc(C[N@@H+]2CCC[C@H]2c2ccccn2)c1Cl ZINC000569538997 332130507 /nfs/dbraw/zinc/13/05/07/332130507.db2.gz VIZRBSFOIFOGGF-LBPRGKRZSA-N 1 2 313.253 4.787 20 0 DJADLO Clc1scc(C[N@H+]2CCC[C@H]2c2ccccn2)c1Cl ZINC000569538997 332130508 /nfs/dbraw/zinc/13/05/08/332130508.db2.gz VIZRBSFOIFOGGF-LBPRGKRZSA-N 1 2 313.253 4.787 20 0 DJADLO C[C@H]([NH2+]Cc1csc(C(C)(C)C)n1)c1c(F)cccc1F ZINC000132961607 332135192 /nfs/dbraw/zinc/13/51/92/332135192.db2.gz KEAYJSMFMJDXSQ-JTQLQIEISA-N 1 2 310.413 4.570 20 0 DJADLO Cc1csc([C@@H](C)[NH2+]Cc2c(Cl)oc3ccccc32)n1 ZINC000133185128 332138265 /nfs/dbraw/zinc/13/82/65/332138265.db2.gz SLAPSQXOWBQZMJ-SNVBAGLBSA-N 1 2 306.818 4.702 20 0 DJADLO CCCc1csc(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)n1 ZINC000426059557 335094737 /nfs/dbraw/zinc/09/47/37/335094737.db2.gz OYWPEHJDXKBKDP-INIZCTEOSA-N 1 2 304.434 4.572 20 0 DJADLO CCCc1csc(C[N@H+]2CCC[C@H]2c2cccc(F)c2)n1 ZINC000426059557 335094738 /nfs/dbraw/zinc/09/47/38/335094738.db2.gz OYWPEHJDXKBKDP-INIZCTEOSA-N 1 2 304.434 4.572 20 0 DJADLO C[C@@H]1C[C@H](C(F)(F)F)CC[N@@H+]1Cc1csc(C(C)(C)C)n1 ZINC000449463305 332234775 /nfs/dbraw/zinc/23/47/75/332234775.db2.gz VVUDJWOHDLMTII-GHMZBOCLSA-N 1 2 320.424 4.603 20 0 DJADLO C[C@@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1csc(C(C)(C)C)n1 ZINC000449463305 332234778 /nfs/dbraw/zinc/23/47/78/332234778.db2.gz VVUDJWOHDLMTII-GHMZBOCLSA-N 1 2 320.424 4.603 20 0 DJADLO C[C@@H](SCCn1cc[nH+]c1)c1cc(Cl)ccc1Cl ZINC000536373182 332234798 /nfs/dbraw/zinc/23/47/98/332234798.db2.gz ARQUROOMBAAQNC-SNVBAGLBSA-N 1 2 301.242 4.684 20 0 DJADLO Cc1nc(C[NH2+][C@H](C)c2csc(Cl)c2)nc2ccccc12 ZINC000526049361 332371117 /nfs/dbraw/zinc/37/11/17/332371117.db2.gz WKDNIGZDEXJMHX-SNVBAGLBSA-N 1 2 317.845 4.504 20 0 DJADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)C(C1CCC1)C1CCC1 ZINC000560695469 332379195 /nfs/dbraw/zinc/37/91/95/332379195.db2.gz CDUMHNMMPPNTDE-UHFFFAOYSA-N 1 2 323.440 4.540 20 0 DJADLO CCCc1nc(C)c(C[NH2+][C@H](C)c2c(F)cccc2Cl)o1 ZINC000428347691 332513024 /nfs/dbraw/zinc/51/30/24/332513024.db2.gz NWUPKZLTRGZHFC-LLVKDONJSA-N 1 2 310.800 4.579 20 0 DJADLO COCc1ccc([C@H]2CCCN2c2[nH+]ccc3ccc(C)cc32)o1 ZINC000569805959 332681559 /nfs/dbraw/zinc/68/15/59/332681559.db2.gz ANAUJJZLCJIJHS-GOSISDBHSA-N 1 2 322.408 4.624 20 0 DJADLO CC(C)c1cccc(C(C)C)c1NC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000569813788 332682032 /nfs/dbraw/zinc/68/20/32/332682032.db2.gz MMUCJLWJCLGZQI-OAHLLOKOSA-N 1 2 313.445 4.720 20 0 DJADLO Cc1ccc(NC(=O)N2CCCCC[C@@H]2c2ccccc2)c(C)[nH+]1 ZINC000176709505 332953323 /nfs/dbraw/zinc/95/33/23/332953323.db2.gz MIMXOXLORMJLGB-LJQANCHMSA-N 1 2 323.440 4.848 20 0 DJADLO Fc1cccc(C[NH2+]Cc2cc(Cl)sc2Cl)c1F ZINC000312755435 333000658 /nfs/dbraw/zinc/00/06/58/333000658.db2.gz BVCBKYDGJXOPDT-UHFFFAOYSA-N 1 2 308.180 4.623 20 0 DJADLO COc1cccc(Cl)c1C[NH2+][C@@H](C)c1csc(C(C)C)n1 ZINC000188463210 333046793 /nfs/dbraw/zinc/04/67/93/333046793.db2.gz IFSLXKKHDORVCJ-NSHDSACASA-N 1 2 324.877 4.779 20 0 DJADLO CCc1cnc(C[N@@H+]2CCCC[C@@H]2c2cccc(Cl)c2)o1 ZINC000580278403 333053587 /nfs/dbraw/zinc/05/35/87/333053587.db2.gz DFSSTMZASQIGCP-MRXNPFEDSA-N 1 2 304.821 4.618 20 0 DJADLO CCc1cnc(C[N@H+]2CCCC[C@@H]2c2cccc(Cl)c2)o1 ZINC000580278403 333053588 /nfs/dbraw/zinc/05/35/88/333053588.db2.gz DFSSTMZASQIGCP-MRXNPFEDSA-N 1 2 304.821 4.618 20 0 DJADLO CC(C)c1nc([C@H](C)[NH2+]Cc2c(F)cccc2Cl)cs1 ZINC000460360759 333071404 /nfs/dbraw/zinc/07/14/04/333071404.db2.gz SFBOFAUGCKUSPR-JTQLQIEISA-N 1 2 312.841 4.910 20 0 DJADLO C[C@H]1C[C@H](Nc2cc(Cl)cc(C(F)(F)F)c2)c2[nH+]ccn21 ZINC000379034919 333097039 /nfs/dbraw/zinc/09/70/39/333097039.db2.gz YUYZZKJVSBTQKR-UFBFGSQYSA-N 1 2 315.726 4.673 20 0 DJADLO CC(C)[C@H](C)C(=O)Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000498084419 335124705 /nfs/dbraw/zinc/12/47/05/335124705.db2.gz HMYIWCALOMGABS-LBPRGKRZSA-N 1 2 318.804 4.758 20 0 DJADLO CC(C)[C@@H](C)C(=O)Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000498084418 335124861 /nfs/dbraw/zinc/12/48/61/335124861.db2.gz HMYIWCALOMGABS-GFCCVEGCSA-N 1 2 318.804 4.758 20 0 DJADLO C[C@@H]1C[C@@H](Nc2cccc(Oc3ccccc3)c2)c2[nH+]ccn21 ZINC000379073686 333182021 /nfs/dbraw/zinc/18/20/21/333182021.db2.gz BUTBAZUSXAVFDF-RDTXWAMCSA-N 1 2 305.381 4.793 20 0 DJADLO CC[C@H](C)Sc1ccc(N[C@@H](C)c2[nH+]ccn2C)c(C)c1 ZINC000183009981 333182178 /nfs/dbraw/zinc/18/21/78/333182178.db2.gz YHNBRKGDVSCQOT-KBPBESRZSA-N 1 2 303.475 4.792 20 0 DJADLO Cc1c(C(=O)Nc2c(C)cc[nH+]c2C)oc2c1c(C)ccc2C ZINC000425591193 335123653 /nfs/dbraw/zinc/12/36/53/335123653.db2.gz YGTCPXGYPXYQOL-UHFFFAOYSA-N 1 2 308.381 4.622 20 0 DJADLO C[C@@H](c1ccc(F)c(Cl)c1)[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000497590090 333266241 /nfs/dbraw/zinc/26/62/41/333266241.db2.gz AABFTXYIFCXJNA-SCLBCKFNSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@@H](c1ccc(F)c(Cl)c1)[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000497590090 333266242 /nfs/dbraw/zinc/26/62/42/333266242.db2.gz AABFTXYIFCXJNA-SCLBCKFNSA-N 1 2 319.807 4.614 20 0 DJADLO Cc1nc(C[N@@H+](C)[C@H](c2ccccc2Cl)C(C)C)cs1 ZINC000525785669 333311741 /nfs/dbraw/zinc/31/17/41/333311741.db2.gz DKDGEUNKCPKKGY-INIZCTEOSA-N 1 2 308.878 4.934 20 0 DJADLO Cc1nc(C[N@H+](C)[C@H](c2ccccc2Cl)C(C)C)cs1 ZINC000525785669 333311743 /nfs/dbraw/zinc/31/17/43/333311743.db2.gz DKDGEUNKCPKKGY-INIZCTEOSA-N 1 2 308.878 4.934 20 0 DJADLO CCCCc1nc(C[N@H+](C)Cc2cccc(Cl)c2)cs1 ZINC000497995182 333318753 /nfs/dbraw/zinc/31/87/53/333318753.db2.gz DWVYHQSVHFLPDO-UHFFFAOYSA-N 1 2 308.878 4.771 20 0 DJADLO CCCCc1nc(C[N@@H+](C)Cc2cccc(Cl)c2)cs1 ZINC000497995182 333318755 /nfs/dbraw/zinc/31/87/55/333318755.db2.gz DWVYHQSVHFLPDO-UHFFFAOYSA-N 1 2 308.878 4.771 20 0 DJADLO Cc1cc(F)ccc1C[N@@H+](C)[C@@H](C)c1ncc(C(C)(C)C)o1 ZINC000487983811 333334812 /nfs/dbraw/zinc/33/48/12/333334812.db2.gz XBIXFDRHTAUVIA-ZDUSSCGKSA-N 1 2 304.409 4.613 20 0 DJADLO Cc1cc(F)ccc1C[N@H+](C)[C@@H](C)c1ncc(C(C)(C)C)o1 ZINC000487983811 333334814 /nfs/dbraw/zinc/33/48/14/333334814.db2.gz XBIXFDRHTAUVIA-ZDUSSCGKSA-N 1 2 304.409 4.613 20 0 DJADLO c1sc(C[NH2+][C@H]2CSc3ccccc32)nc1-c1ccccc1 ZINC000522756120 333385521 /nfs/dbraw/zinc/38/55/21/333385521.db2.gz JYVHMHSDADDIDR-INIZCTEOSA-N 1 2 324.474 4.747 20 0 DJADLO CCCOc1cc(C)ccc1[NH2+][C@H]1CCCC12CCOCC2 ZINC000319809240 333409434 /nfs/dbraw/zinc/40/94/34/333409434.db2.gz HEEOALHHCRFWAP-SFHVURJKSA-N 1 2 303.446 4.545 20 0 DJADLO Cc1ccc(C)c(CSCc2[nH+]ccn2Cc2ccccc2)c1 ZINC000525821856 333421402 /nfs/dbraw/zinc/42/14/02/333421402.db2.gz IHEXTQIZPGNNCJ-UHFFFAOYSA-N 1 2 322.477 4.982 20 0 DJADLO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2cccc(Cl)c2Cl)s1 ZINC000274262765 333485887 /nfs/dbraw/zinc/48/58/87/333485887.db2.gz VDPYUJPANUPRKC-HTQZYQBOSA-N 1 2 316.257 4.565 20 0 DJADLO CCc1nc(C)c(C[NH2+][C@H](C)c2cc(Cl)sc2Cl)o1 ZINC000291895082 333816225 /nfs/dbraw/zinc/81/62/25/333816225.db2.gz KYTYLVMEUOCXEP-SSDOTTSWSA-N 1 2 319.257 4.765 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1csnn1)c1ccc(-c2cccs2)cc1 ZINC000414293653 333934974 /nfs/dbraw/zinc/93/49/74/333934974.db2.gz DEFDGYWLLSPAEF-NEPJUHHUSA-N 1 2 315.467 4.678 20 0 DJADLO CC[C@@H]([NH2+][C@H](C)c1nc(C(C)C)no1)c1ccc(Cl)s1 ZINC000273466559 334047485 /nfs/dbraw/zinc/04/74/85/334047485.db2.gz DVLAAOLRNGHMBE-NXEZZACHSA-N 1 2 313.854 4.710 20 0 DJADLO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2cc(Cl)cc(Cl)c2)s1 ZINC000274270009 334058545 /nfs/dbraw/zinc/05/85/45/334058545.db2.gz WNQQOAPORKCBHW-YUMQZZPRSA-N 1 2 316.257 4.565 20 0 DJADLO CCn1ccnc1[C@H](C)[NH2+][C@@H](C)c1cccc(Cl)c1Cl ZINC000453106516 334231577 /nfs/dbraw/zinc/23/15/77/334231577.db2.gz DWKZUUHUNISXEE-QWRGUYRKSA-N 1 2 312.244 4.622 20 0 DJADLO CC[C@@H]([NH2+][C@@H](C)c1noc(-c2ccccc2)n1)c1ccsc1 ZINC000296686048 334235930 /nfs/dbraw/zinc/23/59/30/334235930.db2.gz GVXRHCHHELQQHB-SWLSCSKDSA-N 1 2 313.426 4.600 20 0 DJADLO C[C@H]([NH2+][C@H]1C[C@@H](C)n2ccnc21)c1cc(Cl)sc1Cl ZINC000453356188 334256193 /nfs/dbraw/zinc/25/61/93/334256193.db2.gz OZBYRUJQXBTVQG-WEDXCCLWSA-N 1 2 316.257 4.608 20 0 DJADLO C[C@@H]([NH2+]Cc1cn2ccsc2n1)c1ccc(-c2ccccc2)o1 ZINC000531949243 334303634 /nfs/dbraw/zinc/30/36/34/334303634.db2.gz OYOLCLNKVGVGSU-CYBMUJFWSA-N 1 2 323.421 4.507 20 0 DJADLO C[C@H](c1cccc(Cl)c1)[N@@H+]1CCO[C@@H](c2ccccc2F)C1 ZINC000303225070 334304856 /nfs/dbraw/zinc/30/48/56/334304856.db2.gz WGUPQZOKMFAFKA-FZKQIMNGSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@H](c1cccc(Cl)c1)[N@H+]1CCO[C@@H](c2ccccc2F)C1 ZINC000303225070 334304857 /nfs/dbraw/zinc/30/48/57/334304857.db2.gz WGUPQZOKMFAFKA-FZKQIMNGSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@@H]1CCC[C@H](C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000303937998 334346557 /nfs/dbraw/zinc/34/65/57/334346557.db2.gz WTZNPVMZZBGQPY-CABCVRRESA-N 1 2 310.397 4.639 20 0 DJADLO Cc1nc(C[NH2+][C@@H](CC(F)(F)F)c2ccccc2)c(C)s1 ZINC000341589530 334459283 /nfs/dbraw/zinc/45/92/83/334459283.db2.gz MKHVXWXWVFXUAE-ZDUSSCGKSA-N 1 2 314.376 4.543 20 0 DJADLO Fc1ccc([C@H](Nc2ccc(F)c(Cl)c2)c2[nH]cc[nH+]2)cc1 ZINC000188379706 334695035 /nfs/dbraw/zinc/69/50/35/334695035.db2.gz GYPVPRYPSAOTMP-HNNXBMFYSA-N 1 2 319.742 4.543 20 0 DJADLO CC[C@H]1CCCN(C(=O)c2cccc(Oc3cc[nH+]cc3)c2)CC1 ZINC000343620844 335182172 /nfs/dbraw/zinc/18/21/72/335182172.db2.gz MMYYHGWVGVCELW-INIZCTEOSA-N 1 2 324.424 4.526 20 0 DJADLO Cc1[nH]ncc1C[NH2+][C@H](CC(C)(C)C)c1ccc(Cl)cc1 ZINC000344302881 335238711 /nfs/dbraw/zinc/23/87/11/335238711.db2.gz LIHLYSAAJAAKBX-MRXNPFEDSA-N 1 2 305.853 4.639 20 0 DJADLO CCc1cnc(C[N@H+](Cc2ccc([C@H]3C[C@H]3C)o2)C2CC2)s1 ZINC000346138115 335380227 /nfs/dbraw/zinc/38/02/27/335380227.db2.gz RSXFZNDDZYAUAE-WBMJQRKESA-N 1 2 316.470 4.587 20 0 DJADLO CCc1cnc(C[N@@H+](Cc2ccc([C@H]3C[C@H]3C)o2)C2CC2)s1 ZINC000346138115 335380229 /nfs/dbraw/zinc/38/02/29/335380229.db2.gz RSXFZNDDZYAUAE-WBMJQRKESA-N 1 2 316.470 4.587 20 0 DJADLO CCc1cnc(C[N@H+](Cc2ccc([C@H]3C[C@@H]3C)o2)C2CC2)s1 ZINC000346138113 335380234 /nfs/dbraw/zinc/38/02/34/335380234.db2.gz RSXFZNDDZYAUAE-LRDDRELGSA-N 1 2 316.470 4.587 20 0 DJADLO CCc1cnc(C[N@@H+](Cc2ccc([C@H]3C[C@@H]3C)o2)C2CC2)s1 ZINC000346138113 335380235 /nfs/dbraw/zinc/38/02/35/335380235.db2.gz RSXFZNDDZYAUAE-LRDDRELGSA-N 1 2 316.470 4.587 20 0 DJADLO CCc1cnc(C[N@H+](Cc2ccc([C@@H]3C[C@H]3C)o2)C2CC2)s1 ZINC000346138114 335380266 /nfs/dbraw/zinc/38/02/66/335380266.db2.gz RSXFZNDDZYAUAE-MLGOLLRUSA-N 1 2 316.470 4.587 20 0 DJADLO CCc1cnc(C[N@@H+](Cc2ccc([C@@H]3C[C@H]3C)o2)C2CC2)s1 ZINC000346138114 335380268 /nfs/dbraw/zinc/38/02/68/335380268.db2.gz RSXFZNDDZYAUAE-MLGOLLRUSA-N 1 2 316.470 4.587 20 0 DJADLO CC[C@@H]([NH2+]C1(c2nc(C)cs2)CCC1)c1ccc(F)cc1F ZINC000346665144 335427724 /nfs/dbraw/zinc/42/77/24/335427724.db2.gz GMTSMNFAHCDTCC-OAHLLOKOSA-N 1 2 322.424 4.850 20 0 DJADLO CCSc1cccc(CNc2cccc(-n3cc[nH+]c3)c2)c1 ZINC000349646496 335688426 /nfs/dbraw/zinc/68/84/26/335688426.db2.gz QAENGWORVZBJFN-UHFFFAOYSA-N 1 2 309.438 4.596 20 0 DJADLO CC(C)N(C(=O)c1cccc(Oc2cc[nH+]cc2)c1)C1CCCC1 ZINC000353100820 335710663 /nfs/dbraw/zinc/71/06/63/335710663.db2.gz DSDHKUMYRUXGDY-UHFFFAOYSA-N 1 2 324.424 4.667 20 0 DJADLO Cc1ccc(C)c([C@@H](C)[NH2+][C@H](C)c2noc(-c3ccccc3)n2)c1 ZINC000532246131 335925861 /nfs/dbraw/zinc/92/58/61/335925861.db2.gz KRXOKQSNRDINPC-HZPDHXFCSA-N 1 2 321.424 4.765 20 0 DJADLO C[C@@H]([NH2+]Cc1coc(-c2cccs2)n1)c1ccc(F)c(F)c1 ZINC000102687803 335929958 /nfs/dbraw/zinc/92/99/58/335929958.db2.gz ZBRNMNWLHUCFLV-SNVBAGLBSA-N 1 2 320.364 4.532 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)c1cccc(OC2CCCCC2)c1 ZINC000331768866 336148086 /nfs/dbraw/zinc/14/80/86/336148086.db2.gz DMGXGYNLTZNKJA-UHFFFAOYSA-N 1 2 324.424 4.662 20 0 DJADLO Cc1c[nH]c(-c2ccccc2NC(=O)[C@H]2CCCC(C)(C)C2)[nH+]1 ZINC000332061254 336156998 /nfs/dbraw/zinc/15/69/98/336156998.db2.gz QRVMUMYEOUDIDH-AWEZNQCLSA-N 1 2 311.429 4.540 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H](CC1CCC1)c1ccccc1 ZINC000351931636 336180568 /nfs/dbraw/zinc/18/05/68/336180568.db2.gz SDQUXUGECXIVJD-SFHVURJKSA-N 1 2 323.440 4.751 20 0 DJADLO CC[C@@H](NC(=O)Nc1c(C)cc[nH+]c1C)c1cccc(Cl)c1 ZINC000351935404 336180980 /nfs/dbraw/zinc/18/09/80/336180980.db2.gz HBWABAZTKRBDRY-OAHLLOKOSA-N 1 2 317.820 4.625 20 0 DJADLO CC(C)c1[nH]ccc1C(=O)Nc1ccc2[nH]c(C3CCC3)[nH+]c2c1 ZINC000351972690 336184729 /nfs/dbraw/zinc/18/47/29/336184729.db2.gz SNMZXLXHXWNGHI-UHFFFAOYSA-N 1 2 322.412 4.534 20 0 DJADLO Clc1cnc(C[N@H+](Cc2ccoc2)C2CCCCC2)s1 ZINC000351994228 336186826 /nfs/dbraw/zinc/18/68/26/336186826.db2.gz FDXFUVIUSRSPHP-UHFFFAOYSA-N 1 2 310.850 4.724 20 0 DJADLO Clc1cnc(C[N@@H+](Cc2ccoc2)C2CCCCC2)s1 ZINC000351994228 336186827 /nfs/dbraw/zinc/18/68/27/336186827.db2.gz FDXFUVIUSRSPHP-UHFFFAOYSA-N 1 2 310.850 4.724 20 0 DJADLO Clc1ccc(C[N@H+](Cc2nccs2)C2CC2)cc1Cl ZINC000352250341 336206786 /nfs/dbraw/zinc/20/67/86/336206786.db2.gz GWMZDRTWICROIR-UHFFFAOYSA-N 1 2 313.253 4.615 20 0 DJADLO Clc1ccc(C[N@@H+](Cc2nccs2)C2CC2)cc1Cl ZINC000352250341 336206787 /nfs/dbraw/zinc/20/67/87/336206787.db2.gz GWMZDRTWICROIR-UHFFFAOYSA-N 1 2 313.253 4.615 20 0 DJADLO Cc1cnc([C@H](C)[NH2+][C@H](C)c2ccc(Oc3cccnc3)cc2)o1 ZINC000352250477 336206808 /nfs/dbraw/zinc/20/68/08/336206808.db2.gz OADHVIRNXLORPK-CABCVRRESA-N 1 2 323.396 4.582 20 0 DJADLO Clc1cc2c(s1)CC[C@H]2[NH2+]Cc1csc(C2CC2)n1 ZINC000352446160 336219396 /nfs/dbraw/zinc/21/93/96/336219396.db2.gz BCXYOUBBSXKBPB-LLVKDONJSA-N 1 2 310.875 4.513 20 0 DJADLO CC[C@H](c1ccc(F)cc1F)[N@@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000532344197 336243416 /nfs/dbraw/zinc/24/34/16/336243416.db2.gz AVWGTSWDNSMICD-IAGOWNOFSA-N 1 2 323.408 4.551 20 0 DJADLO CC[C@H](c1ccc(F)cc1F)[N@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000532344197 336243417 /nfs/dbraw/zinc/24/34/17/336243417.db2.gz AVWGTSWDNSMICD-IAGOWNOFSA-N 1 2 323.408 4.551 20 0 DJADLO C[C@@H](c1ccc(C(C)(C)C)cc1)[N@H+](C)Cc1nccn1C(F)F ZINC000532470176 336249531 /nfs/dbraw/zinc/24/95/31/336249531.db2.gz BKMUEIHFPKBURJ-ZDUSSCGKSA-N 1 2 321.415 4.769 20 0 DJADLO C[C@@H](c1ccc(C(C)(C)C)cc1)[N@@H+](C)Cc1nccn1C(F)F ZINC000532470176 336249532 /nfs/dbraw/zinc/24/95/32/336249532.db2.gz BKMUEIHFPKBURJ-ZDUSSCGKSA-N 1 2 321.415 4.769 20 0 DJADLO COc1ccccc1-c1ccc(CNc2c[nH+]cc(C)c2)cc1 ZINC000532568916 336255788 /nfs/dbraw/zinc/25/57/88/336255788.db2.gz LXPSFNARNHVJRX-UHFFFAOYSA-N 1 2 304.393 4.678 20 0 DJADLO CC(C)c1ccc([C@H](C)CC(=O)Nc2cccc3[nH+]ccn32)cc1 ZINC000460334951 336260109 /nfs/dbraw/zinc/26/01/09/336260109.db2.gz LYDHESMMVCWSCS-OAHLLOKOSA-N 1 2 321.424 4.590 20 0 DJADLO Clc1cc(NCc2cccc3cc[nH]c32)ccc1-n1cc[nH+]c1 ZINC000532727728 336267670 /nfs/dbraw/zinc/26/76/70/336267670.db2.gz VUGLEKUFKDENKO-UHFFFAOYSA-N 1 2 322.799 4.619 20 0 DJADLO Cc1cc(SC2CCCCC2)ccc1NCc1[nH]cc[nH+]1 ZINC000532728167 336267756 /nfs/dbraw/zinc/26/77/56/336267756.db2.gz DAFRMRPDYKTDKQ-UHFFFAOYSA-N 1 2 301.459 4.755 20 0 DJADLO CC(C)C[C@H]([NH2+][C@@H](C)c1nc(C(C)C)no1)c1cccs1 ZINC000542557633 336272506 /nfs/dbraw/zinc/27/25/06/336272506.db2.gz WYQLKBIZCKIEDX-STQMWFEESA-N 1 2 307.463 4.693 20 0 DJADLO CCc1nc(C[N@H+](C)C/C=C/c2ccc(Cl)cc2)cs1 ZINC000527050801 336281410 /nfs/dbraw/zinc/28/14/10/336281410.db2.gz INARXWVYRHKUSM-SNAWJCMRSA-N 1 2 306.862 4.504 20 0 DJADLO CCc1nc(C[N@@H+](C)C/C=C/c2ccc(Cl)cc2)cs1 ZINC000527050801 336281411 /nfs/dbraw/zinc/28/14/11/336281411.db2.gz INARXWVYRHKUSM-SNAWJCMRSA-N 1 2 306.862 4.504 20 0 DJADLO CCc1cc(N[C@@H](C)c2ccc(C)s2)nc(-c2ccncc2)[nH+]1 ZINC000301168370 336293005 /nfs/dbraw/zinc/29/30/05/336293005.db2.gz IWLQDQNCVOAOAC-ZDUSSCGKSA-N 1 2 324.453 4.644 20 0 DJADLO Cc1cc(C)cc([C@@H](C)Nc2cc(C)[nH+]c(-c3cccnc3)n2)c1 ZINC000301185206 336293884 /nfs/dbraw/zinc/29/38/84/336293884.db2.gz JQFRTOLKGUDXAF-MRXNPFEDSA-N 1 2 318.424 4.637 20 0 DJADLO c1ccc(C(Nc2cc[nH+]c(C3CC3)n2)c2ccccc2)cc1 ZINC000301249996 336296768 /nfs/dbraw/zinc/29/67/68/336296768.db2.gz PJUDFPRGEMOBDI-UHFFFAOYSA-N 1 2 301.393 4.556 20 0 DJADLO Cc1cc([C@H](C)Nc2nc(-c3ccncc3)[nH+]c(C)c2C)c(C)o1 ZINC000301252898 336296932 /nfs/dbraw/zinc/29/69/32/336296932.db2.gz JSJSLQMGYPDKJY-AWEZNQCLSA-N 1 2 322.412 4.538 20 0 DJADLO Cc1cc(NCc2ccc(-c3cccnc3)cc2)nc(C(C)C)[nH+]1 ZINC000301435956 336306650 /nfs/dbraw/zinc/30/66/50/336306650.db2.gz KMHFEEIJYJCGRQ-UHFFFAOYSA-N 1 2 318.424 4.583 20 0 DJADLO Fc1cccc([C@@H](Nc2cc[nH+]c(C3CC3)n2)c2ccccc2)c1 ZINC000301601566 336317734 /nfs/dbraw/zinc/31/77/34/336317734.db2.gz JHUQMAHLFFSXMK-IBGZPJMESA-N 1 2 319.383 4.695 20 0 DJADLO CCc1nc([C@H](C)Nc2cc(C)[nH+]c3c(F)cccc23)cs1 ZINC000301649202 336320592 /nfs/dbraw/zinc/32/05/92/336320592.db2.gz FNDGTFHGJKDJKZ-NSHDSACASA-N 1 2 315.417 4.874 20 0 DJADLO COc1ccccc1[C@@H]1CCN(c2[nH+]c3ccccc3cc2C)C1 ZINC000301707240 336324710 /nfs/dbraw/zinc/32/47/10/336324710.db2.gz GQEGVYJDLIUVSQ-QGZVFWFLSA-N 1 2 318.420 4.546 20 0 DJADLO CC(C)c1cc(N[C@@H]2CCOC3(CCCC3)C2)nc(C(C)C)[nH+]1 ZINC000301882578 336336071 /nfs/dbraw/zinc/33/60/71/336336071.db2.gz XEWRBVGHWJRBLX-OAHLLOKOSA-N 1 2 317.477 4.627 20 0 DJADLO C[C@@H](Nc1cc(C(F)(F)F)cc[nH+]1)c1cccc(F)c1F ZINC000301932556 336338633 /nfs/dbraw/zinc/33/86/33/336338633.db2.gz PIBFIACDYQKRRA-MRVPVSSYSA-N 1 2 302.246 4.552 20 0 DJADLO Cc1nc(C)c(CNc2cc(C(C)(C)C)[nH+]c(C(C)C)n2)s1 ZINC000302903165 336374060 /nfs/dbraw/zinc/37/40/60/336374060.db2.gz RIXVQHOELYDWRO-UHFFFAOYSA-N 1 2 318.490 4.583 20 0 DJADLO CC(C)c1nc(NCc2ccc(Cl)nc2)cc(C(C)(C)C)[nH+]1 ZINC000302915955 336374331 /nfs/dbraw/zinc/37/43/31/336374331.db2.gz VYUQRGUAAIXENB-UHFFFAOYSA-N 1 2 318.852 4.558 20 0 DJADLO Cc1cc(SC2CCCCC2)ccc1NCc1c[nH+]cn1C ZINC000355567294 336514517 /nfs/dbraw/zinc/51/45/17/336514517.db2.gz MGXNVEACAFEMIF-UHFFFAOYSA-N 1 2 315.486 4.765 20 0 DJADLO CC[C@@H]1CC[C@@H](C)N1C(=O)c1ccc(C)c(Oc2cc[nH+]cc2)c1 ZINC000357764339 336597343 /nfs/dbraw/zinc/59/73/43/336597343.db2.gz UEUGMVLOTLWHAV-NVXWUHKLSA-N 1 2 324.424 4.585 20 0 DJADLO Cc1nc([C@@H](C)[NH2+][C@@H](CC(F)(F)F)c2ccccc2)cs1 ZINC000361079122 336737568 /nfs/dbraw/zinc/73/75/68/336737568.db2.gz JWWABQNHQWWGOZ-MFKMUULPSA-N 1 2 314.376 4.796 20 0 DJADLO Cc1ccc(NC(=O)C[C@H]2C[C@@H](C)c3c2cccc3C)c(C)[nH+]1 ZINC000362649281 336807753 /nfs/dbraw/zinc/80/77/53/336807753.db2.gz PMARLZNSQMGPOK-CZUORRHYSA-N 1 2 308.425 4.626 20 0 DJADLO c1csc([C@H]([NH2+]Cc2ccc3occc3c2)c2ccccc2)n1 ZINC000367542154 336824615 /nfs/dbraw/zinc/82/46/15/336824615.db2.gz XULYQNFEHGIZFV-GOSISDBHSA-N 1 2 320.417 4.769 20 0 DJADLO COc1ccsc1[C@@H](C)[NH2+][C@@H](c1ccccc1)c1ccccn1 ZINC000375085665 337002987 /nfs/dbraw/zinc/00/29/87/337002987.db2.gz ZYLCMRCHMDMIAI-KDOFPFPSSA-N 1 2 324.449 4.592 20 0 DJADLO Cc1cccc([C@H]([NH2+][C@H](C)c2cc(C)ccn2)c2ccccn2)c1 ZINC000375811375 337020223 /nfs/dbraw/zinc/02/02/23/337020223.db2.gz WGGNVDOXXDFYCR-UTKZUKDTSA-N 1 2 317.436 4.534 20 0 DJADLO Fc1ccc2c(c1)CC[C@H]2[NH2+][C@H](c1nccs1)c1ccccc1 ZINC000123072310 337035259 /nfs/dbraw/zinc/03/52/59/337035259.db2.gz OORZQLDIAOBXFI-MSOLQXFVSA-N 1 2 324.424 4.649 20 0 DJADLO Cc1ccc2c(c1)[C@@H]([NH2+][C@@H](c1nccs1)c1ccccc1)CC2 ZINC000123269951 337041842 /nfs/dbraw/zinc/04/18/42/337041842.db2.gz DJZFQRGUYSFATJ-RBUKOAKNSA-N 1 2 320.461 4.818 20 0 DJADLO Cc1ccc([C@H](C)[NH2+][C@H](c2nccs2)c2ccccc2)cc1 ZINC000123343865 337044889 /nfs/dbraw/zinc/04/48/89/337044889.db2.gz GZWXTHLOSNKPQX-YJBOKZPZSA-N 1 2 308.450 4.892 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1cscn1)c1cc(Cl)cc(Cl)c1 ZINC000582736557 337127931 /nfs/dbraw/zinc/12/79/31/337127931.db2.gz ANOHVTCLOIWHQE-BDAKNGLRSA-N 1 2 301.242 4.862 20 0 DJADLO Cc1cccc([C@H](C)[NH2+][C@@H](c2nccs2)c2ccccc2)c1 ZINC000173266791 337133996 /nfs/dbraw/zinc/13/39/96/337133996.db2.gz IHHWJVZYZSFFRV-MAUKXSAKSA-N 1 2 308.450 4.892 20 0 DJADLO Fc1ccc2c(c1)[C@H]([NH2+][C@H](c1nccs1)c1ccccc1)CC2 ZINC000177695527 337158547 /nfs/dbraw/zinc/15/85/47/337158547.db2.gz CYESRUYMIAPDPM-MSOLQXFVSA-N 1 2 324.424 4.649 20 0 DJADLO Cc1cc(C[N@H+](Cc2ccco2)Cc2cccnc2)c(C)s1 ZINC000182061986 337186169 /nfs/dbraw/zinc/18/61/69/337186169.db2.gz MUEMHWWJNISNPZ-UHFFFAOYSA-N 1 2 312.438 4.555 20 0 DJADLO Cc1cc(C[N@@H+](Cc2ccco2)Cc2cccnc2)c(C)s1 ZINC000182061986 337186170 /nfs/dbraw/zinc/18/61/70/337186170.db2.gz MUEMHWWJNISNPZ-UHFFFAOYSA-N 1 2 312.438 4.555 20 0 DJADLO Cc1csc([C@H](C)[NH2+][C@H](C)c2ncc(-c3ccccc3)o2)n1 ZINC000184274581 337197649 /nfs/dbraw/zinc/19/76/49/337197649.db2.gz YLPQWABQVLDSKV-OLZOCXBDSA-N 1 2 313.426 4.518 20 0 DJADLO Cc1ccc(C[N@H+](Cc2ccco2)Cc2cccs2)c(C)n1 ZINC000186463470 337256431 /nfs/dbraw/zinc/25/64/31/337256431.db2.gz GKJVEMRBJQEZSX-UHFFFAOYSA-N 1 2 312.438 4.555 20 0 DJADLO Cc1ccc(C[N@@H+](Cc2ccco2)Cc2cccs2)c(C)n1 ZINC000186463470 337256432 /nfs/dbraw/zinc/25/64/32/337256432.db2.gz GKJVEMRBJQEZSX-UHFFFAOYSA-N 1 2 312.438 4.555 20 0 DJADLO Cc1ccc(C[N@@H+](C)[C@H](C)c2nc3ccccc3s2)c(C)n1 ZINC000187194076 337263588 /nfs/dbraw/zinc/26/35/88/337263588.db2.gz DQNSXPZWNFPGIQ-CQSZACIVSA-N 1 2 311.454 4.501 20 0 DJADLO Cc1ccc(C[N@H+](C)[C@H](C)c2nc3ccccc3s2)c(C)n1 ZINC000187194076 337263589 /nfs/dbraw/zinc/26/35/89/337263589.db2.gz DQNSXPZWNFPGIQ-CQSZACIVSA-N 1 2 311.454 4.501 20 0 DJADLO Cc1noc(C)c1[C@H](C)CNc1cc[nH+]c2c(Cl)cccc12 ZINC000583207563 337271456 /nfs/dbraw/zinc/27/14/56/337271456.db2.gz LAOQSFIAJKDDQV-SNVBAGLBSA-N 1 2 315.804 4.709 20 0 DJADLO CC[C@H](C)Sc1ccc(NCc2[nH]c(C)c(C)[nH+]2)c(C)c1 ZINC000583274153 337299830 /nfs/dbraw/zinc/29/98/30/337299830.db2.gz PBFMAZVJMZVFBJ-LBPRGKRZSA-N 1 2 303.475 4.838 20 0 DJADLO Clc1ccsc1C[NH2+][C@@H](c1nccs1)c1ccccc1 ZINC000193070277 337309194 /nfs/dbraw/zinc/30/91/94/337309194.db2.gz OEEJEWCQRPNGKI-CQSZACIVSA-N 1 2 320.870 4.737 20 0 DJADLO Cc1nc([C@@H](C)[NH2+][C@H](C)c2ccccc2OC(C)C)cs1 ZINC000037118920 337363212 /nfs/dbraw/zinc/36/32/12/337363212.db2.gz NYCQYTUEQRMHFX-CHWSQXEVSA-N 1 2 304.459 4.651 20 0 DJADLO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2OC)cs1 ZINC000421835965 337652338 /nfs/dbraw/zinc/65/23/38/337652338.db2.gz QOPMMRIWVLFNID-WDEREUQCSA-N 1 2 324.877 4.779 20 0 DJADLO C[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc(Br)s1 ZINC000423209850 337704293 /nfs/dbraw/zinc/70/42/93/337704293.db2.gz FLONANJGSRBBMR-SECBINFHSA-N 1 2 323.259 4.652 20 0 DJADLO Clc1ccc2c(c1)OCCC[C@H]2Nc1ccc2c(c1)CC[NH2+]2 ZINC000423222127 337705651 /nfs/dbraw/zinc/70/56/51/337705651.db2.gz ZTPXVJKKUNYXMB-QGZVFWFLSA-N 1 2 314.816 4.634 20 0 DJADLO CC(C)(C)c1ccncc1C[NH2+]Cc1c(F)ccc(F)c1Cl ZINC000527719817 337758887 /nfs/dbraw/zinc/75/88/87/337758887.db2.gz KXCWVARVVWKJHU-UHFFFAOYSA-N 1 2 324.802 4.601 20 0 DJADLO Cc1c(Cl)cccc1NCc1cn2cc(Cl)ccc2[nH+]1 ZINC000105855061 337811168 /nfs/dbraw/zinc/81/11/68/337811168.db2.gz AXAXXCHZZHGUFS-UHFFFAOYSA-N 1 2 306.196 4.562 20 0 DJADLO CCC[C@H]([NH2+]Cc1ncc(C)o1)c1ccc(Cl)c(Cl)c1 ZINC000537060328 337885433 /nfs/dbraw/zinc/88/54/33/337885433.db2.gz YGIIMESTLPQOJY-AWEZNQCLSA-N 1 2 313.228 4.921 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1cccc(F)c1)c1ccccn1)c1cccc(F)c1 ZINC000090956406 337887483 /nfs/dbraw/zinc/88/74/83/337887483.db2.gz BPDFFHGMTCCMPW-VLIAUNLRSA-N 1 2 324.374 4.800 20 0 DJADLO C[C@@H]1CCC[C@@H](Nc2cccc3c2CN(c2cccc[nH+]2)C3)C1 ZINC000537326221 337931155 /nfs/dbraw/zinc/93/11/55/337931155.db2.gz SDXYWLBDNGNCMS-NVXWUHKLSA-N 1 2 307.441 4.592 20 0 DJADLO Cc1ccncc1[C@H](C)Nc1cccc([NH+]2CCCCCC2)c1 ZINC000537533617 337941130 /nfs/dbraw/zinc/94/11/30/337941130.db2.gz PPSSBNJMBAIXEP-KRWDZBQOSA-N 1 2 309.457 4.944 20 0 DJADLO CCc1nc(C[NH2+][C@@H](C)c2cc3ccc(C)cc3o2)cs1 ZINC000426021419 338019603 /nfs/dbraw/zinc/01/96/03/338019603.db2.gz LIPJTPAVZCGRHE-LBPRGKRZSA-N 1 2 300.427 4.611 20 0 DJADLO CCCc1csc(C[N@@H+]2CC[C@@H](C(F)(F)F)C(C)(C)C2)n1 ZINC000426367170 338029112 /nfs/dbraw/zinc/02/91/12/338029112.db2.gz SMCSTACCAGOERS-GFCCVEGCSA-N 1 2 320.424 4.506 20 0 DJADLO CCCc1csc(C[N@H+]2CC[C@@H](C(F)(F)F)C(C)(C)C2)n1 ZINC000426367170 338029113 /nfs/dbraw/zinc/02/91/13/338029113.db2.gz SMCSTACCAGOERS-GFCCVEGCSA-N 1 2 320.424 4.506 20 0 DJADLO CCc1nc(C)c(C[N@H+]([C@@H](C)c2ccccc2Cl)C2CC2)o1 ZINC000428216600 338042804 /nfs/dbraw/zinc/04/28/04/338042804.db2.gz DKJZIFFRYBPIOO-ZDUSSCGKSA-N 1 2 318.848 4.924 20 0 DJADLO CCc1nc(C)c(C[N@@H+]([C@@H](C)c2ccccc2Cl)C2CC2)o1 ZINC000428216600 338042805 /nfs/dbraw/zinc/04/28/05/338042805.db2.gz DKJZIFFRYBPIOO-ZDUSSCGKSA-N 1 2 318.848 4.924 20 0 DJADLO Cc1cnc([C@H](C)[NH+]2Cc3ccccc3-c3ccccc3C2)cn1 ZINC000428234886 338043540 /nfs/dbraw/zinc/04/35/40/338043540.db2.gz AZANBHUKCXYRNE-INIZCTEOSA-N 1 2 315.420 4.529 20 0 DJADLO Cc1nc(C(C)C)oc1C[N@H+](Cc1ccc(F)cc1F)C1CC1 ZINC000428461159 338053378 /nfs/dbraw/zinc/05/33/78/338053378.db2.gz IFCBZQSKWJJWSI-UHFFFAOYSA-N 1 2 320.383 4.549 20 0 DJADLO Cc1nc(C(C)C)oc1C[N@@H+](Cc1ccc(F)cc1F)C1CC1 ZINC000428461159 338053379 /nfs/dbraw/zinc/05/33/79/338053379.db2.gz IFCBZQSKWJJWSI-UHFFFAOYSA-N 1 2 320.383 4.549 20 0 DJADLO CCCc1ccc([C@@H]([NH2+]Cc2cocn2)c2cccs2)cc1 ZINC000428873164 338063892 /nfs/dbraw/zinc/06/38/92/338063892.db2.gz VDVPMUNOEKOMRC-GOSISDBHSA-N 1 2 312.438 4.568 20 0 DJADLO CC(C)CCc1nc(C[NH2+]C(C)(C)c2ccccc2F)cs1 ZINC000429250055 338074758 /nfs/dbraw/zinc/07/47/58/338074758.db2.gz FFAOTSIWUCRAPG-UHFFFAOYSA-N 1 2 320.477 4.896 20 0 DJADLO CC[C@](C)([NH2+]Cc1c(Cl)cccc1OC)c1nc(C)cs1 ZINC000429699219 338087583 /nfs/dbraw/zinc/08/75/83/338087583.db2.gz OETPRFTYTAXZOD-INIZCTEOSA-N 1 2 324.877 4.529 20 0 DJADLO CC[C@@H]([NH2+]Cc1csc(Cl)c1Cl)c1nccs1 ZINC000432237308 338149556 /nfs/dbraw/zinc/14/95/56/338149556.db2.gz FEAJFEODYFFSBF-MRVPVSSYSA-N 1 2 307.271 4.752 20 0 DJADLO Clc1scc(C[NH2+]Cc2ccc3ccccc3n2)c1Cl ZINC000432243217 338150298 /nfs/dbraw/zinc/15/02/98/338150298.db2.gz TWTCATGGMBYBQK-UHFFFAOYSA-N 1 2 323.248 4.893 20 0 DJADLO C[C@@H]([NH2+]Cc1coc(-c2ccccc2)n1)c1cc2ccccc2o1 ZINC000161860357 338159850 /nfs/dbraw/zinc/15/98/50/338159850.db2.gz YEHGAMXVZAZWDS-CQSZACIVSA-N 1 2 318.376 4.939 20 0 DJADLO Cc1nc(CNc2ccc(-c3ccc(Cl)s3)c[nH+]2)cs1 ZINC000432729338 338164500 /nfs/dbraw/zinc/16/45/00/338164500.db2.gz QGFXPISUSQINPK-UHFFFAOYSA-N 1 2 321.858 4.841 20 0 DJADLO FC(F)(F)C1CC[NH+](Cc2csc(Cl)c2Cl)CC1 ZINC000432739084 338165185 /nfs/dbraw/zinc/16/51/85/338165185.db2.gz WBNBOJFQCYGPEG-UHFFFAOYSA-N 1 2 318.191 4.829 20 0 DJADLO C[C@@H](c1ccccc1F)[N@H+](C)Cc1nc2ccc(F)cc2s1 ZINC000432738651 338165300 /nfs/dbraw/zinc/16/53/00/338165300.db2.gz LOCHMXZSDISMGN-NSHDSACASA-N 1 2 318.392 4.768 20 0 DJADLO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1nc2ccc(F)cc2s1 ZINC000432738651 338165301 /nfs/dbraw/zinc/16/53/01/338165301.db2.gz LOCHMXZSDISMGN-NSHDSACASA-N 1 2 318.392 4.768 20 0 DJADLO Cc1ncc(C[N@@H+](C)Cc2ccc(F)c(Cl)c2Cl)s1 ZINC000432750004 338166281 /nfs/dbraw/zinc/16/62/81/338166281.db2.gz WOVFBPRRYSHTLM-UHFFFAOYSA-N 1 2 319.232 4.529 20 0 DJADLO Cc1ncc(C[N@H+](C)Cc2ccc(F)c(Cl)c2Cl)s1 ZINC000432750004 338166282 /nfs/dbraw/zinc/16/62/82/338166282.db2.gz WOVFBPRRYSHTLM-UHFFFAOYSA-N 1 2 319.232 4.529 20 0 DJADLO CC(C)c1cnc(C[N@H+](C)Cc2ccc(F)c(Cl)c2)s1 ZINC000432796755 338168408 /nfs/dbraw/zinc/16/84/08/338168408.db2.gz IWZVLJWPJKSARM-UHFFFAOYSA-N 1 2 312.841 4.691 20 0 DJADLO CC(C)c1cnc(C[N@@H+](C)Cc2ccc(F)c(Cl)c2)s1 ZINC000432796755 338168409 /nfs/dbraw/zinc/16/84/09/338168409.db2.gz IWZVLJWPJKSARM-UHFFFAOYSA-N 1 2 312.841 4.691 20 0 DJADLO C[C@@H]([NH2+]Cc1cc(F)c(Cl)cc1F)c1cccc(F)c1F ZINC000433099893 338181803 /nfs/dbraw/zinc/18/18/03/338181803.db2.gz CDAPMZRSJCSRPR-MRVPVSSYSA-N 1 2 317.713 4.747 20 0 DJADLO C[C@H]([NH2+]Cc1cc(F)c(Cl)cc1F)c1cccc(F)c1F ZINC000433099894 338181851 /nfs/dbraw/zinc/18/18/51/338181851.db2.gz CDAPMZRSJCSRPR-QMMMGPOBSA-N 1 2 317.713 4.747 20 0 DJADLO CC(C)c1nc(N2CCC[C@@H]2c2cccnc2)cc(C(C)(C)C)[nH+]1 ZINC000433600125 338197857 /nfs/dbraw/zinc/19/78/57/338197857.db2.gz PIGMMHNYOUCOSH-MRXNPFEDSA-N 1 2 324.472 4.634 20 0 DJADLO CC(C)c1noc([C@H](C)[NH2+][C@H](c2ccc(Cl)cc2)C(C)C)n1 ZINC000433781677 338201702 /nfs/dbraw/zinc/20/17/02/338201702.db2.gz FRKQCHGDXGLELD-WFASDCNBSA-N 1 2 321.852 4.894 20 0 DJADLO CC(C)C[C@@H]1CCCC[N@@H+]1Cc1ncc(C(F)(F)F)s1 ZINC000435124264 338232542 /nfs/dbraw/zinc/23/25/42/338232542.db2.gz NNXUVOKMBWDYQQ-NSHDSACASA-N 1 2 306.397 4.563 20 0 DJADLO CC(C)C[C@@H]1CCCC[N@H+]1Cc1ncc(C(F)(F)F)s1 ZINC000435124264 338232543 /nfs/dbraw/zinc/23/25/43/338232543.db2.gz NNXUVOKMBWDYQQ-NSHDSACASA-N 1 2 306.397 4.563 20 0 DJADLO Cc1cc(C)c(NC(=O)N2CCC[C@@H]2c2ccccc2C)c(C)[nH+]1 ZINC000436497101 338274329 /nfs/dbraw/zinc/27/43/29/338274329.db2.gz RWADFZPUGVFRBJ-GOSISDBHSA-N 1 2 323.440 4.684 20 0 DJADLO CC(C)c1cccc(C[NH2+][C@H](c2ncc[nH]2)c2ccc(F)cc2)c1 ZINC000437009071 338297634 /nfs/dbraw/zinc/29/76/34/338297634.db2.gz ZFVDIJREMYGVIE-IBGZPJMESA-N 1 2 323.415 4.551 20 0 DJADLO CC(C)c1cccc(C[NH2+][C@@H](c2ncc[nH]2)c2ccc(F)cc2)c1 ZINC000437009072 338297646 /nfs/dbraw/zinc/29/76/46/338297646.db2.gz ZFVDIJREMYGVIE-LJQANCHMSA-N 1 2 323.415 4.551 20 0 DJADLO C[C@@H](c1cccnc1)[N@@H+]1CCc2cc(Cl)cc(Cl)c2C1 ZINC000437507968 338312008 /nfs/dbraw/zinc/31/20/08/338312008.db2.gz XOMZAFBLIDAJGW-NSHDSACASA-N 1 2 307.224 4.508 20 0 DJADLO C[C@@H](c1cccnc1)[N@H+]1CCc2cc(Cl)cc(Cl)c2C1 ZINC000437507968 338312009 /nfs/dbraw/zinc/31/20/09/338312009.db2.gz XOMZAFBLIDAJGW-NSHDSACASA-N 1 2 307.224 4.508 20 0 DJADLO c1cc2cccc(NCc3c[nH+]cn3Cc3ccccc3)c2s1 ZINC000438292003 338338893 /nfs/dbraw/zinc/33/88/93/338338893.db2.gz HKXCTCYNFGAGLM-UHFFFAOYSA-N 1 2 319.433 4.758 20 0 DJADLO CC(C)(C)c1ccccc1NCc1c[nH+]cn1Cc1ccccc1 ZINC000438312026 338339413 /nfs/dbraw/zinc/33/94/13/338339413.db2.gz AAMJVMXVKFVQMP-UHFFFAOYSA-N 1 2 319.452 4.841 20 0 DJADLO CC(C)c1ncc(C[N@H+](C)[C@@H](C)c2cccc(Cl)c2F)cn1 ZINC000440472473 338388014 /nfs/dbraw/zinc/38/80/14/338388014.db2.gz UJOCKZJYTIFTTB-LBPRGKRZSA-N 1 2 321.827 4.586 20 0 DJADLO CC(C)c1ncc(C[N@@H+](C)[C@@H](C)c2cccc(Cl)c2F)cn1 ZINC000440472473 338388015 /nfs/dbraw/zinc/38/80/15/338388015.db2.gz UJOCKZJYTIFTTB-LBPRGKRZSA-N 1 2 321.827 4.586 20 0 DJADLO CC(C)CC1(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)CC1 ZINC000440481726 338388272 /nfs/dbraw/zinc/38/82/72/338388272.db2.gz BOYBAALBWBSUMH-UHFFFAOYSA-N 1 2 310.397 4.639 20 0 DJADLO CC(C)c1ncc(C[N@H+](C)Cc2cc(Cl)ccc2Cl)cn1 ZINC000440480505 338388314 /nfs/dbraw/zinc/38/83/14/338388314.db2.gz RMKNSJRZLBWKJA-UHFFFAOYSA-N 1 2 324.255 4.539 20 0 DJADLO CC(C)c1ncc(C[N@@H+](C)Cc2cc(Cl)ccc2Cl)cn1 ZINC000440480505 338388315 /nfs/dbraw/zinc/38/83/15/338388315.db2.gz RMKNSJRZLBWKJA-UHFFFAOYSA-N 1 2 324.255 4.539 20 0 DJADLO Cc1cc2[nH+]cn([C@@H](C)c3nc(C4CCC4)cs3)c2cc1C ZINC000440532876 338389440 /nfs/dbraw/zinc/38/94/40/338389440.db2.gz HJLLNFNHCASQBL-ZDUSSCGKSA-N 1 2 311.454 4.986 20 0 DJADLO CSc1ccccc1[C@H](C)[NH2+]Cc1ncc(-c2ccccc2)o1 ZINC000440614193 338392396 /nfs/dbraw/zinc/39/23/96/338392396.db2.gz MSVQWEDGZDKMJP-AWEZNQCLSA-N 1 2 324.449 4.914 20 0 DJADLO CCC(CC)n1ccc(C[N@H+]([C@@H](C)c2ccco2)C2CC2)n1 ZINC000440907455 338399708 /nfs/dbraw/zinc/39/97/08/338399708.db2.gz KQZHDPSNBOOFIH-AWEZNQCLSA-N 1 2 301.434 4.563 20 0 DJADLO CCC(CC)n1ccc(C[N@@H+]([C@@H](C)c2ccco2)C2CC2)n1 ZINC000440907455 338399709 /nfs/dbraw/zinc/39/97/09/338399709.db2.gz KQZHDPSNBOOFIH-AWEZNQCLSA-N 1 2 301.434 4.563 20 0 DJADLO CC(C)(C)C[C@H]([NH2+]C1CCC(C(F)F)CC1)C(F)(F)F ZINC000442812613 338433177 /nfs/dbraw/zinc/43/31/77/338433177.db2.gz ARIPCNUXHMXDNW-ILDUYXDCSA-N 1 2 301.343 4.767 20 0 DJADLO CCC1(CC)CCN(C(=O)c2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000446532099 338529686 /nfs/dbraw/zinc/52/96/86/338529686.db2.gz OSKVYEBGNGHYMV-UHFFFAOYSA-N 1 2 324.424 4.526 20 0 DJADLO CCCN(CC1CCCCC1)C(=O)Nc1ccc(C)[nH+]c1C ZINC000447181132 338547036 /nfs/dbraw/zinc/54/70/36/338547036.db2.gz CYKYBZDOHFISJY-UHFFFAOYSA-N 1 2 303.450 4.523 20 0 DJADLO Cc1ccc(NC(=O)N[C@H](CC(C)C)c2cccs2)c(C)[nH+]1 ZINC000447188307 338547114 /nfs/dbraw/zinc/54/71/14/338547114.db2.gz WVGJWYLWKDHLBG-OAHLLOKOSA-N 1 2 317.458 4.669 20 0 DJADLO Cc1ccc([C@@H](C)Nc2cccc(-c3[nH+]cc4n3CCCC4)c2)o1 ZINC000447570304 338557737 /nfs/dbraw/zinc/55/77/37/338557737.db2.gz SMRCRNMEOCAESR-OAHLLOKOSA-N 1 2 321.424 4.961 20 0 DJADLO C[C@@H]([NH2+]Cc1ccnn1C1CCCC1)c1c(F)cccc1Cl ZINC000449174455 338599210 /nfs/dbraw/zinc/59/92/10/338599210.db2.gz HUKVOCNWBBVWKD-GFCCVEGCSA-N 1 2 321.827 4.642 20 0 DJADLO Cc1cnc([C@@H](C)[NH2+][C@@H](c2ccc(F)c(Cl)c2)C2CC2)o1 ZINC000451352694 338730863 /nfs/dbraw/zinc/73/08/63/338730863.db2.gz IBKWZPIQMCXTRA-MEBBXXQBSA-N 1 2 308.784 4.577 20 0 DJADLO CC[C@@H]([NH2+][C@H](c1ccco1)c1ccccc1OC)c1ccncc1 ZINC000453154816 338800486 /nfs/dbraw/zinc/80/04/86/338800486.db2.gz ARDZNVKQMLPFAO-XLIONFOSSA-N 1 2 322.408 4.514 20 0 DJADLO C[C@@H]1C[C@H](Nc2ccc(C(C)(C)C(F)(F)F)cc2)c2[nH+]ccn21 ZINC000453201870 338807138 /nfs/dbraw/zinc/80/71/38/338807138.db2.gz CRRJVQSXBYSXMZ-RISCZKNCSA-N 1 2 323.362 4.841 20 0 DJADLO C[C@H]([NH2+][C@@H](c1c(Cl)cccc1Cl)C1CC1)c1ccncn1 ZINC000453254078 338814781 /nfs/dbraw/zinc/81/47/81/338814781.db2.gz OWKDXCGTPLGPKK-MGPLVRAMSA-N 1 2 322.239 4.585 20 0 DJADLO COc1ccc([C@@H]([NH2+][C@H](C)c2ccc(C)o2)c2ccco2)cc1 ZINC000453383693 338835653 /nfs/dbraw/zinc/83/56/53/338835653.db2.gz ADLGDKBOTFSCQN-AUUYWEPGSA-N 1 2 311.381 4.630 20 0 DJADLO c1csc([C@@H]([NH2+]Cc2ccc(C3CC3)cc2)c2ccccc2)n1 ZINC000459407848 339027505 /nfs/dbraw/zinc/02/75/05/339027505.db2.gz WPYMEFWXDRXNJO-IBGZPJMESA-N 1 2 320.461 4.900 20 0 DJADLO CC(C)c1nnc(C[NH2+]Cc2ccc(C3CCCC3)cc2)s1 ZINC000462786648 339088595 /nfs/dbraw/zinc/08/85/95/339088595.db2.gz ZQIAILABPMYOMX-UHFFFAOYSA-N 1 2 315.486 4.609 20 0 DJADLO Cc1nc([C@H](C)[NH2+][C@H](C)c2nc(C(C)(C)C)cs2)cs1 ZINC000462823058 339092299 /nfs/dbraw/zinc/09/22/99/339092299.db2.gz YDWARRVCHDARDJ-VHSXEESVSA-N 1 2 309.504 4.617 20 0 DJADLO COc1ccc(Cl)cc1[C@@H](CC(C)C)Nc1cc(C)[nH+]cn1 ZINC000462855805 339094627 /nfs/dbraw/zinc/09/46/27/339094627.db2.gz CRPOJZFTHWIKGO-OAHLLOKOSA-N 1 2 319.836 4.646 20 0 DJADLO COc1ccc(Cl)cc1[C@@H](CC(C)C)Nc1cc[nH+]c(C)n1 ZINC000462867424 339095064 /nfs/dbraw/zinc/09/50/64/339095064.db2.gz TZZBFYSFHIHCOO-OAHLLOKOSA-N 1 2 319.836 4.646 20 0 DJADLO COc1ccc(Cl)cc1[C@H](CC(C)C)Nc1cc[nH+]c(C)n1 ZINC000462867423 339095187 /nfs/dbraw/zinc/09/51/87/339095187.db2.gz TZZBFYSFHIHCOO-HNNXBMFYSA-N 1 2 319.836 4.646 20 0 DJADLO Cc1[nH+]cn(-c2ccc(NC3CCC(C(F)F)CC3)cc2)c1C ZINC000463038667 339102494 /nfs/dbraw/zinc/10/24/94/339102494.db2.gz ZENWYYNUUDRKEV-UHFFFAOYSA-N 1 2 319.399 4.725 20 0 DJADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2cncc(C(F)(F)F)c2)cc1 ZINC000463079189 339104814 /nfs/dbraw/zinc/10/48/14/339104814.db2.gz XSYMDCXQEIYNKA-INIZCTEOSA-N 1 2 324.321 4.577 20 0 DJADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2cncc(C(F)(F)F)c2)cc1 ZINC000463079189 339104815 /nfs/dbraw/zinc/10/48/15/339104815.db2.gz XSYMDCXQEIYNKA-INIZCTEOSA-N 1 2 324.321 4.577 20 0 DJADLO FC(F)(F)c1cncc(C[N@@H+]2CCCCC[C@@H]2c2ccco2)c1 ZINC000463105717 339105903 /nfs/dbraw/zinc/10/59/03/339105903.db2.gz LQZYCKNUESJKLQ-OAHLLOKOSA-N 1 2 324.346 4.811 20 0 DJADLO FC(F)(F)c1cncc(C[N@H+]2CCCCC[C@@H]2c2ccco2)c1 ZINC000463105717 339105904 /nfs/dbraw/zinc/10/59/04/339105904.db2.gz LQZYCKNUESJKLQ-OAHLLOKOSA-N 1 2 324.346 4.811 20 0 DJADLO COc1ccccc1[C@H](C)SCc1cn2cc(C)ccc2[nH+]1 ZINC000463189346 339108595 /nfs/dbraw/zinc/10/85/95/339108595.db2.gz HQIAKBVJYIXTPJ-AWEZNQCLSA-N 1 2 312.438 4.646 20 0 DJADLO COc1ccccc1[C@@H](C)SCc1cn2cc(C)ccc2[nH+]1 ZINC000463189347 339108692 /nfs/dbraw/zinc/10/86/92/339108692.db2.gz HQIAKBVJYIXTPJ-CQSZACIVSA-N 1 2 312.438 4.646 20 0 DJADLO C[C@H]1C[C@@H]1CC(=O)Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000463605011 339122592 /nfs/dbraw/zinc/12/25/92/339122592.db2.gz UVZTWWOAUQCJGG-NWDGAFQWSA-N 1 2 316.788 4.512 20 0 DJADLO Cc1ccccc1[C@H](C)[N@H+](C)Cc1nnc(-c2ccccc2)s1 ZINC000464110049 339134529 /nfs/dbraw/zinc/13/45/29/339134529.db2.gz RUBJSANFYMLCNC-HNNXBMFYSA-N 1 2 323.465 4.707 20 0 DJADLO Cc1ccccc1[C@H](C)[N@@H+](C)Cc1nnc(-c2ccccc2)s1 ZINC000464110049 339134530 /nfs/dbraw/zinc/13/45/30/339134530.db2.gz RUBJSANFYMLCNC-HNNXBMFYSA-N 1 2 323.465 4.707 20 0 DJADLO Cc1cc(C[N@@H+](C)[C@H](C)c2ccc(-c3ccccc3)cc2)no1 ZINC000464765481 339151792 /nfs/dbraw/zinc/15/17/92/339151792.db2.gz MPTKPUHMNADHRV-MRXNPFEDSA-N 1 2 306.409 4.843 20 0 DJADLO Cc1cc(C[N@H+](C)[C@H](C)c2ccc(-c3ccccc3)cc2)no1 ZINC000464765481 339151793 /nfs/dbraw/zinc/15/17/93/339151793.db2.gz MPTKPUHMNADHRV-MRXNPFEDSA-N 1 2 306.409 4.843 20 0 DJADLO C[C@@H]1CC[N@H+](Cc2cc(-c3ccco3)on2)[C@H](c2ccco2)C1 ZINC000464862256 339158694 /nfs/dbraw/zinc/15/86/94/339158694.db2.gz XBOJLTGPTORGNP-HIFRSBDPSA-N 1 2 312.369 4.501 20 0 DJADLO C[C@@H]1CC[N@@H+](Cc2cc(-c3ccco3)on2)[C@H](c2ccco2)C1 ZINC000464862256 339158695 /nfs/dbraw/zinc/15/86/95/339158695.db2.gz XBOJLTGPTORGNP-HIFRSBDPSA-N 1 2 312.369 4.501 20 0 DJADLO Fc1ccccc1C=C1CC[NH+](Cc2nc3ccccc3o2)CC1 ZINC000464883931 339160107 /nfs/dbraw/zinc/16/01/07/339160107.db2.gz FITSATGXBLPFKV-UHFFFAOYSA-N 1 2 322.383 4.646 20 0 DJADLO CCCn1nc(C)c(CNc2ccc(-c3ccccc3)c[nH+]2)c1C ZINC000466627395 339210849 /nfs/dbraw/zinc/21/08/49/339210849.db2.gz SXWWIYYIRHJJAM-UHFFFAOYSA-N 1 2 320.440 4.584 20 0 DJADLO COCc1cccc(CNc2[nH+]cccc2-c2ccccc2)c1 ZINC000466638463 339211437 /nfs/dbraw/zinc/21/14/37/339211437.db2.gz BZTKVBYSTSCILK-UHFFFAOYSA-N 1 2 304.393 4.507 20 0 DJADLO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2c(F)cccc2Cl)o1 ZINC000467119152 339226662 /nfs/dbraw/zinc/22/66/62/339226662.db2.gz RBDKDMXRPWOMLQ-INIZCTEOSA-N 1 2 323.795 4.556 20 0 DJADLO COCc1ccc([C@@H]2CCC[N@H+]2Cc2c(F)cccc2Cl)o1 ZINC000467119152 339226663 /nfs/dbraw/zinc/22/66/63/339226663.db2.gz RBDKDMXRPWOMLQ-INIZCTEOSA-N 1 2 323.795 4.556 20 0 DJADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1cccc2ccsc21 ZINC000467120045 339226870 /nfs/dbraw/zinc/22/68/70/339226870.db2.gz NPJBEDQVYGYCIL-UHFFFAOYSA-N 1 2 319.389 4.544 20 0 DJADLO C(=C\c1ccccc1)\CSCc1[nH+]ccn1Cc1ccccc1 ZINC000467222578 339228740 /nfs/dbraw/zinc/22/87/40/339228740.db2.gz AFDHLJGLKFENBS-GHXNOFRVSA-N 1 2 320.461 4.878 20 0 DJADLO Cc1nc2ccc(N[C@@H]3CCC[C@@H](c4[nH+]cccc4C)C3)cc2o1 ZINC000467357860 339233853 /nfs/dbraw/zinc/23/38/53/339233853.db2.gz ZFEJWWMVMIELSC-HZPDHXFCSA-N 1 2 321.424 4.978 20 0 DJADLO Cc1cccc(C)c1CSCc1[nH+]ccn1Cc1ccccc1 ZINC000467538758 339241344 /nfs/dbraw/zinc/24/13/44/339241344.db2.gz AHXLURBLYGFBDZ-UHFFFAOYSA-N 1 2 322.477 4.982 20 0 DJADLO C[C@@H]([NH2+]C1(c2ccccc2)CC1)c1nc(C(F)(F)F)cs1 ZINC000467736344 339244734 /nfs/dbraw/zinc/24/47/34/339244734.db2.gz BXYHZEURRHEKQR-SNVBAGLBSA-N 1 2 312.360 4.502 20 0 DJADLO Cc1c(COC(C)(C)C)cccc1NCc1[nH+]ccn1C(C)C ZINC000467776753 339246642 /nfs/dbraw/zinc/24/66/42/339246642.db2.gz NDUUZZVKIRMXJV-UHFFFAOYSA-N 1 2 315.461 4.700 20 0 DJADLO C[C@@H](c1ccc(Cl)cc1Cl)[N@H+](C)Cc1cncc(F)c1 ZINC000468491120 339264111 /nfs/dbraw/zinc/26/41/11/339264111.db2.gz DCWVLLNZIRUWMR-JTQLQIEISA-N 1 2 313.203 4.721 20 0 DJADLO C[C@@H](c1ccc(Cl)cc1Cl)[N@@H+](C)Cc1cncc(F)c1 ZINC000468491120 339264112 /nfs/dbraw/zinc/26/41/12/339264112.db2.gz DCWVLLNZIRUWMR-JTQLQIEISA-N 1 2 313.203 4.721 20 0 DJADLO C[C@H](c1ccc(Cl)cc1Cl)[N@H+](C)Cc1cncc(F)c1 ZINC000468491127 339264183 /nfs/dbraw/zinc/26/41/83/339264183.db2.gz DCWVLLNZIRUWMR-SNVBAGLBSA-N 1 2 313.203 4.721 20 0 DJADLO C[C@H](c1ccc(Cl)cc1Cl)[N@@H+](C)Cc1cncc(F)c1 ZINC000468491127 339264184 /nfs/dbraw/zinc/26/41/84/339264184.db2.gz DCWVLLNZIRUWMR-SNVBAGLBSA-N 1 2 313.203 4.721 20 0 DJADLO CC[C@H]([NH2+][C@@H]1CC=C(c2ccc(F)cc2)CC1)C(F)(F)F ZINC000469045205 339278489 /nfs/dbraw/zinc/27/84/89/339278489.db2.gz OQOLZZNNSGLYTH-CABCVRRESA-N 1 2 301.327 4.692 20 0 DJADLO CC(C)c1nc(N2CCCC[C@@H]2c2cc3ccccc3[nH]2)cc[nH+]1 ZINC000471746328 339353046 /nfs/dbraw/zinc/35/30/46/339353046.db2.gz KNMWQKYJLLYRSL-GOSISDBHSA-N 1 2 320.440 4.813 20 0 DJADLO CC(C)[C@@H]([NH2+]Cc1ncc(Cl)s1)c1ccccc1Cl ZINC000472040591 339360184 /nfs/dbraw/zinc/36/01/84/339360184.db2.gz GMLFGCGRIZLIJW-CQSZACIVSA-N 1 2 315.269 4.937 20 0 DJADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1ncc(Cl)s1 ZINC000472046703 339360711 /nfs/dbraw/zinc/36/07/11/339360711.db2.gz GNCOMNLBEHUMJU-SNVBAGLBSA-N 1 2 306.818 4.702 20 0 DJADLO C[C@@H]([NH2+]Cc1ncc(Cl)s1)c1cc(Cl)ccc1Cl ZINC000472077546 339362785 /nfs/dbraw/zinc/36/27/85/339362785.db2.gz IHFFVOPUHRMNFV-SSDOTTSWSA-N 1 2 321.660 4.954 20 0 DJADLO C[C@@H]1CC[N@H+](Cc2ncc(C(C)(C)C)o2)[C@@H]1c1cccc(F)c1 ZINC000472317771 339369740 /nfs/dbraw/zinc/36/97/40/339369740.db2.gz JQYHUALCUFXRIM-ACJLOTCBSA-N 1 2 316.420 4.694 20 0 DJADLO C[C@@H]1CC[N@@H+](Cc2ncc(C(C)(C)C)o2)[C@@H]1c1cccc(F)c1 ZINC000472317771 339369741 /nfs/dbraw/zinc/36/97/41/339369741.db2.gz JQYHUALCUFXRIM-ACJLOTCBSA-N 1 2 316.420 4.694 20 0 DJADLO C[C@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2ncc(Cl)s2)C1 ZINC000473137955 339382075 /nfs/dbraw/zinc/38/20/75/339382075.db2.gz BTDDDCPOJUGDDW-GWCFXTLKSA-N 1 2 310.825 4.519 20 0 DJADLO C[C@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2ncc(Cl)s2)C1 ZINC000473137955 339382076 /nfs/dbraw/zinc/38/20/76/339382076.db2.gz BTDDDCPOJUGDDW-GWCFXTLKSA-N 1 2 310.825 4.519 20 0 DJADLO C[C@H]([NH2+]Cc1ncc(Cl)s1)c1cc2cccc(F)c2o1 ZINC000474010787 339396972 /nfs/dbraw/zinc/39/69/72/339396972.db2.gz QDTMGFCUXPWLDN-QMMMGPOBSA-N 1 2 310.781 4.533 20 0 DJADLO COc1c2ccccc2oc1C[NH2+]Cc1ccc(F)cc1Cl ZINC000474013216 339397127 /nfs/dbraw/zinc/39/71/27/339397127.db2.gz AIJJQSDYWMXROZ-UHFFFAOYSA-N 1 2 319.763 4.524 20 0 DJADLO Cc1ccc(CCCNc2cccc(Oc3ccccn3)c2)c[nH+]1 ZINC000474931190 339431830 /nfs/dbraw/zinc/43/18/30/339431830.db2.gz GEGXACGNRNMXTD-UHFFFAOYSA-N 1 2 319.408 4.622 20 0 DJADLO Cc1ccc(CSc2nc3cc(Cl)ccc3o2)c(C)[nH+]1 ZINC000478835252 339523434 /nfs/dbraw/zinc/52/34/34/339523434.db2.gz NCXNWWKDCUMKEF-UHFFFAOYSA-N 1 2 304.802 4.785 20 0 DJADLO Cc1ccc(CSCc2cc(-c3ccccc3)on2)c(C)[nH+]1 ZINC000478918653 339524717 /nfs/dbraw/zinc/52/47/17/339524717.db2.gz XMNLKSOBJPGAIP-UHFFFAOYSA-N 1 2 310.422 4.787 20 0 DJADLO CC(=O)c1ccc(Cl)c(Cl)c1OCc1ccc(C)[nH+]c1C ZINC000478944970 339525282 /nfs/dbraw/zinc/52/52/82/339525282.db2.gz WQHLDDJSOGDCSW-UHFFFAOYSA-N 1 2 324.207 4.787 20 0 DJADLO C[C@H]([NH2+][C@H](c1ccco1)c1ccccc1)c1ccc(Cl)cn1 ZINC000480336558 339569615 /nfs/dbraw/zinc/56/96/15/339569615.db2.gz PYZBHWMFRLLGKC-UGSOOPFHSA-N 1 2 312.800 4.768 20 0 DJADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1nc2ccc(F)cc2o1 ZINC000484346575 339685204 /nfs/dbraw/zinc/68/52/04/339685204.db2.gz DKOLCZIPILEJJZ-GFCCVEGCSA-N 1 2 324.355 4.872 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC[C@H]1CCC1CCCC1 ZINC000485449626 339703524 /nfs/dbraw/zinc/70/35/24/339703524.db2.gz DEGAQRWTJFQCBM-KRWDZBQOSA-N 1 2 315.461 4.665 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC[C@@H]1CC1CCCCC1 ZINC000485449972 339703542 /nfs/dbraw/zinc/70/35/42/339703542.db2.gz GKAKBLCUKCANHW-QGZVFWFLSA-N 1 2 315.461 4.665 20 0 DJADLO Cc1ccc(C(=O)Nc2ccc(Oc3cc[nH+]cc3)c(C)c2)cc1 ZINC000487710790 339761445 /nfs/dbraw/zinc/76/14/45/339761445.db2.gz RHYHJCYLAPHIPA-UHFFFAOYSA-N 1 2 318.376 4.743 20 0 DJADLO Fc1ccc2cc[nH+]c(NCc3cc(-c4ccccc4)on3)c2c1 ZINC000489003997 339799691 /nfs/dbraw/zinc/79/96/91/339799691.db2.gz ARUIYKVQNBRASB-UHFFFAOYSA-N 1 2 319.339 4.641 20 0 DJADLO CCCc1csc(C[NH2+]Cc2ccc(-c3ccccc3)o2)n1 ZINC000494046288 339939829 /nfs/dbraw/zinc/93/98/29/339939829.db2.gz FPHWTUJEYSITSC-UHFFFAOYSA-N 1 2 312.438 4.645 20 0 DJADLO Cc1sc(C[NH2+][C@H](C)c2cc(F)ccc2F)nc1C(C)C ZINC000495471522 339985541 /nfs/dbraw/zinc/98/55/41/339985541.db2.gz YQKWJZOGFRFQJH-SNVBAGLBSA-N 1 2 310.413 4.704 20 0 DJADLO CCCc1nc(C[N@H+](C)[C@@H](C)c2ccc(F)c(F)c2)cs1 ZINC000496951096 340016834 /nfs/dbraw/zinc/01/68/34/340016834.db2.gz NHWGPYWCIYFCGX-NSHDSACASA-N 1 2 310.413 4.567 20 0 DJADLO CCCc1nc(C[N@@H+](C)[C@@H](C)c2ccc(F)c(F)c2)cs1 ZINC000496951096 340016835 /nfs/dbraw/zinc/01/68/35/340016835.db2.gz NHWGPYWCIYFCGX-NSHDSACASA-N 1 2 310.413 4.567 20 0 DJADLO C[C@H](c1ccc(Cl)c(Cl)c1)N(C)c1cc[nH+]c(C2CC2)n1 ZINC000498974853 340027316 /nfs/dbraw/zinc/02/73/16/340027316.db2.gz CNECBOGBDKJLHO-SNVBAGLBSA-N 1 2 322.239 4.858 20 0 DJADLO CSc1ccc([C@H](C)[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)cc1 ZINC000500251746 340054069 /nfs/dbraw/zinc/05/40/69/340054069.db2.gz OLKAJJKQGADYCB-RYUDHWBXSA-N 1 2 319.474 4.501 20 0 DJADLO CCc1ccc(-c2ccc(C[NH2+][C@H](C)c3ncc(C)o3)o2)cc1 ZINC000500394213 340056448 /nfs/dbraw/zinc/05/64/48/340056448.db2.gz LKXGHPULWNEKLM-CQSZACIVSA-N 1 2 310.397 4.656 20 0 DJADLO CC(C)c1nc(C[NH2+][C@@]2(c3ccc(Cl)cc3)C[C@@H]2C)cs1 ZINC000500414720 340057515 /nfs/dbraw/zinc/05/75/15/340057515.db2.gz INKUBBZQTYTTEW-SJCJKPOMSA-N 1 2 320.889 4.945 20 0 DJADLO Cc1cc([C@@H](C)[NH2+]Cc2cccc(Oc3ccccc3)c2)no1 ZINC000500508336 340061130 /nfs/dbraw/zinc/06/11/30/340061130.db2.gz NVRWAHJXXYNJTO-OAHLLOKOSA-N 1 2 308.381 4.626 20 0 DJADLO Cc1ncc(C[N@@H+]([C@H](C)c2ccccc2Cl)C2CC2)s1 ZINC000501203123 340076053 /nfs/dbraw/zinc/07/60/53/340076053.db2.gz IDNRNOAWDADTBY-LLVKDONJSA-N 1 2 306.862 4.831 20 0 DJADLO Cc1ncc(C[N@H+]([C@H](C)c2ccccc2Cl)C2CC2)s1 ZINC000501203123 340076054 /nfs/dbraw/zinc/07/60/54/340076054.db2.gz IDNRNOAWDADTBY-LLVKDONJSA-N 1 2 306.862 4.831 20 0 DJADLO c1[nH+]c(-c2cccc(N[C@H]3CCC34CCC4)c2)n2c1CCCC2 ZINC000502390790 340101371 /nfs/dbraw/zinc/10/13/71/340101371.db2.gz OVVJGIHJZHATKP-SFHVURJKSA-N 1 2 307.441 4.631 20 0 DJADLO c1[nH+]c(-c2cccc(N[C@@H]3CCC34CCC4)c2)n2c1CCCC2 ZINC000502390789 340101467 /nfs/dbraw/zinc/10/14/67/340101467.db2.gz OVVJGIHJZHATKP-GOSISDBHSA-N 1 2 307.441 4.631 20 0 DJADLO c1c(-c2ccc(N[C@@H]3CCC34CCC4)cc2)[nH+]c2n1CCCC2 ZINC000502405563 340101996 /nfs/dbraw/zinc/10/19/96/340101996.db2.gz JPWQGQLJMZQXKC-GOSISDBHSA-N 1 2 307.441 4.631 20 0 DJADLO COCC[C@H]1CCC[C@H]1Nc1cccc([NH+]2CCCCCC2)c1 ZINC000502461206 340104707 /nfs/dbraw/zinc/10/47/07/340104707.db2.gz IYLDFDKZNZGLKA-YLJYHZDGSA-N 1 2 316.489 4.684 20 0 DJADLO CCCc1nc(C[NH2+][C@@]2(c3ccc(Cl)cc3)C[C@@H]2C)cs1 ZINC000503412442 340127667 /nfs/dbraw/zinc/12/76/67/340127667.db2.gz URRDTOYQKREUBR-SJCJKPOMSA-N 1 2 320.889 4.774 20 0 DJADLO Fc1ccccc1C1([NH2+]Cc2ccc(Oc3ccccc3)o2)CC1 ZINC000503569416 340130923 /nfs/dbraw/zinc/13/09/23/340130923.db2.gz RNNAWXQOAMJTBN-UHFFFAOYSA-N 1 2 323.367 4.990 20 0 DJADLO CC(C)(C)C(=O)Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000504843100 340153557 /nfs/dbraw/zinc/15/35/57/340153557.db2.gz OGVUVPQGJOXDDN-UHFFFAOYSA-N 1 2 304.777 4.512 20 0 DJADLO c1ccc([C@@H](Nc2ccc3ccccc3[nH+]2)[C@H]2CCCO2)cc1 ZINC000505779585 340177818 /nfs/dbraw/zinc/17/78/18/340177818.db2.gz YHEJKNIZAVSGCS-UYAOXDASSA-N 1 2 304.393 4.567 20 0 DJADLO COc1ccccc1/C=C/C[NH+](Cc1ccco1)Cc1ccco1 ZINC000506088222 340185272 /nfs/dbraw/zinc/18/52/72/340185272.db2.gz VMVPTFOZIONXJR-XBXARRHUSA-N 1 2 323.392 4.597 20 0 DJADLO C[N@H+](Cc1cnc(C2CCCC2)s1)Cc1ccc(F)cc1F ZINC000506340496 340192676 /nfs/dbraw/zinc/19/26/76/340192676.db2.gz MLISLEYCKFIMFY-UHFFFAOYSA-N 1 2 322.424 4.711 20 0 DJADLO C[N@@H+](Cc1cnc(C2CCCC2)s1)Cc1ccc(F)cc1F ZINC000506340496 340192677 /nfs/dbraw/zinc/19/26/77/340192677.db2.gz MLISLEYCKFIMFY-UHFFFAOYSA-N 1 2 322.424 4.711 20 0 DJADLO CC(C)Cc1ncc(C[N@H+](C)[C@H](C)c2ccccc2F)s1 ZINC000506583228 340197201 /nfs/dbraw/zinc/19/72/01/340197201.db2.gz AEJKSQNVNOQVFX-CYBMUJFWSA-N 1 2 306.450 4.674 20 0 DJADLO CC(C)Cc1ncc(C[N@@H+](C)[C@H](C)c2ccccc2F)s1 ZINC000506583228 340197202 /nfs/dbraw/zinc/19/72/02/340197202.db2.gz AEJKSQNVNOQVFX-CYBMUJFWSA-N 1 2 306.450 4.674 20 0 DJADLO CC(C)n1cc(C[N@H+]([C@@H](C)c2ccccc2Cl)C2CC2)cn1 ZINC000506614136 340197650 /nfs/dbraw/zinc/19/76/50/340197650.db2.gz UMRSXSIAHNQNOE-AWEZNQCLSA-N 1 2 317.864 4.843 20 0 DJADLO CC(C)n1cc(C[N@@H+]([C@@H](C)c2ccccc2Cl)C2CC2)cn1 ZINC000506614136 340197651 /nfs/dbraw/zinc/19/76/51/340197651.db2.gz UMRSXSIAHNQNOE-AWEZNQCLSA-N 1 2 317.864 4.843 20 0 DJADLO COc1ccsc1C[N@H+](C)[C@H](C)c1nc2ccccc2s1 ZINC000506720945 340200181 /nfs/dbraw/zinc/20/01/81/340200181.db2.gz WDTFZNFKCALBQO-LLVKDONJSA-N 1 2 318.467 4.559 20 0 DJADLO COc1ccsc1C[N@@H+](C)[C@H](C)c1nc2ccccc2s1 ZINC000506720945 340200182 /nfs/dbraw/zinc/20/01/82/340200182.db2.gz WDTFZNFKCALBQO-LLVKDONJSA-N 1 2 318.467 4.559 20 0 DJADLO CC(C)c1nc(C[N@H+](Cc2cccc(F)c2)C(C)C)cs1 ZINC000507117682 340208109 /nfs/dbraw/zinc/20/81/09/340208109.db2.gz VSSIQIFWXYMVFZ-UHFFFAOYSA-N 1 2 306.450 4.816 20 0 DJADLO CC(C)c1nc(C[N@@H+](Cc2cccc(F)c2)C(C)C)cs1 ZINC000507117682 340208110 /nfs/dbraw/zinc/20/81/10/340208110.db2.gz VSSIQIFWXYMVFZ-UHFFFAOYSA-N 1 2 306.450 4.816 20 0 DJADLO Cc1csc(C[N@@H+](C)[C@@H](C)c2cccc(C(F)(F)F)c2)n1 ZINC000507196637 340212597 /nfs/dbraw/zinc/21/25/97/340212597.db2.gz YKKAFLFSKBIASH-NSHDSACASA-N 1 2 314.376 4.663 20 0 DJADLO Cc1csc(C[N@H+](C)[C@@H](C)c2cccc(C(F)(F)F)c2)n1 ZINC000507196637 340212598 /nfs/dbraw/zinc/21/25/98/340212598.db2.gz YKKAFLFSKBIASH-NSHDSACASA-N 1 2 314.376 4.663 20 0 DJADLO C[C@@H](c1c(F)cccc1F)[N@H+](C)Cc1ccc2ccccc2n1 ZINC000507206088 340213158 /nfs/dbraw/zinc/21/31/58/340213158.db2.gz YMBSTTCGKHPVKD-ZDUSSCGKSA-N 1 2 312.363 4.706 20 0 DJADLO C[C@@H](c1c(F)cccc1F)[N@@H+](C)Cc1ccc2ccccc2n1 ZINC000507206088 340213159 /nfs/dbraw/zinc/21/31/59/340213159.db2.gz YMBSTTCGKHPVKD-ZDUSSCGKSA-N 1 2 312.363 4.706 20 0 DJADLO Cc1cccc(C[N@H+](Cc2cnn(C(C)C)c2)Cc2ccco2)c1 ZINC000507205646 340213196 /nfs/dbraw/zinc/21/31/96/340213196.db2.gz XBQJHCNPAHZUGK-UHFFFAOYSA-N 1 2 323.440 4.568 20 0 DJADLO Cc1cccc(C[N@@H+](Cc2cnn(C(C)C)c2)Cc2ccco2)c1 ZINC000507205646 340213197 /nfs/dbraw/zinc/21/31/97/340213197.db2.gz XBQJHCNPAHZUGK-UHFFFAOYSA-N 1 2 323.440 4.568 20 0 DJADLO C[C@@H](c1c(F)cccc1F)[N@H+](C)Cc1cnc(C2CCC2)s1 ZINC000507204123 340213224 /nfs/dbraw/zinc/21/32/24/340213224.db2.gz PUBGXOGUEMXTEW-NSHDSACASA-N 1 2 322.424 4.882 20 0 DJADLO C[C@@H](c1c(F)cccc1F)[N@@H+](C)Cc1cnc(C2CCC2)s1 ZINC000507204123 340213225 /nfs/dbraw/zinc/21/32/25/340213225.db2.gz PUBGXOGUEMXTEW-NSHDSACASA-N 1 2 322.424 4.882 20 0 DJADLO Cc1ccc(C[N@@H+](C)[C@@H](C)c2ccc(Cl)cc2Cl)nc1 ZINC000507241587 340215109 /nfs/dbraw/zinc/21/51/09/340215109.db2.gz ALLPBCOYSWPVMS-LBPRGKRZSA-N 1 2 309.240 4.890 20 0 DJADLO Cc1ccc(C[N@H+](C)[C@@H](C)c2ccc(Cl)cc2Cl)nc1 ZINC000507241587 340215110 /nfs/dbraw/zinc/21/51/10/340215110.db2.gz ALLPBCOYSWPVMS-LBPRGKRZSA-N 1 2 309.240 4.890 20 0 DJADLO Clc1cccc(C[N@H+](Cc2ccccn2)C2CC2)c1Cl ZINC000507440241 340219587 /nfs/dbraw/zinc/21/95/87/340219587.db2.gz IMLHEABVMDWMMK-UHFFFAOYSA-N 1 2 307.224 4.553 20 0 DJADLO Clc1cccc(C[N@@H+](Cc2ccccn2)C2CC2)c1Cl ZINC000507440241 340219588 /nfs/dbraw/zinc/21/95/88/340219588.db2.gz IMLHEABVMDWMMK-UHFFFAOYSA-N 1 2 307.224 4.553 20 0 DJADLO CCc1cccnc1[C@@H](C)[NH2+]Cc1csc(-c2ccccc2)n1 ZINC000507466792 340220975 /nfs/dbraw/zinc/22/09/75/340220975.db2.gz DJWMRNXABRVMSM-CQSZACIVSA-N 1 2 323.465 4.618 20 0 DJADLO COc1c(C)cc(C[N@H+](C)Cc2csc(C(C)C)n2)cc1C ZINC000507615013 340226318 /nfs/dbraw/zinc/22/63/18/340226318.db2.gz JITUQRANKATXGA-UHFFFAOYSA-N 1 2 318.486 4.524 20 0 DJADLO COc1c(C)cc(C[N@@H+](C)Cc2csc(C(C)C)n2)cc1C ZINC000507615013 340226319 /nfs/dbraw/zinc/22/63/19/340226319.db2.gz JITUQRANKATXGA-UHFFFAOYSA-N 1 2 318.486 4.524 20 0 DJADLO CC(C)(C)c1nc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)cs1 ZINC000509040489 340259282 /nfs/dbraw/zinc/25/92/82/340259282.db2.gz SMNYIBYXMNOGCZ-INIZCTEOSA-N 1 2 318.461 4.917 20 0 DJADLO CC(C)(C)c1nc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)cs1 ZINC000509040489 340259283 /nfs/dbraw/zinc/25/92/83/340259283.db2.gz SMNYIBYXMNOGCZ-INIZCTEOSA-N 1 2 318.461 4.917 20 0 DJADLO CC[N@H+](Cc1csc(C(C)(C)C)n1)[C@@H](C)c1cccc(O)c1 ZINC000509562370 340273497 /nfs/dbraw/zinc/27/34/97/340273497.db2.gz ZXPJZXMANCRRQW-ZDUSSCGKSA-N 1 2 318.486 4.729 20 0 DJADLO CC[N@@H+](Cc1csc(C(C)(C)C)n1)[C@@H](C)c1cccc(O)c1 ZINC000509562370 340273498 /nfs/dbraw/zinc/27/34/98/340273498.db2.gz ZXPJZXMANCRRQW-ZDUSSCGKSA-N 1 2 318.486 4.729 20 0 DJADLO CCC[C@@H]1CCCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000510258855 340294385 /nfs/dbraw/zinc/29/43/85/340294385.db2.gz QODVTZIGRBQNRI-MRXNPFEDSA-N 1 2 324.424 4.526 20 0 DJADLO c1csc(-c2noc(-c3ccccc3Oc3cc[nH+]cc3)n2)c1 ZINC000511256482 340324466 /nfs/dbraw/zinc/32/44/66/340324466.db2.gz GNCCYQRFVKLIRL-UHFFFAOYSA-N 1 2 321.361 4.652 20 0 DJADLO C[C@@H](c1nc2ccccc2o1)[N@@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000511546256 340330189 /nfs/dbraw/zinc/33/01/89/340330189.db2.gz PHYFUNDXMKIXFL-BLLLJJGKSA-N 1 2 312.800 4.989 20 0 DJADLO C[C@@H](c1nc2ccccc2o1)[N@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000511546256 340330190 /nfs/dbraw/zinc/33/01/90/340330190.db2.gz PHYFUNDXMKIXFL-BLLLJJGKSA-N 1 2 312.800 4.989 20 0 DJADLO Clc1ccc([C@@H]2CC[N@@H+]2Cc2ncc(-c3ccccc3)o2)cc1 ZINC000511602467 340331882 /nfs/dbraw/zinc/33/18/82/340331882.db2.gz BBWYZQCYGILNIY-KRWDZBQOSA-N 1 2 324.811 4.942 20 0 DJADLO Clc1ccc([C@@H]2CC[N@H+]2Cc2ncc(-c3ccccc3)o2)cc1 ZINC000511602467 340331883 /nfs/dbraw/zinc/33/18/83/340331883.db2.gz BBWYZQCYGILNIY-KRWDZBQOSA-N 1 2 324.811 4.942 20 0 DJADLO Cc1cc([C@@H](C)Nc2ccc(C)[nH+]c2)sc1Br ZINC000512068332 340347541 /nfs/dbraw/zinc/34/75/41/340347541.db2.gz QTMBXQWKBHYSJE-SNVBAGLBSA-N 1 2 311.248 4.696 20 0 DJADLO CCc1ccc(CNc2cccc([NH+]3CCCCCC3)c2)cn1 ZINC000512084572 340348069 /nfs/dbraw/zinc/34/80/69/340348069.db2.gz XGYUNIRFWWKPMK-UHFFFAOYSA-N 1 2 309.457 4.637 20 0 DJADLO Clc1cccc(Cl)c1CNc1ccc(N2CCCC2)c[nH+]1 ZINC000513053304 340390998 /nfs/dbraw/zinc/39/09/98/340390998.db2.gz BNODFRVOMBCZGJ-UHFFFAOYSA-N 1 2 322.239 4.601 20 0 DJADLO C[C@H]([NH2+]Cc1csc(Cl)c1Cl)c1c(F)cncc1F ZINC000513081040 340392521 /nfs/dbraw/zinc/39/25/21/340392521.db2.gz DRKHVEZTVRISCC-LURJTMIESA-N 1 2 323.195 4.579 20 0 DJADLO CCc1cnc(C[NH2+]C(c2cccs2)c2cccs2)s1 ZINC000224407869 340554616 /nfs/dbraw/zinc/55/46/16/340554616.db2.gz QXFLTXMGEREMPF-UHFFFAOYSA-N 1 2 320.508 4.708 20 0 DJADLO C[C@H]([NH2+]Cc1nc2ccccc2[nH]1)c1cccc(Cl)c1Cl ZINC000227530240 340600016 /nfs/dbraw/zinc/60/00/16/340600016.db2.gz INNCRSZKBZEDFX-JTQLQIEISA-N 1 2 320.223 4.721 20 0 DJADLO CCCOc1cccc(NCc2c[nH+]c(C)n2-c2ccccc2)c1 ZINC000236776054 340664892 /nfs/dbraw/zinc/66/48/92/340664892.db2.gz LDLQHJNEXYKSSN-UHFFFAOYSA-N 1 2 321.424 4.582 20 0 DJADLO CC[C@@H]1CCC[C@@H](NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000524845369 340682353 /nfs/dbraw/zinc/68/23/53/340682353.db2.gz VOGSZGKPWWAFSE-NVXWUHKLSA-N 1 2 324.424 4.573 20 0 DJADLO CCCCn1cc[nH+]c1-c1cccc(NC(=O)c2cocc2C)c1 ZINC000528838060 340736340 /nfs/dbraw/zinc/73/63/40/340736340.db2.gz DAKUYWGVZZTDOU-UHFFFAOYSA-N 1 2 323.396 4.504 20 0 DJADLO C[C@H]([NH2+]Cc1cccc(O)c1Cl)c1cc2ccccc2o1 ZINC000328251133 340757073 /nfs/dbraw/zinc/75/70/73/340757073.db2.gz SPCYDHYFFMAQBS-NSHDSACASA-N 1 2 301.773 4.643 20 0 DJADLO Cc1ccc([C@H](C)[NH2+][C@H](C)c2noc(-c3ccccc3)n2)cc1C ZINC000124342080 340798575 /nfs/dbraw/zinc/79/85/75/340798575.db2.gz HRFLAKSOLQZFTF-JKSUJKDBSA-N 1 2 321.424 4.765 20 0 DJADLO Cc1ccc(-c2cnc(C[NH2+]C(C)(C)c3cccc(F)c3)o2)cc1 ZINC000538188812 340812568 /nfs/dbraw/zinc/81/25/68/340812568.db2.gz SGACXKYTLPDFFT-UHFFFAOYSA-N 1 2 324.399 4.814 20 0 DJADLO CCc1nc(C[NH2+]C2c3ccccc3-c3ccccc32)cs1 ZINC000067184209 340855537 /nfs/dbraw/zinc/85/55/37/340855537.db2.gz JJCBDAKJZNPMOY-UHFFFAOYSA-N 1 2 306.434 4.565 20 0 DJADLO Cc1cnc([C@H](C)[NH2+][C@@H](C)c2ccc(SC(C)C)cc2)o1 ZINC000539302582 340880106 /nfs/dbraw/zinc/88/01/06/340880106.db2.gz AWRAKNOIIUHCIL-KBPBESRZSA-N 1 2 304.459 4.895 20 0 DJADLO CC(C)CCc1nc(C[NH2+][C@H](C)c2ccc(F)cc2F)cs1 ZINC000540388910 340929037 /nfs/dbraw/zinc/92/90/37/340929037.db2.gz ZJFGMMMODPUBGS-GFCCVEGCSA-N 1 2 324.440 4.861 20 0 DJADLO CC(C)(C)c1ccc(C(C)(C)[NH2+]Cc2ncc(C3CC3)o2)cc1 ZINC000540403175 340929844 /nfs/dbraw/zinc/92/98/44/340929844.db2.gz AXWIDVGNKQYJSP-UHFFFAOYSA-N 1 2 312.457 4.874 20 0 DJADLO C[C@@H](Nc1ccc(N2CCCCC2)c[nH+]1)c1ccc(F)c(F)c1 ZINC000540727147 340943490 /nfs/dbraw/zinc/94/34/90/340943490.db2.gz QLZIPXSRYQFSJA-CYBMUJFWSA-N 1 2 317.383 4.523 20 0 DJADLO CCc1c[nH+]ccc1[C@H](C)[C@H](c1ccc(F)cc1)c1cnccn1 ZINC000543403843 341042603 /nfs/dbraw/zinc/04/26/03/341042603.db2.gz WGSVATSVMKPZLD-VBKZILBWSA-N 1 2 321.399 4.509 20 0 DJADLO FC(F)(F)c1cc(SCCCn2cc[nH+]c2)ccc1Cl ZINC000543642431 341052863 /nfs/dbraw/zinc/05/28/63/341052863.db2.gz PPYXTHKZNJMGME-UHFFFAOYSA-N 1 2 320.767 4.738 20 0 DJADLO Cc1cnc([C@@H](C)[NH2+][C@H](c2ccc(Cl)cc2F)C(C)C)o1 ZINC000543847664 341061427 /nfs/dbraw/zinc/06/14/27/341061427.db2.gz YGYQKXUKNOHCBQ-ABAIWWIYSA-N 1 2 310.800 4.823 20 0 DJADLO Cc1cnc([C@H](C)[NH2+][C@H](c2ccc(Cl)cc2F)C(C)C)o1 ZINC000543847666 341061440 /nfs/dbraw/zinc/06/14/40/341061440.db2.gz YGYQKXUKNOHCBQ-NHYWBVRUSA-N 1 2 310.800 4.823 20 0 DJADLO C[C@@H](c1ccc(Cl)cc1Cl)[N@H+](C)Cc1cncs1 ZINC000131212638 341065928 /nfs/dbraw/zinc/06/59/28/341065928.db2.gz VDLOKCFPNRGDPU-VIFPVBQESA-N 1 2 301.242 4.643 20 0 DJADLO C[C@@H](c1ccc(Cl)cc1Cl)[N@@H+](C)Cc1cncs1 ZINC000131212638 341065929 /nfs/dbraw/zinc/06/59/29/341065929.db2.gz VDLOKCFPNRGDPU-VIFPVBQESA-N 1 2 301.242 4.643 20 0 DJADLO C[C@@H](c1cccc(Cl)c1)[N@H+](C)Cc1nc(C2CC2)cs1 ZINC000544070363 341069012 /nfs/dbraw/zinc/06/90/12/341069012.db2.gz UOEHMJGYOHNKKL-NSHDSACASA-N 1 2 306.862 4.867 20 0 DJADLO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)Cc1nc(C2CC2)cs1 ZINC000544070363 341069013 /nfs/dbraw/zinc/06/90/13/341069013.db2.gz UOEHMJGYOHNKKL-NSHDSACASA-N 1 2 306.862 4.867 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1cccc(OCc2ccccc2)c1)c1ccon1 ZINC000544606705 341088567 /nfs/dbraw/zinc/08/85/67/341088567.db2.gz VPKSOGIXSSHYHH-JKSUJKDBSA-N 1 2 322.408 4.665 20 0 DJADLO CC(C)CCc1noc(C[NH2+][C@H](c2ccccc2)C(C)(C)C)n1 ZINC000072579552 341092207 /nfs/dbraw/zinc/09/22/07/341092207.db2.gz HJVYHQIECWTWKJ-GOSISDBHSA-N 1 2 315.461 4.535 20 0 DJADLO Cc1cc(C[N@H+](C)Cc2ccc(-c3ccc(Cl)cc3)o2)no1 ZINC000072803702 341107159 /nfs/dbraw/zinc/10/71/59/341107159.db2.gz CHFONBODPVHMKF-UHFFFAOYSA-N 1 2 316.788 4.528 20 0 DJADLO Cc1cc(C[N@@H+](C)Cc2ccc(-c3ccc(Cl)cc3)o2)no1 ZINC000072803702 341107160 /nfs/dbraw/zinc/10/71/60/341107160.db2.gz CHFONBODPVHMKF-UHFFFAOYSA-N 1 2 316.788 4.528 20 0 DJADLO CC[C@@](C)([NH2+]Cc1ccc(F)cc1Cl)c1nc(C)cs1 ZINC000072863434 341109474 /nfs/dbraw/zinc/10/94/74/341109474.db2.gz VOSRZTMLFHGLIA-OAHLLOKOSA-N 1 2 312.841 4.659 20 0 DJADLO c1nc(C[NH2+][C@H](c2cc3ccccc3o2)c2ccccc2)cs1 ZINC000073460312 341116951 /nfs/dbraw/zinc/11/69/51/341116951.db2.gz SQHVUDFWZGJGCT-IBGZPJMESA-N 1 2 320.417 4.769 20 0 DJADLO c1nc(C[NH2+][C@@H](c2cc3ccccc3o2)c2ccccc2)cs1 ZINC000073460313 341116999 /nfs/dbraw/zinc/11/69/99/341116999.db2.gz SQHVUDFWZGJGCT-LJQANCHMSA-N 1 2 320.417 4.769 20 0 DJADLO Cc1ccccc1-c1nc(C[NH2+][C@@H](C)c2c(C)cccc2C)no1 ZINC000546225605 341157729 /nfs/dbraw/zinc/15/77/29/341157729.db2.gz KXUDPTXYUONYRM-INIZCTEOSA-N 1 2 321.424 4.513 20 0 DJADLO Cc1ccccc1-c1nc(C[NH2+][C@H](C)c2c(C)cccc2C)no1 ZINC000546225606 341157798 /nfs/dbraw/zinc/15/77/98/341157798.db2.gz KXUDPTXYUONYRM-MRXNPFEDSA-N 1 2 321.424 4.513 20 0 DJADLO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000133521829 341177247 /nfs/dbraw/zinc/17/72/47/341177247.db2.gz HOJDOJKKLNUGIE-CYBMUJFWSA-N 1 2 318.486 4.608 20 0 DJADLO Cc1nc([C@H]([NH2+][C@H](C)CCC(C)C)c2ccc(Cl)cc2)no1 ZINC000546655909 341177363 /nfs/dbraw/zinc/17/73/63/341177363.db2.gz DCTVJKPJGNIHPM-MLGOLLRUSA-N 1 2 321.852 4.535 20 0 DJADLO Cc1cnc(C[N@@H+]([C@@H](C)c2cccc(C(F)(F)F)c2)C2CC2)o1 ZINC000075684606 341180884 /nfs/dbraw/zinc/18/08/84/341180884.db2.gz UPOTUFYMGCTUJB-LBPRGKRZSA-N 1 2 324.346 4.727 20 0 DJADLO Cc1cnc(C[N@H+]([C@@H](C)c2cccc(C(F)(F)F)c2)C2CC2)o1 ZINC000075684606 341180885 /nfs/dbraw/zinc/18/08/85/341180885.db2.gz UPOTUFYMGCTUJB-LBPRGKRZSA-N 1 2 324.346 4.727 20 0 DJADLO CCCC[C@H](CC)[NH2+][C@@H](c1noc(C)n1)c1ccc(Cl)cc1 ZINC000547312725 341204937 /nfs/dbraw/zinc/20/49/37/341204937.db2.gz QTUATZOAPOZBRB-JKSUJKDBSA-N 1 2 321.852 4.679 20 0 DJADLO CC(C)c1nc([C@H](C)[NH2+][C@@H]2CSc3ccccc32)cs1 ZINC000547398947 341211067 /nfs/dbraw/zinc/21/10/67/341211067.db2.gz GNQCJTLAFMEDIE-SMDDNHRTSA-N 1 2 304.484 4.764 20 0 DJADLO CC(C)c1nc([C@@H](C)[NH2+][C@@H]2CSc3ccccc32)cs1 ZINC000547398944 341211163 /nfs/dbraw/zinc/21/11/63/341211163.db2.gz GNQCJTLAFMEDIE-BXUZGUMPSA-N 1 2 304.484 4.764 20 0 DJADLO CCO[C@@H](C)c1nc(C[NH2+][C@@H](C)c2ccc(Cl)cc2)cs1 ZINC000076716260 341212909 /nfs/dbraw/zinc/21/29/09/341212909.db2.gz MSPUJANBRNUCIH-RYUDHWBXSA-N 1 2 324.877 4.745 20 0 DJADLO CCO[C@H](C)c1nc(C[N@H+](C)[C@H](CC)c2ccccc2)cs1 ZINC000076723278 341213044 /nfs/dbraw/zinc/21/30/44/341213044.db2.gz ZCAYVAQRRUYMIT-RHSMWYFYSA-N 1 2 318.486 4.824 20 0 DJADLO CCO[C@H](C)c1nc(C[N@@H+](C)[C@H](CC)c2ccccc2)cs1 ZINC000076723278 341213045 /nfs/dbraw/zinc/21/30/45/341213045.db2.gz ZCAYVAQRRUYMIT-RHSMWYFYSA-N 1 2 318.486 4.824 20 0 DJADLO Fc1cc2[nH+]cn(Cc3cc(Cl)ccc3Cl)c2cc1F ZINC000135118801 341231459 /nfs/dbraw/zinc/23/14/59/341231459.db2.gz LTYXQOQWKMSQNR-UHFFFAOYSA-N 1 2 313.134 4.670 20 0 DJADLO C[C@H]([NH2+][C@@H](c1ccco1)c1ccccc1)c1ccc(F)c(F)c1 ZINC000078971174 341250801 /nfs/dbraw/zinc/25/08/01/341250801.db2.gz JZRJSUVGUJHABJ-ORAYPTAESA-N 1 2 313.347 4.998 20 0 DJADLO Cc1cc(F)ccc1C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000137453258 341274879 /nfs/dbraw/zinc/27/48/79/341274879.db2.gz CIYNNGVBBXWSDS-UHFFFAOYSA-N 1 2 322.339 4.574 20 0 DJADLO Cc1ccccc1[C@@H](C)[N@H+](C)Cc1nc(C(F)(F)F)cs1 ZINC000137800958 341280263 /nfs/dbraw/zinc/28/02/63/341280263.db2.gz PKVHGYKRMDKFPY-LLVKDONJSA-N 1 2 314.376 4.663 20 0 DJADLO Cc1ccccc1[C@@H](C)[N@@H+](C)Cc1nc(C(F)(F)F)cs1 ZINC000137800958 341280264 /nfs/dbraw/zinc/28/02/64/341280264.db2.gz PKVHGYKRMDKFPY-LLVKDONJSA-N 1 2 314.376 4.663 20 0 DJADLO C[C@H]1CC[N@H+](Cc2csc(C3CC3)n2)[C@@H](c2ccco2)C1 ZINC000245699595 341310464 /nfs/dbraw/zinc/31/04/64/341310464.db2.gz YXYZLHCVZADKOM-SWLSCSKDSA-N 1 2 302.443 4.587 20 0 DJADLO C[C@H]1CC[N@@H+](Cc2csc(C3CC3)n2)[C@@H](c2ccco2)C1 ZINC000245699595 341310465 /nfs/dbraw/zinc/31/04/65/341310465.db2.gz YXYZLHCVZADKOM-SWLSCSKDSA-N 1 2 302.443 4.587 20 0 DJADLO Cc1cc([C@@H](C)[NH2+]Cc2ccccc2Oc2ccc(C)cc2)no1 ZINC000550886587 341325634 /nfs/dbraw/zinc/32/56/34/341325634.db2.gz IGUVEAQEAYUCAA-MRXNPFEDSA-N 1 2 322.408 4.935 20 0 DJADLO Cc1cc([C@@H](C)[NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)no1 ZINC000550932906 341327185 /nfs/dbraw/zinc/32/71/85/341327185.db2.gz XOEKJHFDEHYQAH-KUHUBIRLSA-N 1 2 310.372 4.562 20 0 DJADLO Cc1cc([C@@H](C)[NH2+][C@H](c2ccccc2)c2ccc(F)cc2)no1 ZINC000550932902 341327219 /nfs/dbraw/zinc/32/72/19/341327219.db2.gz XOEKJHFDEHYQAH-AUUYWEPGSA-N 1 2 310.372 4.562 20 0 DJADLO C[C@@H]([NH2+]CC(C)(F)F)c1ccc(SCC(F)(F)F)cc1 ZINC000551241412 341335234 /nfs/dbraw/zinc/33/52/34/341335234.db2.gz KXBQUCHBGXNJQS-SECBINFHSA-N 1 2 313.335 4.647 20 0 DJADLO FCCCCC[N@@H+]1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000551387326 341340151 /nfs/dbraw/zinc/34/01/51/341340151.db2.gz DZIAQVYOEGTTJO-HNNXBMFYSA-N 1 2 320.235 4.507 20 0 DJADLO FCCCCC[N@H+]1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000551387326 341340152 /nfs/dbraw/zinc/34/01/52/341340152.db2.gz DZIAQVYOEGTTJO-HNNXBMFYSA-N 1 2 320.235 4.507 20 0 DJADLO CCOc1cc(N[C@H](c2[nH]cc[nH+]2)C2CCCCC2)ccc1C ZINC000552262467 341382239 /nfs/dbraw/zinc/38/22/39/341382239.db2.gz XNOBJAKOETUHQJ-SFHVURJKSA-N 1 2 313.445 4.850 20 0 DJADLO CCCCCOc1cc(C)ccc1C[NH2+][C@H](C)c1nccs1 ZINC000091735828 341427942 /nfs/dbraw/zinc/42/79/42/341427942.db2.gz JMSRSWDEPJVXFF-OAHLLOKOSA-N 1 2 318.486 4.871 20 0 DJADLO C[C@H]([NH2+]Cc1ccc(-c2ccccc2)cc1F)c1cscn1 ZINC000555608084 341486798 /nfs/dbraw/zinc/48/67/98/341486798.db2.gz ZAWZEKBMUJZNMC-ZDUSSCGKSA-N 1 2 312.413 4.800 20 0 DJADLO Fc1cccc(C2([NH2+]Cc3csc(-c4ccccc4)n3)CC2)c1 ZINC000152871515 341509525 /nfs/dbraw/zinc/50/95/25/341509525.db2.gz DTWMLPSBNOLWIM-UHFFFAOYSA-N 1 2 324.424 4.728 20 0 DJADLO C[C@@H]([NH2+]Cc1ccc(Cl)c(C(F)(F)F)c1)c1cscn1 ZINC000566499971 341560124 /nfs/dbraw/zinc/56/01/24/341560124.db2.gz BYKOYYUXQIOORE-MRVPVSSYSA-N 1 2 320.767 4.666 20 0 DJADLO COC[C@H]([NH2+][C@H](C)c1cc(Cl)ccc1Cl)c1ccco1 ZINC000156713683 341625517 /nfs/dbraw/zinc/62/55/17/341625517.db2.gz RDABRRRVPCKLRI-YGRLFVJLSA-N 1 2 314.212 4.625 20 0 DJADLO Cc1nnc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)c(Cl)c2)s1 ZINC000273679236 341637037 /nfs/dbraw/zinc/63/70/37/341637037.db2.gz JYUZVMPNXKAZSE-SFYZADRCSA-N 1 2 316.257 4.565 20 0 DJADLO C[C@@H]([NH2+]Cc1ccccc1OC1CC1)c1c(F)cccc1Cl ZINC000568445159 341671481 /nfs/dbraw/zinc/67/14/81/341671481.db2.gz QCEQTLSJSJIGRF-GFCCVEGCSA-N 1 2 319.807 4.871 20 0 DJADLO CC(C)Oc1ccccc1[C@H](C)[NH2+]Cc1cc(C(C)(C)C)on1 ZINC000576742973 341860999 /nfs/dbraw/zinc/86/09/99/341860999.db2.gz BSWXSCHIJZNIBV-AWEZNQCLSA-N 1 2 316.445 4.610 20 0 DJADLO CC1(CC(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)CCCC1 ZINC000577415388 341908924 /nfs/dbraw/zinc/90/89/24/341908924.db2.gz CEYRLESIGUOIEP-UHFFFAOYSA-N 1 2 310.397 4.783 20 0 DJADLO C[C@H]([NH2+]Cc1coc(-c2cccs2)n1)c1cc(F)ccc1F ZINC000171974625 518183383 /nfs/dbraw/zinc/18/33/83/518183383.db2.gz RGYNALGGOYUQFD-JTQLQIEISA-N 1 2 320.364 4.532 20 0 DJADLO CC(C)c1nnc(C[N@H+](Cc2ccc3ccccc3c2)C2CC2)o1 ZINC000339294049 519885867 /nfs/dbraw/zinc/88/58/67/519885867.db2.gz SAHLXVUBFDJVKV-UHFFFAOYSA-N 1 2 321.424 4.511 20 0 DJADLO CC(C)c1nnc(C[N@@H+](Cc2ccc3ccccc3c2)C2CC2)o1 ZINC000339294049 519885869 /nfs/dbraw/zinc/88/58/69/519885869.db2.gz SAHLXVUBFDJVKV-UHFFFAOYSA-N 1 2 321.424 4.511 20 0 DJADLO CCC[C@@H]([NH2+]Cc1nc([C@@H](C)SCC)no1)c1ccccc1 ZINC000181762919 520781519 /nfs/dbraw/zinc/78/15/19/520781519.db2.gz CXFDTFHHCFCIHI-UKRRQHHQSA-N 1 2 319.474 4.515 20 0 DJADLO CCCc1nc(C[NH2+][C@H](C)c2cc3ccccc3o2)cs1 ZINC000182628103 521517804 /nfs/dbraw/zinc/51/78/04/521517804.db2.gz RGPNGWZRSMKBLA-GFCCVEGCSA-N 1 2 300.427 4.693 20 0 DJADLO CCc1nc([C@H](C)[NH2+][C@@H](C)c2cc3ccccc3o2)cs1 ZINC000162415577 522453826 /nfs/dbraw/zinc/45/38/26/522453826.db2.gz DAXSOGSPWSACRU-RYUDHWBXSA-N 1 2 300.427 4.864 20 0 DJADLO CC[C@H]([NH2+]Cc1ccccc1F)c1nc(C(F)(F)F)cs1 ZINC000266596698 522654933 /nfs/dbraw/zinc/65/49/33/522654933.db2.gz BJCYEVLPPFFYNS-NSHDSACASA-N 1 2 318.339 4.542 20 0 DJADLO CCc1nnc(C[NH2+][C@@H](CCC(C)C)c2ccc(Cl)cc2)o1 ZINC000180024486 522745138 /nfs/dbraw/zinc/74/51/38/522745138.db2.gz ARQDWDUVQXPSCD-HNNXBMFYSA-N 1 2 321.852 4.553 20 0 DJADLO CC[C@H]([NH2+][C@H](C)c1noc(-c2ccccc2)n1)c1ccccc1 ZINC000124300096 522745593 /nfs/dbraw/zinc/74/55/93/522745593.db2.gz DIEZWMGCOXCMPE-PBHICJAKSA-N 1 2 307.397 4.539 20 0 DJADLO CO[C@@H](C)c1nc(C[N@@H+]2CCCCC[C@@H]2c2ccco2)cs1 ZINC000267085937 523470097 /nfs/dbraw/zinc/47/00/97/523470097.db2.gz ZMWGFMPFTPKBJM-DZGCQCFKSA-N 1 2 320.458 4.561 20 0 DJADLO CO[C@@H](C)c1nc(C[N@H+]2CCCCC[C@@H]2c2ccco2)cs1 ZINC000267085937 523470106 /nfs/dbraw/zinc/47/01/06/523470106.db2.gz ZMWGFMPFTPKBJM-DZGCQCFKSA-N 1 2 320.458 4.561 20 0 DJADLO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1cc(-c2ccccc2)on1 ZINC000161551736 523858966 /nfs/dbraw/zinc/85/89/66/523858966.db2.gz PMPGXXSYQDUMTJ-HNNXBMFYSA-N 1 2 322.408 4.509 20 0 DJADLO COc1ccccc1[C@@H](C)[NH2+][C@H](C)c1ncc(-c2ccccc2)o1 ZINC000266519929 524726384 /nfs/dbraw/zinc/72/63/84/524726384.db2.gz ZJFZPBMEMPKYKS-HUUCEWRRSA-N 1 2 322.408 4.762 20 0 DJADLO C[C@H]([NH2+]Cc1ccc(C(C)(C)C)cc1)c1nc(C(C)(C)C)no1 ZINC000237588882 525436009 /nfs/dbraw/zinc/43/60/09/525436009.db2.gz OSKCZEPPTDWLKK-ZDUSSCGKSA-N 1 2 315.461 4.515 20 0 DJADLO C[C@H]([NH2+]Cc1csc(C2CCCCC2)n1)c1cccc(O)c1 ZINC000181553356 525483602 /nfs/dbraw/zinc/48/36/02/525483602.db2.gz YXYYDWRFLIDGJL-ZDUSSCGKSA-N 1 2 316.470 4.747 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1nc(C2CCCCC2)no1)c1ccccc1F ZINC000185233913 525622061 /nfs/dbraw/zinc/62/20/61/525622061.db2.gz HUIURNNJMBTZLC-OLZOCXBDSA-N 1 2 317.408 4.668 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1cscn1)c1ccc(Cl)cc1Cl ZINC000162309982 525622398 /nfs/dbraw/zinc/62/23/98/525622398.db2.gz LVLHPLRMLKCTJL-BDAKNGLRSA-N 1 2 301.242 4.862 20 0 DJADLO C[C@H](Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)c1nccs1 ZINC000182883262 525645918 /nfs/dbraw/zinc/64/59/18/525645918.db2.gz NMPXSUFAVIECRZ-ZDUSSCGKSA-N 1 2 324.453 4.516 20 0 DJADLO C[C@@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1cc(F)cc(F)c1 ZINC000154631520 525671140 /nfs/dbraw/zinc/67/11/40/525671140.db2.gz XRMKPBUURSHEHO-JLTOFOAXSA-N 1 2 324.374 4.800 20 0 DJADLO COc1ccc2oc([C@@H](C)[NH2+][C@H](C)c3cscn3)c(C)c2c1 ZINC000271189723 525690184 /nfs/dbraw/zinc/69/01/84/525690184.db2.gz XKDCQIHARDRNAQ-VXGBXAGGSA-N 1 2 316.426 4.618 20 0 DJADLO C[C@@H](Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)c1nccs1 ZINC000182883281 525701417 /nfs/dbraw/zinc/70/14/17/525701417.db2.gz NMPXSUFAVIECRZ-CYBMUJFWSA-N 1 2 324.453 4.516 20 0 DJADLO Cc1c[nH]c(-c2ccccc2NC(=O)C[C@@H](C)c2ccccc2)[nH+]1 ZINC000366354210 525963216 /nfs/dbraw/zinc/96/32/16/525963216.db2.gz GNNQLBXVWDIPIR-CQSZACIVSA-N 1 2 319.408 4.517 20 0 DJADLO Cc1c[nH+]ccc1NC(=O)c1occc1CSc1ccccc1 ZINC000107293086 526241787 /nfs/dbraw/zinc/24/17/87/526241787.db2.gz RPYWQPAOYMKYCI-UHFFFAOYSA-N 1 2 324.405 4.528 20 0 DJADLO Cc1csc(C[NH2+]C2(c3ccc(Cl)c(Cl)c3)CC2)n1 ZINC000265305672 526355917 /nfs/dbraw/zinc/35/59/17/526355917.db2.gz HHQNHVGRJSYZER-UHFFFAOYSA-N 1 2 313.253 4.537 20 0 DJADLO c1cc(-c2ccccc2)oc1C[NH2+]Cc1nc(C2CC2)cs1 ZINC000131214341 526412962 /nfs/dbraw/zinc/41/29/62/526412962.db2.gz LSQTUVLISDMELO-UHFFFAOYSA-N 1 2 310.422 4.570 20 0 DJADLO Cc1scc(C(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)c1C ZINC000179887004 526907623 /nfs/dbraw/zinc/90/76/23/526907623.db2.gz BYEYKRSCWSZKME-UHFFFAOYSA-N 1 2 324.405 4.805 20 0 DJADLO Cc1sccc1CNc1ccc(-c2cn3c([nH+]2)CCCC3)cc1 ZINC000339301783 526921980 /nfs/dbraw/zinc/92/19/80/526921980.db2.gz JJGVYIAURRHVNF-UHFFFAOYSA-N 1 2 323.465 4.868 20 0 DJADLO CCCC[C@H](CC)CC(=O)N1CCCC[C@@H]1c1[nH+]ccn1CC ZINC000366646706 534992899 /nfs/dbraw/zinc/99/28/99/534992899.db2.gz HTMLJJOISLMBND-DLBZAZTESA-N 1 2 319.493 4.563 20 0 DJADLO CCSc1cc(Cl)ccc1C(=O)Nc1cc[nH+]cc1CC ZINC000274112008 535733002 /nfs/dbraw/zinc/73/30/02/535733002.db2.gz YPIWRINMESEMGL-UHFFFAOYSA-N 1 2 320.845 4.662 20 0 DJADLO CCn1ccnc1[C@@H](C)[NH2+][C@H](c1ccc(F)cc1F)C(C)(C)C ZINC000297588791 536117290 /nfs/dbraw/zinc/11/72/90/536117290.db2.gz HMVIIJOUDGJXCB-MLGOLLRUSA-N 1 2 321.415 4.619 20 0 DJADLO CC(C)c1noc([C@H](C)[NH2+][C@H](C)c2cccc3ccccc32)n1 ZINC000079287821 185163432 /nfs/dbraw/zinc/16/34/32/185163432.db2.gz JSYWHFIYVUBJST-KGLIPLIRSA-N 1 2 309.413 4.758 20 0 DJADLO CC(C)c1nc([C@H](C)[NH2+][C@H]2CCOc3ccc(F)cc32)cs1 ZINC000090048814 185279742 /nfs/dbraw/zinc/27/97/42/185279742.db2.gz CGLVFQVJRCRZAY-FZMZJTMJSA-N 1 2 320.433 4.580 20 0 DJADLO CC(C)c1nc([C@H](C)[NH2+][C@@H](C)c2ccc(F)cc2F)cs1 ZINC000090049734 185279914 /nfs/dbraw/zinc/27/99/14/185279914.db2.gz QTYHQLBNZNDBLI-QWRGUYRKSA-N 1 2 310.413 4.957 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1Cl)c1cccnc1Cl ZINC000090180393 185285440 /nfs/dbraw/zinc/28/54/40/185285440.db2.gz YGTREMOLNCKCLD-ZJUUUORDSA-N 1 2 313.203 4.939 20 0 DJADLO COc1ccccc1[C@H]([NH2+][C@H](C)c1ccc(C)o1)c1ccco1 ZINC000090534408 185301288 /nfs/dbraw/zinc/30/12/88/185301288.db2.gz RNRMVDCFHMIVDQ-KUHUBIRLSA-N 1 2 311.381 4.630 20 0 DJADLO Fc1cc(F)c(C[NH2+]Cc2c(Cl)cccc2Cl)cc1F ZINC000563726438 334955593 /nfs/dbraw/zinc/95/55/93/334955593.db2.gz ZWTSRJMGWHTILP-UHFFFAOYSA-N 1 2 320.141 4.701 20 0 DJADLO CC(C)n1ccc(C[NH2+][C@H](C)c2ccc(Cl)cc2Cl)n1 ZINC000083683249 192377808 /nfs/dbraw/zinc/37/78/08/192377808.db2.gz GBNIAXHLSKWRDN-LLVKDONJSA-N 1 2 312.244 4.622 20 0 DJADLO Cc1csc(C(C)(C)[NH2+]Cc2csc(C3CCCC3)n2)n1 ZINC000072663047 191210242 /nfs/dbraw/zinc/21/02/42/191210242.db2.gz YEZMVLZUAHTZPU-UHFFFAOYSA-N 1 2 321.515 4.591 20 0 DJADLO CC(C)n1cc[nH+]c1CNc1ccc(COc2ccccc2)cc1 ZINC000090997345 192969711 /nfs/dbraw/zinc/96/97/11/192969711.db2.gz QYRMDPPUFMIWKN-UHFFFAOYSA-N 1 2 321.424 4.655 20 0 DJADLO Cc1ccc(OCCCn2c[nH+]c3cc(C)c(C)cc32)cc1C ZINC000040224093 183047159 /nfs/dbraw/zinc/04/71/59/183047159.db2.gz YPXKUFHBBARWIB-UHFFFAOYSA-N 1 2 308.425 4.739 20 0 DJADLO CCCc1csc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)n1 ZINC000426036677 335042680 /nfs/dbraw/zinc/04/26/80/335042680.db2.gz OXEAAIRYJJNSNZ-INIZCTEOSA-N 1 2 304.434 4.572 20 0 DJADLO CCCc1csc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)n1 ZINC000426036677 335042681 /nfs/dbraw/zinc/04/26/81/335042681.db2.gz OXEAAIRYJJNSNZ-INIZCTEOSA-N 1 2 304.434 4.572 20 0 DJADLO Cc1cnc([C@@H](C)[NH2+]Cc2csc(C3CCCCC3)n2)s1 ZINC000273270057 130102848 /nfs/dbraw/zinc/10/28/48/130102848.db2.gz GGDWBLYPQQGTLU-GFCCVEGCSA-N 1 2 321.515 4.807 20 0 DJADLO Cc1ccc(C)c([C@@H]2CCCN2C(=O)Nc2c(C)cc[nH+]c2C)c1 ZINC000287405489 131278896 /nfs/dbraw/zinc/27/88/96/131278896.db2.gz DXEDOZZRVGUZKF-SFHVURJKSA-N 1 2 323.440 4.684 20 0 DJADLO c1c[nH]c([C@H]2CCC[N@H+]2Cc2csc(-c3cccs3)n2)c1 ZINC000298769680 132077031 /nfs/dbraw/zinc/07/70/31/132077031.db2.gz NXBFOJZPXVZBNQ-CQSZACIVSA-N 1 2 315.467 4.537 20 0 DJADLO c1c[nH]c([C@H]2CCC[N@@H+]2Cc2csc(-c3cccs3)n2)c1 ZINC000298769680 132077032 /nfs/dbraw/zinc/07/70/32/132077032.db2.gz NXBFOJZPXVZBNQ-CQSZACIVSA-N 1 2 315.467 4.537 20 0 DJADLO Cc1nc(C[N@@H+](C)[C@H](C)c2ccc(C(F)(F)F)cc2)oc1C ZINC000299353004 132100671 /nfs/dbraw/zinc/10/06/71/132100671.db2.gz HJUIIHLDPJUOIR-LLVKDONJSA-N 1 2 312.335 4.503 20 0 DJADLO Cc1nc(C[N@H+](C)[C@H](C)c2ccc(C(F)(F)F)cc2)oc1C ZINC000299353004 132100672 /nfs/dbraw/zinc/10/06/72/132100672.db2.gz HJUIIHLDPJUOIR-LLVKDONJSA-N 1 2 312.335 4.503 20 0 DJADLO Cc1nc(C[N@@H+](C)[C@H](C)c2cccc(C(F)(F)F)c2)oc1C ZINC000299410958 132103940 /nfs/dbraw/zinc/10/39/40/132103940.db2.gz ZUIPFOCRIKRYQC-LLVKDONJSA-N 1 2 312.335 4.503 20 0 DJADLO Cc1nc(C[N@H+](C)[C@H](C)c2cccc(C(F)(F)F)c2)oc1C ZINC000299410958 132103941 /nfs/dbraw/zinc/10/39/41/132103941.db2.gz ZUIPFOCRIKRYQC-LLVKDONJSA-N 1 2 312.335 4.503 20 0 DJADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2csc(C)n2)o1 ZINC000340691973 132158410 /nfs/dbraw/zinc/15/84/10/132158410.db2.gz URWWIGKVQHJYHQ-LRDDRELGSA-N 1 2 304.459 4.580 20 0 DJADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2csc(C)n2)o1 ZINC000340691973 132158411 /nfs/dbraw/zinc/15/84/11/132158411.db2.gz URWWIGKVQHJYHQ-LRDDRELGSA-N 1 2 304.459 4.580 20 0 DJADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CC[C@](F)(c2ccccc2)C1 ZINC000563861671 335068693 /nfs/dbraw/zinc/06/86/93/335068693.db2.gz PCOSRDTVEYPXMB-AUUYWEPGSA-N 1 2 316.420 4.604 20 0 DJADLO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1CC[C@](F)(c2ccccc2)C1 ZINC000563861671 335068694 /nfs/dbraw/zinc/06/86/94/335068694.db2.gz PCOSRDTVEYPXMB-AUUYWEPGSA-N 1 2 316.420 4.604 20 0 DJADLO CSc1ccc(F)cc1CNc1cc(C(F)(F)F)cc[nH+]1 ZINC000530930682 331636681 /nfs/dbraw/zinc/63/66/81/331636681.db2.gz LFHNVLGNQUGDON-UHFFFAOYSA-N 1 2 316.323 4.574 20 0 DJADLO CC[C@@H]([NH2+]Cc1cc(Cl)sc1Cl)c1ccc(F)cn1 ZINC000312771290 331734002 /nfs/dbraw/zinc/73/40/02/331734002.db2.gz RTZDTFOHAWVFSA-SNVBAGLBSA-N 1 2 319.232 4.830 20 0 DJADLO CC[C@H]([NH2+]Cc1cc(Cl)sc1Cl)c1ccc(F)cn1 ZINC000312771283 331734015 /nfs/dbraw/zinc/73/40/15/331734015.db2.gz RTZDTFOHAWVFSA-JTQLQIEISA-N 1 2 319.232 4.830 20 0 DJADLO Cc1nc(C[NH2+][C@@H](CCC(C)C)c2ccoc2)nc2ccccc12 ZINC000556874164 331746197 /nfs/dbraw/zinc/74/61/97/331746197.db2.gz XUWJBGDCWOQPCJ-SFHVURJKSA-N 1 2 323.440 4.798 20 0 DJADLO Cc1csc([C@@H](C)[NH2+]Cc2cc(Cl)ccc2Cl)n1 ZINC000087759449 331791728 /nfs/dbraw/zinc/79/17/28/331791728.db2.gz GXWDEVREXRIGLQ-SECBINFHSA-N 1 2 301.242 4.609 20 0 DJADLO C[C@@H]([NH2+]Cc1cccc(SCc2ccccc2)c1)c1ccon1 ZINC000558116825 331877501 /nfs/dbraw/zinc/87/75/01/331877501.db2.gz LLCNGGSKUSVUEM-OAHLLOKOSA-N 1 2 324.449 4.818 20 0 DJADLO Cc1csc([C@H](C)[NH2+]Cc2cc(Cl)ccc2Cl)n1 ZINC000087759450 332036974 /nfs/dbraw/zinc/03/69/74/332036974.db2.gz GXWDEVREXRIGLQ-VIFPVBQESA-N 1 2 301.242 4.609 20 0 DJADLO CCCCc1[nH]c2ccc(NC(=O)c3ccoc3C3CC3)cc2[nH+]1 ZINC000409562857 332038682 /nfs/dbraw/zinc/03/86/82/332038682.db2.gz SWSLJORTRJNTAJ-UHFFFAOYSA-N 1 2 323.396 4.628 20 0 DJADLO CC(C)(C)c1[nH]c2ccc(NC(=O)c3ccoc3C3CC3)cc2[nH+]1 ZINC000409645227 332043343 /nfs/dbraw/zinc/04/33/43/332043343.db2.gz PCKPKQJQPNJXLK-UHFFFAOYSA-N 1 2 323.396 4.583 20 0 DJADLO C[C@H](SCCn1cc[nH+]c1)c1ccc(Cl)cc1Cl ZINC000536373039 332234645 /nfs/dbraw/zinc/23/46/45/332234645.db2.gz AHAUUGVLODLDGB-JTQLQIEISA-N 1 2 301.242 4.684 20 0 DJADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+](C)Cc1ccc(Cl)c(F)c1 ZINC000536486529 332252149 /nfs/dbraw/zinc/25/21/49/332252149.db2.gz SDUGANZHKDFWDD-NSHDSACASA-N 1 2 324.827 4.958 20 0 DJADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@@H+](C)Cc1ccc(Cl)c(F)c1 ZINC000536486529 332252151 /nfs/dbraw/zinc/25/21/51/332252151.db2.gz SDUGANZHKDFWDD-NSHDSACASA-N 1 2 324.827 4.958 20 0 DJADLO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1csc(Cl)c1Cl)CO2 ZINC000555762228 332265627 /nfs/dbraw/zinc/26/56/27/332265627.db2.gz LDEUJBPNBROUTQ-NSHDSACASA-N 1 2 314.237 4.587 20 0 DJADLO Cc1cc([C@H](C)[NH2+]Cc2ccccc2Oc2cccc(C)c2)no1 ZINC000559892283 332290265 /nfs/dbraw/zinc/29/02/65/332290265.db2.gz CVPLSYZYDPEPTK-INIZCTEOSA-N 1 2 322.408 4.935 20 0 DJADLO CCCCc1ccc(CC(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC000097213862 332334317 /nfs/dbraw/zinc/33/43/17/332334317.db2.gz BHCJDXWAJWWCNO-UHFFFAOYSA-N 1 2 310.441 4.531 20 0 DJADLO Cc1cnc(C[N@@H+](C)[C@H](C)c2ccc(Cl)c(Cl)c2)s1 ZINC000560840768 332389561 /nfs/dbraw/zinc/38/95/61/332389561.db2.gz GHGCIEJOAPRERF-SNVBAGLBSA-N 1 2 315.269 4.951 20 0 DJADLO Cc1cnc(C[N@H+](C)[C@H](C)c2ccc(Cl)c(Cl)c2)s1 ZINC000560840768 332389563 /nfs/dbraw/zinc/38/95/63/332389563.db2.gz GHGCIEJOAPRERF-SNVBAGLBSA-N 1 2 315.269 4.951 20 0 DJADLO Cc1cnc([C@H](C)[NH2+][C@H](C)c2cccc(Cl)c2Cl)cn1 ZINC000427818157 332526064 /nfs/dbraw/zinc/52/60/64/332526064.db2.gz NWYLALQBSGAJJX-MNOVXSKESA-N 1 2 310.228 4.504 20 0 DJADLO C[C@@H]([NH2+]Cc1nc2ccccc2s1)c1c(F)cccc1Cl ZINC000181730716 333031657 /nfs/dbraw/zinc/03/16/57/333031657.db2.gz GOFDOZZGEYQYMC-SNVBAGLBSA-N 1 2 320.820 4.940 20 0 DJADLO Cc1oncc1C[N@@H+]1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000188848254 333057023 /nfs/dbraw/zinc/05/70/23/333057023.db2.gz ZFDPCCAJMCJNET-OAHLLOKOSA-N 1 2 311.212 4.627 20 0 DJADLO Cc1oncc1C[N@H+]1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000188848254 333057024 /nfs/dbraw/zinc/05/70/24/333057024.db2.gz ZFDPCCAJMCJNET-OAHLLOKOSA-N 1 2 311.212 4.627 20 0 DJADLO Cc1[nH]c2ccc(CSc3ccc(C(F)(F)F)cn3)cc2[nH+]1 ZINC000460438009 333087237 /nfs/dbraw/zinc/08/72/37/333087237.db2.gz QPFNXEKUFYNOFR-UHFFFAOYSA-N 1 2 323.343 4.577 20 0 DJADLO Cc1[nH]c2cc(CSc3ccc(C(F)(F)F)cn3)ccc2[nH+]1 ZINC000460438009 333087238 /nfs/dbraw/zinc/08/72/38/333087238.db2.gz QPFNXEKUFYNOFR-UHFFFAOYSA-N 1 2 323.343 4.577 20 0 DJADLO C[C@@H]1C[C@@H](Nc2cc(Cl)cc(C(F)(F)F)c2)c2[nH+]ccn21 ZINC000379034917 333097128 /nfs/dbraw/zinc/09/71/28/333097128.db2.gz YUYZZKJVSBTQKR-PRHODGIISA-N 1 2 315.726 4.673 20 0 DJADLO C[C@H]([NH2+]Cc1nc(C(F)(F)F)cs1)c1ccccc1Cl ZINC000177362124 333127858 /nfs/dbraw/zinc/12/78/58/333127858.db2.gz QSGPPDVFLLCOLD-QMMMGPOBSA-N 1 2 320.767 4.666 20 0 DJADLO FC(F)(F)Cn1cc[nH+]c1CSCc1ccccc1Cl ZINC000525725889 333193798 /nfs/dbraw/zinc/19/37/98/333193798.db2.gz NKNJRFWCPYKURU-UHFFFAOYSA-N 1 2 320.767 4.532 20 0 DJADLO CCc1cnccc1[C@@H](C)[NH2+][C@H](CCc1ccccc1)C(F)F ZINC000498764062 333252634 /nfs/dbraw/zinc/25/26/34/333252634.db2.gz JLTWRFBDKHTWNZ-RDTXWAMCSA-N 1 2 318.411 4.561 20 0 DJADLO C[C@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1ccccc1F ZINC000119585980 333255542 /nfs/dbraw/zinc/25/55/42/333255542.db2.gz PPIWRINQWWAJNZ-MGPUTAFESA-N 1 2 306.384 4.661 20 0 DJADLO C[C@H](c1ccc(F)c(Cl)c1)[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000497590089 333266344 /nfs/dbraw/zinc/26/63/44/333266344.db2.gz AABFTXYIFCXJNA-FZKQIMNGSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@H](c1ccc(F)c(Cl)c1)[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000497590089 333266346 /nfs/dbraw/zinc/26/63/46/333266346.db2.gz AABFTXYIFCXJNA-FZKQIMNGSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@H](c1ccc(Cl)cc1)[N@@H+]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000497590736 333266522 /nfs/dbraw/zinc/26/65/22/333266522.db2.gz MVCGJMCUVSLJQW-ACJLOTCBSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@H](c1ccc(Cl)cc1)[N@H+]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000497590736 333266523 /nfs/dbraw/zinc/26/65/23/333266523.db2.gz MVCGJMCUVSLJQW-ACJLOTCBSA-N 1 2 319.807 4.614 20 0 DJADLO Cc1nc([C@@H](C)[N@@H+]2CC[C@](C)(F)C2)oc1-c1ccc(Cl)cc1 ZINC000501422735 333273416 /nfs/dbraw/zinc/27/34/16/333273416.db2.gz NJCACWOSCGRVDD-PXAZEXFGSA-N 1 2 322.811 4.798 20 0 DJADLO Cc1nc([C@@H](C)[N@H+]2CC[C@](C)(F)C2)oc1-c1ccc(Cl)cc1 ZINC000501422735 333273418 /nfs/dbraw/zinc/27/34/18/333273418.db2.gz NJCACWOSCGRVDD-PXAZEXFGSA-N 1 2 322.811 4.798 20 0 DJADLO CC[C@@H]([NH2+][C@H](C)c1nc2c(s1)CCC2)c1cc(F)ccc1F ZINC000502057911 333284537 /nfs/dbraw/zinc/28/45/37/333284537.db2.gz NRRRJVWQQLIWID-QMTHXVAHSA-N 1 2 322.424 4.712 20 0 DJADLO C[N@H+](Cc1nc2ccccc2s1)Cc1sccc1Cl ZINC000495089184 333352281 /nfs/dbraw/zinc/35/22/81/333352281.db2.gz XKQPBRDKYYRXJK-UHFFFAOYSA-N 1 2 308.859 4.643 20 0 DJADLO C[N@@H+](Cc1nc2ccccc2s1)Cc1sccc1Cl ZINC000495089184 333352282 /nfs/dbraw/zinc/35/22/82/333352282.db2.gz XKQPBRDKYYRXJK-UHFFFAOYSA-N 1 2 308.859 4.643 20 0 DJADLO CCc1nc(C[N@@H+]2CCCC[C@H]2c2ccc(F)cc2)cs1 ZINC000531449115 333354332 /nfs/dbraw/zinc/35/43/32/333354332.db2.gz YHTFWGGKPKPPNZ-INIZCTEOSA-N 1 2 304.434 4.572 20 0 DJADLO CCc1nc(C[N@H+]2CCCC[C@H]2c2ccc(F)cc2)cs1 ZINC000531449115 333354333 /nfs/dbraw/zinc/35/43/33/333354333.db2.gz YHTFWGGKPKPPNZ-INIZCTEOSA-N 1 2 304.434 4.572 20 0 DJADLO Cc1oc(-c2ccccc2)c(C(=O)Nc2cc[nH+]c(C)c2)c1C ZINC000186853544 333380191 /nfs/dbraw/zinc/38/01/91/333380191.db2.gz HNKXSYNMQKOLQF-UHFFFAOYSA-N 1 2 306.365 4.519 20 0 DJADLO Cc1cc(Cn2c[nH+]c3cc(C)c(C)cc32)c2ccccc2n1 ZINC000391350047 333454616 /nfs/dbraw/zinc/45/46/16/333454616.db2.gz KYNGYRQWLIOIPZ-UHFFFAOYSA-N 1 2 301.393 4.558 20 0 DJADLO COc1ccccc1C[NH2+]C1(c2c(Cl)cccc2Cl)CC1 ZINC000531848131 333576500 /nfs/dbraw/zinc/57/65/00/333576500.db2.gz FMLKHQKTJQEIMW-UHFFFAOYSA-N 1 2 322.235 4.781 20 0 DJADLO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2cc(Cl)cc(Cl)c2)s1 ZINC000274270002 334058699 /nfs/dbraw/zinc/05/86/99/334058699.db2.gz WNQQOAPORKCBHW-JGVFFNPUSA-N 1 2 316.257 4.565 20 0 DJADLO C[C@@H]1CC[N@H+](Cc2nc(C3CC3)cs2)[C@H](c2ccco2)C1 ZINC000343597771 335175765 /nfs/dbraw/zinc/17/57/65/335175765.db2.gz DEAOLWOMTXHEGW-DOMZBBRYSA-N 1 2 302.443 4.587 20 0 DJADLO C[C@@H]1CC[N@@H+](Cc2nc(C3CC3)cs2)[C@H](c2ccco2)C1 ZINC000343597771 335175767 /nfs/dbraw/zinc/17/57/67/335175767.db2.gz DEAOLWOMTXHEGW-DOMZBBRYSA-N 1 2 302.443 4.587 20 0 DJADLO CC[C@H]([NH2+][C@H](C)c1noc(-c2ccccc2)n1)c1ccsc1 ZINC000296686042 334235913 /nfs/dbraw/zinc/23/59/13/334235913.db2.gz GVXRHCHHELQQHB-DOMZBBRYSA-N 1 2 313.426 4.600 20 0 DJADLO Cn1cc[nH+]c1-c1cccc(N[C@@H]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000187557769 334264897 /nfs/dbraw/zinc/26/48/97/334264897.db2.gz MYAWWANXISQWGD-DZGCQCFKSA-N 1 2 323.362 4.620 20 0 DJADLO Cn1cc[nH+]c1-c1cccc(N[C@H]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000187557830 334264950 /nfs/dbraw/zinc/26/49/50/334264950.db2.gz MYAWWANXISQWGD-HIFRSBDPSA-N 1 2 323.362 4.620 20 0 DJADLO CC[C@@H]1c2ccsc2CC[N@H+]1Cc1nc(C)c2ccccc2n1 ZINC000303336949 334312344 /nfs/dbraw/zinc/31/23/44/334312344.db2.gz XPMIFSANFVNECB-QGZVFWFLSA-N 1 2 323.465 4.509 20 0 DJADLO CC[C@@H]1c2ccsc2CC[N@@H+]1Cc1nc(C)c2ccccc2n1 ZINC000303336949 334312345 /nfs/dbraw/zinc/31/23/45/334312345.db2.gz XPMIFSANFVNECB-QGZVFWFLSA-N 1 2 323.465 4.509 20 0 DJADLO C[C@@H](c1cccc(Cl)c1)[N@H+](C)Cc1csc(C2CC2)n1 ZINC000534689547 334330764 /nfs/dbraw/zinc/33/07/64/334330764.db2.gz BCEDNRNWWFIRPI-NSHDSACASA-N 1 2 306.862 4.867 20 0 DJADLO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)Cc1csc(C2CC2)n1 ZINC000534689547 334330765 /nfs/dbraw/zinc/33/07/65/334330765.db2.gz BCEDNRNWWFIRPI-NSHDSACASA-N 1 2 306.862 4.867 20 0 DJADLO c1nc(C[NH+](Cc2ccccc2)Cc2ccccc2)oc1C1CC1 ZINC000534811203 334338119 /nfs/dbraw/zinc/33/81/19/334338119.db2.gz NXJHRNANOJTZSW-UHFFFAOYSA-N 1 2 318.420 4.754 20 0 DJADLO Clc1ccc(C[N@@H+]2CCC[C@@H]2c2ccncc2)cc1Cl ZINC000534939758 334349706 /nfs/dbraw/zinc/34/97/06/334349706.db2.gz INEDSYZNYZIKQH-MRXNPFEDSA-N 1 2 307.224 4.726 20 0 DJADLO Clc1ccc(C[N@H+]2CCC[C@@H]2c2ccncc2)cc1Cl ZINC000534939758 334349707 /nfs/dbraw/zinc/34/97/07/334349707.db2.gz INEDSYZNYZIKQH-MRXNPFEDSA-N 1 2 307.224 4.726 20 0 DJADLO CCC[C@@H](Nc1ccc(N2CCCC2)[nH+]c1)c1ccsc1 ZINC000443096299 338444236 /nfs/dbraw/zinc/44/42/36/338444236.db2.gz RIXZRMULTZJZBL-MRXNPFEDSA-N 1 2 301.459 4.697 20 0 DJADLO Cc1ccc(CNc2cccc3c2CN(c2cccc[nH+]2)C3)cc1 ZINC000535251922 334382587 /nfs/dbraw/zinc/38/25/87/334382587.db2.gz LPHWQTGDALSYAF-UHFFFAOYSA-N 1 2 315.420 4.522 20 0 DJADLO CC[N@H+](Cc1ncc(-c2ccccc2C)o1)Cc1cccc(F)c1 ZINC000535259711 334383526 /nfs/dbraw/zinc/38/35/26/334383526.db2.gz DTWVKEUNGFYHIE-UHFFFAOYSA-N 1 2 324.399 4.811 20 0 DJADLO CC[N@@H+](Cc1ncc(-c2ccccc2C)o1)Cc1cccc(F)c1 ZINC000535259711 334383527 /nfs/dbraw/zinc/38/35/27/334383527.db2.gz DTWVKEUNGFYHIE-UHFFFAOYSA-N 1 2 324.399 4.811 20 0 DJADLO Cc1nc(C[NH2+][C@H](CC(F)(F)F)c2ccccc2)sc1C ZINC000341586858 334459083 /nfs/dbraw/zinc/45/90/83/334459083.db2.gz OBXCRDFAHBTVTF-CYBMUJFWSA-N 1 2 314.376 4.543 20 0 DJADLO CCC[C@@H]([NH2+]Cc1nccc(C)n1)c1ccc(Cl)c(Cl)c1 ZINC000341645505 334468277 /nfs/dbraw/zinc/46/82/77/334468277.db2.gz SYUWTVJZTGKDJS-OAHLLOKOSA-N 1 2 324.255 4.723 20 0 DJADLO Cc1nc(C[NH+]2CCC(=Cc3ccccc3F)CC2)c(C)s1 ZINC000443601250 338456318 /nfs/dbraw/zinc/45/63/18/338456318.db2.gz HLWDHKOTAXOZFG-UHFFFAOYSA-N 1 2 316.445 4.578 20 0 DJADLO C[C@@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1ccccc1Cl ZINC000093978008 335695983 /nfs/dbraw/zinc/69/59/83/335695983.db2.gz LZESAKXASZRFKS-LLVKDONJSA-N 1 2 308.878 4.945 20 0 DJADLO CC[C@H](NC(=O)Nc1c(C)cc[nH+]c1C)c1cccc(Cl)c1 ZINC000351935403 336181066 /nfs/dbraw/zinc/18/10/66/336181066.db2.gz HBWABAZTKRBDRY-HNNXBMFYSA-N 1 2 317.820 4.625 20 0 DJADLO CCc1ccc(N[C@H](c2[nH]cc[nH+]2)c2ccccc2)cc1CC ZINC000526118503 336203266 /nfs/dbraw/zinc/20/32/66/336203266.db2.gz ADYZMJIMOWQXMB-IBGZPJMESA-N 1 2 305.425 4.736 20 0 DJADLO Brc1ccc(CNc2ccc3ccccc3[nH+]2)cc1 ZINC000042316093 336238882 /nfs/dbraw/zinc/23/88/82/336238882.db2.gz PHXUEVDWFYGLCY-UHFFFAOYSA-N 1 2 313.198 4.609 20 0 DJADLO CCSc1ccc([C@@H](C)[NH2+][C@H](C)c2nc(C(C)C)no2)cc1 ZINC000103499707 336242053 /nfs/dbraw/zinc/24/20/53/336242053.db2.gz UWRRYGPGFGLYNB-CHWSQXEVSA-N 1 2 319.474 4.717 20 0 DJADLO CCSc1ccc([C@H](C)[NH2+][C@@H](C)c2nc(C(C)C)no2)cc1 ZINC000103499704 336242094 /nfs/dbraw/zinc/24/20/94/336242094.db2.gz UWRRYGPGFGLYNB-STQMWFEESA-N 1 2 319.474 4.717 20 0 DJADLO C[C@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1cc(F)ccc1F ZINC000324827667 336261017 /nfs/dbraw/zinc/26/10/17/336261017.db2.gz HJVISYRUAXTEHI-VBKZILBWSA-N 1 2 324.374 4.800 20 0 DJADLO Cc1c[nH]c(-c2ccccc2NC(=O)C[C@H]2CCCC[C@H]2C)[nH+]1 ZINC000532862003 336273344 /nfs/dbraw/zinc/27/33/44/336273344.db2.gz KBGWQDVLCLFYID-UKRRQHHQSA-N 1 2 311.429 4.540 20 0 DJADLO CCc1cnc(C[N@H+](C)C/C=C/c2ccc(Cl)cc2)s1 ZINC000527048434 336281082 /nfs/dbraw/zinc/28/10/82/336281082.db2.gz OJEOQIREULYQKD-SNAWJCMRSA-N 1 2 306.862 4.504 20 0 DJADLO CCc1cnc(C[N@@H+](C)C/C=C/c2ccc(Cl)cc2)s1 ZINC000527048434 336281083 /nfs/dbraw/zinc/28/10/83/336281083.db2.gz OJEOQIREULYQKD-SNAWJCMRSA-N 1 2 306.862 4.504 20 0 DJADLO CCc1nc(C[N@H+](C)C/C=C\c2ccc(Cl)cc2)cs1 ZINC000527050800 336281425 /nfs/dbraw/zinc/28/14/25/336281425.db2.gz INARXWVYRHKUSM-PLNGDYQASA-N 1 2 306.862 4.504 20 0 DJADLO CCc1nc(C[N@@H+](C)C/C=C\c2ccc(Cl)cc2)cs1 ZINC000527050800 336281426 /nfs/dbraw/zinc/28/14/26/336281426.db2.gz INARXWVYRHKUSM-PLNGDYQASA-N 1 2 306.862 4.504 20 0 DJADLO Cc1cc(NCc2csc(-c3ccccc3)n2)nc(C(C)C)[nH+]1 ZINC000301061632 336287936 /nfs/dbraw/zinc/28/79/36/336287936.db2.gz BVBDKFORXLHEGF-UHFFFAOYSA-N 1 2 324.453 4.644 20 0 DJADLO Cc1cc(N[C@H](C)c2ccccc2Cl)nc(-c2cccnc2)[nH+]1 ZINC000301070022 336288330 /nfs/dbraw/zinc/28/83/30/336288330.db2.gz BXPQKWKSIYQICF-CYBMUJFWSA-N 1 2 324.815 4.674 20 0 DJADLO Cc1cc(N[C@@H](c2ccccc2)C(C)C)nc(-c2cccnc2)[nH+]1 ZINC000301128508 336291357 /nfs/dbraw/zinc/29/13/57/336291357.db2.gz RZOQNOKGLSKFLW-LJQANCHMSA-N 1 2 318.424 4.656 20 0 DJADLO O[C@H](CNc1ccc2ccccc2[nH+]1)c1ccc2ccccc2c1 ZINC000301163156 336292823 /nfs/dbraw/zinc/29/28/23/336292823.db2.gz GGKQCTVTXHOVNI-HXUWFJFHSA-N 1 2 314.388 4.534 20 0 DJADLO c1csc([C@@H](Nc2ccc3ccccc3[nH+]2)c2ccccc2)n1 ZINC000301179428 336293626 /nfs/dbraw/zinc/29/36/26/336293626.db2.gz HHRDNHAVVMSJLP-SFHVURJKSA-N 1 2 317.417 4.893 20 0 DJADLO COc1ccc2oc([C@@H](C)Nc3cc[nH+]c(C4CC4)n3)c(C)c2c1 ZINC000301223189 336295514 /nfs/dbraw/zinc/29/55/14/336295514.db2.gz ACHKMADYHHIEFO-GFCCVEGCSA-N 1 2 323.396 4.590 20 0 DJADLO CC[C@@H](Nc1cc[nH+]c(C2CC2)n1)c1ccccc1OC(F)F ZINC000301232804 336295965 /nfs/dbraw/zinc/29/59/65/336295965.db2.gz BLLXKHKQKNXIEV-CYBMUJFWSA-N 1 2 319.355 4.519 20 0 DJADLO Cc1cc([C@@H](C)Nc2nc(-c3ccncc3)[nH+]c(C)c2C)c(C)o1 ZINC000301252899 336297018 /nfs/dbraw/zinc/29/70/18/336297018.db2.gz JSJSLQMGYPDKJY-CQSZACIVSA-N 1 2 322.412 4.538 20 0 DJADLO Cc1cc(N[C@@H](C)c2cccc(C)c2C)nc(-c2cccnc2)[nH+]1 ZINC000301266896 336297672 /nfs/dbraw/zinc/29/76/72/336297672.db2.gz GTMRYGBYNAITOW-INIZCTEOSA-N 1 2 318.424 4.637 20 0 DJADLO C[C@@H](Nc1cc[nH+]c(C(C)(C)C)n1)c1ccc(OC(F)F)cc1 ZINC000301461233 336308211 /nfs/dbraw/zinc/30/82/11/336308211.db2.gz ZJAOFHVMLFHFHG-LLVKDONJSA-N 1 2 321.371 4.549 20 0 DJADLO C[C@H](Nc1cc(C(F)(F)F)cc[nH+]1)c1ccc(F)cc1F ZINC000301501434 336310795 /nfs/dbraw/zinc/31/07/95/336310795.db2.gz BAQVUVBDRZLUSW-QMMMGPOBSA-N 1 2 302.246 4.552 20 0 DJADLO CCc1cc(N[C@H](CC)c2cccs2)nc(-c2ccncc2)[nH+]1 ZINC000301558186 336314853 /nfs/dbraw/zinc/31/48/53/336314853.db2.gz OBDDZTCPUZJEAN-OAHLLOKOSA-N 1 2 324.453 4.726 20 0 DJADLO Cc1cc(N[C@H](C)c2cccc(N3CCCC3)c2)nc(C(C)C)[nH+]1 ZINC000301585124 336316452 /nfs/dbraw/zinc/31/64/52/336316452.db2.gz VSJCHMNSHKLPAV-MRXNPFEDSA-N 1 2 324.472 4.682 20 0 DJADLO Fc1cccc([C@H](Nc2cc[nH+]c(C3CC3)n2)c2ccccc2)c1 ZINC000301601567 336317768 /nfs/dbraw/zinc/31/77/68/336317768.db2.gz JHUQMAHLFFSXMK-LJQANCHMSA-N 1 2 319.383 4.695 20 0 DJADLO FC(F)Oc1c(Cl)cc(Cl)cc1CNc1cccc[nH+]1 ZINC000301604442 336317820 /nfs/dbraw/zinc/31/78/20/336317820.db2.gz LVIMYESKOPIJPP-UHFFFAOYSA-N 1 2 319.138 4.602 20 0 DJADLO Cc1cc2ccccc2[nH+]c1N1C[C@@H](C)C[C@H]1c1cccnc1 ZINC000302124396 336349647 /nfs/dbraw/zinc/34/96/47/336349647.db2.gz HSOOLLABSZILCA-LIRRHRJNSA-N 1 2 303.409 4.526 20 0 DJADLO COc1ccc2[nH+]c(NCc3ccc(C(F)F)cc3)ccc2c1 ZINC000302171100 336352190 /nfs/dbraw/zinc/35/21/90/336352190.db2.gz MDPBLFRVRFWVDA-UHFFFAOYSA-N 1 2 314.335 4.793 20 0 DJADLO Clc1oc2ccccc2c1CN1CCCC[C@@H]1c1[nH]cc[nH+]1 ZINC000352899836 336375313 /nfs/dbraw/zinc/37/53/13/336375313.db2.gz SFAYSGXSIFHCOG-CQSZACIVSA-N 1 2 315.804 4.537 20 0 DJADLO CCC[C@@H]([NH2+][C@H](C)c1csc(C)n1)c1ccc(F)cc1F ZINC000360994674 336731503 /nfs/dbraw/zinc/73/15/03/336731503.db2.gz GGOAWPHMMRKQMF-MEBBXXQBSA-N 1 2 310.413 4.922 20 0 DJADLO Cc1nc([C@@H](C)[NH2+][C@@H]2CC(C)(C)Oc3cc(F)ccc32)cs1 ZINC000372059847 336920809 /nfs/dbraw/zinc/92/08/09/336920809.db2.gz BNQMVBNECUXHKS-QMTHXVAHSA-N 1 2 320.433 4.544 20 0 DJADLO COc1ccccc1[C@H](C)[NH2+][C@H](c1nccs1)c1ccccc1 ZINC000123179113 337038884 /nfs/dbraw/zinc/03/88/84/337038884.db2.gz GQLIVBAEYJBVOS-KSSFIOAISA-N 1 2 324.449 4.592 20 0 DJADLO Cc1ccc2c(c1)[C@H]([NH2+][C@@H](c1nccs1)c1ccccc1)CC2 ZINC000123269813 337041720 /nfs/dbraw/zinc/04/17/20/337041720.db2.gz DJZFQRGUYSFATJ-RTBURBONSA-N 1 2 320.461 4.818 20 0 DJADLO Cc1nc([C@@H](C)[NH2+][C@@H]2CCCOc3c(Cl)cccc32)cs1 ZINC000378449050 337073041 /nfs/dbraw/zinc/07/30/41/337073041.db2.gz FFFHOGDNTWMSOY-QMTHXVAHSA-N 1 2 322.861 4.669 20 0 DJADLO C[C@@H]([NH2+]Cc1cccc(Cl)c1)c1ncc(-c2ccccc2)o1 ZINC000173796192 337138333 /nfs/dbraw/zinc/13/83/33/337138333.db2.gz MCDITWFUSWZTQU-CYBMUJFWSA-N 1 2 312.800 4.846 20 0 DJADLO Cc1cc(C[NH2+][C@@H](C)c2nc(C3CCCCC3)no2)c(C)s1 ZINC000177795378 337157357 /nfs/dbraw/zinc/15/73/57/337157357.db2.gz HXYFPADVQOJSTC-LBPRGKRZSA-N 1 2 319.474 4.646 20 0 DJADLO C[C@H]([NH2+][C@@H](c1ccco1)c1ccccc1)c1ccc(Cl)nc1 ZINC000179098026 337167134 /nfs/dbraw/zinc/16/71/34/337167134.db2.gz YEIRKQGEFCEAEZ-SCLBCKFNSA-N 1 2 312.800 4.768 20 0 DJADLO Cc1cnc([C@H](C)[NH2+]Cc2ccc(Oc3ccccc3)o2)s1 ZINC000180995164 337179070 /nfs/dbraw/zinc/17/90/70/337179070.db2.gz BIWCCNNZNKKVTE-ZDUSSCGKSA-N 1 2 314.410 4.688 20 0 DJADLO CCc1ccccc1C[NH2+][C@H](c1nccs1)c1ccccc1 ZINC000183284512 337192769 /nfs/dbraw/zinc/19/27/69/337192769.db2.gz ZKKIJHABCYDSPS-SFHVURJKSA-N 1 2 308.450 4.585 20 0 DJADLO Cc1coc(-c2ccc(C)c(NCc3ccc(C)[nH+]c3C)c2)n1 ZINC000184487696 337199041 /nfs/dbraw/zinc/19/90/41/337199041.db2.gz XAZFVIVKRDBFQR-UHFFFAOYSA-N 1 2 307.397 4.582 20 0 DJADLO Cc1cc([C@@H](C)[NH2+][C@@H](c2ccccc2)c2ccccn2)c(C)o1 ZINC000321410182 337262503 /nfs/dbraw/zinc/26/25/03/337262503.db2.gz BEVSQTNBMNIQKR-QRWLVFNGSA-N 1 2 306.409 4.732 20 0 DJADLO C[C@@H]([NH2+]Cc1cccc2c1OC(C)(C)C2)c1c(F)cccc1F ZINC000321494048 337271494 /nfs/dbraw/zinc/27/14/94/337271494.db2.gz SBFCEGXQTYDCMV-GFCCVEGCSA-N 1 2 317.379 4.529 20 0 DJADLO Cc1ccc(F)cc1C[NH2+][C@H](C)c1ncc(-c2ccccc2)o1 ZINC000189452071 337279839 /nfs/dbraw/zinc/27/98/39/337279839.db2.gz ZFKIHTAGZNAAHC-CQSZACIVSA-N 1 2 310.372 4.640 20 0 DJADLO C/C=C\c1ccc(NCc2[nH+]ccn2Cc2ccccc2)cc1 ZINC000520783014 337390397 /nfs/dbraw/zinc/39/03/97/337390397.db2.gz PTLQLURJQAXNCZ-KXFIGUGUSA-N 1 2 303.409 4.577 20 0 DJADLO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1c(F)cccc1Cl ZINC000035015121 337392333 /nfs/dbraw/zinc/39/23/33/337392333.db2.gz WFWMANMZUTXONY-LBPRGKRZSA-N 1 2 307.796 4.647 20 0 DJADLO CC(=O)CCc1ccc(OCc2ccc(C(C)C)[nH+]c2C)cc1 ZINC000418773876 337395960 /nfs/dbraw/zinc/39/59/60/337395960.db2.gz CNTBWZBZPHIPKT-UHFFFAOYSA-N 1 2 311.425 4.614 20 0 DJADLO C[C@H]([NH2+][C@@H](c1nccs1)c1ccccc1)c1cccs1 ZINC000123143866 337397875 /nfs/dbraw/zinc/39/78/75/337397875.db2.gz KXYOITISSQAVBT-SWLSCSKDSA-N 1 2 300.452 4.645 20 0 DJADLO c1csc([C@H]([NH2+][C@H]2CCc3ccccc32)c2ccccc2)n1 ZINC000123147301 337397946 /nfs/dbraw/zinc/39/79/46/337397946.db2.gz QAQWDLSOHLOIDB-ZWKOTPCHSA-N 1 2 306.434 4.510 20 0 DJADLO CC[C@H]([NH2+][C@@H](C)c1noc(-c2ccccc2)n1)c1cccs1 ZINC000124349092 337404878 /nfs/dbraw/zinc/40/48/78/337404878.db2.gz NUCBOMSRZAUROW-JSGCOSHPSA-N 1 2 313.426 4.600 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1cccc(Cl)c1)c1ccccn1)c1ccco1 ZINC000124598355 337406314 /nfs/dbraw/zinc/40/63/14/337406314.db2.gz MGVIUJCCADRPQT-ACJLOTCBSA-N 1 2 312.800 4.768 20 0 DJADLO Clc1ccc([C@H]([NH2+]Cc2cscn2)c2cccs2)cc1 ZINC000127143136 337419485 /nfs/dbraw/zinc/41/94/85/337419485.db2.gz PLHIAVKPYCNSPG-HNNXBMFYSA-N 1 2 320.870 4.737 20 0 DJADLO C[C@H]([NH2+][C@H](c1nccs1)c1ccccc1)c1cccc(F)c1 ZINC000195074149 337464889 /nfs/dbraw/zinc/46/48/89/337464889.db2.gz HSXLSMRPOAZTAB-GUYCJALGSA-N 1 2 312.413 4.722 20 0 DJADLO Cc1[nH+]c(C(C)C)ccc1CSCc1nnc(C(C)C)s1 ZINC000419493823 337487735 /nfs/dbraw/zinc/48/77/35/337487735.db2.gz OFJONQPOEZPBPI-UHFFFAOYSA-N 1 2 321.515 4.922 20 0 DJADLO COc1ccc(Cl)cc1[C@@H](C)[NH2+][C@@H](C)c1nc(C)cs1 ZINC000162405308 337618180 /nfs/dbraw/zinc/61/81/80/337618180.db2.gz OKHXNNDIYKYATJ-MNOVXSKESA-N 1 2 310.850 4.525 20 0 DJADLO CCc1nc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2OC)cs1 ZINC000421835961 337652327 /nfs/dbraw/zinc/65/23/27/337652327.db2.gz QOPMMRIWVLFNID-MNOVXSKESA-N 1 2 324.877 4.779 20 0 DJADLO Cc1c[nH+]ccc1NC(=O)c1ccc(-c2ccccc2Cl)o1 ZINC000107293185 337828509 /nfs/dbraw/zinc/82/85/09/337828509.db2.gz GHFAQFVXRIFHLE-UHFFFAOYSA-N 1 2 312.756 4.556 20 0 DJADLO CC[C@@](C)([NH2+]Cc1cc(Cl)ccc1F)c1nc(C)cs1 ZINC000119348577 337857083 /nfs/dbraw/zinc/85/70/83/337857083.db2.gz PEDPYBFTNDECPX-OAHLLOKOSA-N 1 2 312.841 4.659 20 0 DJADLO COc1ccccc1[C@@H]([NH2+][C@H](C)c1ccsc1)c1ccco1 ZINC000090535124 337882257 /nfs/dbraw/zinc/88/22/57/337882257.db2.gz PDKHCVJLHXHHRJ-FZKQIMNGSA-N 1 2 313.422 4.790 20 0 DJADLO C[C@@H](Nc1cccc(CCCc2ccccc2)c1)c1[nH+]ccn1C ZINC000537529855 337940725 /nfs/dbraw/zinc/94/07/25/337940725.db2.gz LKIALMJPTBZVAR-QGZVFWFLSA-N 1 2 319.452 4.769 20 0 DJADLO C[C@H](Nc1cccc(CCCc2ccccc2)c1)c1[nH+]ccn1C ZINC000537529850 337940770 /nfs/dbraw/zinc/94/07/70/337940770.db2.gz LKIALMJPTBZVAR-KRWDZBQOSA-N 1 2 319.452 4.769 20 0 DJADLO Cc1cccc2c1CC[C@H]2[NH2+][C@H](c1nccs1)c1ccccc1 ZINC000123110430 337944786 /nfs/dbraw/zinc/94/47/86/337944786.db2.gz DTVRJRQFBNMZEY-MOPGFXCFSA-N 1 2 320.461 4.818 20 0 DJADLO Cc1oc(-c2ccccc2)nc1C[N@@H+]([C@H](C)c1ccco1)C1CC1 ZINC000086233508 338013634 /nfs/dbraw/zinc/01/36/34/338013634.db2.gz TZZWHUJCRWKXEW-CQSZACIVSA-N 1 2 322.408 4.969 20 0 DJADLO Cc1oc(-c2ccccc2)nc1C[N@H+]([C@H](C)c1ccco1)C1CC1 ZINC000086233508 338013635 /nfs/dbraw/zinc/01/36/35/338013635.db2.gz TZZWHUJCRWKXEW-CQSZACIVSA-N 1 2 322.408 4.969 20 0 DJADLO C[C@H](c1ccco1)[N@H+](Cc1coc(-c2ccccc2)n1)C1CC1 ZINC000086232600 338013689 /nfs/dbraw/zinc/01/36/89/338013689.db2.gz MVCLMACIRQGNFS-CQSZACIVSA-N 1 2 308.381 4.660 20 0 DJADLO C[C@H](c1ccco1)[N@@H+](Cc1coc(-c2ccccc2)n1)C1CC1 ZINC000086232600 338013690 /nfs/dbraw/zinc/01/36/90/338013690.db2.gz MVCLMACIRQGNFS-CQSZACIVSA-N 1 2 308.381 4.660 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)c1coc2ccc(C(C)C)cc12 ZINC000425598725 338015937 /nfs/dbraw/zinc/01/59/37/338015937.db2.gz XMHBJGVXEWBVIG-UHFFFAOYSA-N 1 2 308.381 4.820 20 0 DJADLO Cc1cnc([C@@H](C)[NH+]2Cc3ccccc3-c3ccccc3C2)cn1 ZINC000428234887 338043610 /nfs/dbraw/zinc/04/36/10/338043610.db2.gz AZANBHUKCXYRNE-MRXNPFEDSA-N 1 2 315.420 4.529 20 0 DJADLO Cc1nc(C(C)C)oc1C[NH2+][C@H](C)c1c(F)cccc1Cl ZINC000428350822 338048394 /nfs/dbraw/zinc/04/83/94/338048394.db2.gz WJCOTVSUEFYGSL-LLVKDONJSA-N 1 2 310.800 4.750 20 0 DJADLO Cc1csc([C@@H]2CCCC[N@H+]2Cc2oc(C(C)C)nc2C)n1 ZINC000428416011 338050529 /nfs/dbraw/zinc/05/05/29/338050529.db2.gz BVDLIEBWNZGTFD-AWEZNQCLSA-N 1 2 319.474 4.599 20 0 DJADLO Cc1csc([C@@H]2CCCC[N@@H+]2Cc2oc(C(C)C)nc2C)n1 ZINC000428416011 338050530 /nfs/dbraw/zinc/05/05/30/338050530.db2.gz BVDLIEBWNZGTFD-AWEZNQCLSA-N 1 2 319.474 4.599 20 0 DJADLO Cc1csc([C@H]2CCCC[N@H+]2Cc2oc(C(C)C)nc2C)n1 ZINC000428416012 338050617 /nfs/dbraw/zinc/05/06/17/338050617.db2.gz BVDLIEBWNZGTFD-CQSZACIVSA-N 1 2 319.474 4.599 20 0 DJADLO Cc1csc([C@H]2CCCC[N@@H+]2Cc2oc(C(C)C)nc2C)n1 ZINC000428416012 338050618 /nfs/dbraw/zinc/05/06/18/338050618.db2.gz BVDLIEBWNZGTFD-CQSZACIVSA-N 1 2 319.474 4.599 20 0 DJADLO CCCc1nc(C)c(C[N@H+](C)[C@H](C)c2ccccc2Cl)o1 ZINC000428461441 338053287 /nfs/dbraw/zinc/05/32/87/338053287.db2.gz QCROYQQTFHRMGF-CYBMUJFWSA-N 1 2 306.837 4.782 20 0 DJADLO CCCc1nc(C)c(C[N@@H+](C)[C@H](C)c2ccccc2Cl)o1 ZINC000428461441 338053288 /nfs/dbraw/zinc/05/32/88/338053288.db2.gz QCROYQQTFHRMGF-CYBMUJFWSA-N 1 2 306.837 4.782 20 0 DJADLO Cc1nc(C(C)C)oc1C[N@H+](C)[C@@H](C)c1cc(F)ccc1F ZINC000428469585 338053969 /nfs/dbraw/zinc/05/39/69/338053969.db2.gz VTWLCVNBEKEPPF-LBPRGKRZSA-N 1 2 308.372 4.578 20 0 DJADLO Cc1nc(C(C)C)oc1C[N@@H+](C)[C@@H](C)c1cc(F)ccc1F ZINC000428469585 338053970 /nfs/dbraw/zinc/05/39/70/338053970.db2.gz VTWLCVNBEKEPPF-LBPRGKRZSA-N 1 2 308.372 4.578 20 0 DJADLO CCCc1nc(C)c(C[N@H+](Cc2ccco2)Cc2ccccc2)o1 ZINC000428474466 338054395 /nfs/dbraw/zinc/05/43/95/338054395.db2.gz SEFILJIVUPZXTJ-UHFFFAOYSA-N 1 2 324.424 4.731 20 0 DJADLO CCCc1nc(C)c(C[N@@H+](Cc2ccco2)Cc2ccccc2)o1 ZINC000428474466 338054396 /nfs/dbraw/zinc/05/43/96/338054396.db2.gz SEFILJIVUPZXTJ-UHFFFAOYSA-N 1 2 324.424 4.731 20 0 DJADLO FC(F)(F)c1ccc(CNc2cccc(-n3cc[nH+]c3)c2)s1 ZINC000428850909 338062179 /nfs/dbraw/zinc/06/21/79/338062179.db2.gz PNPYMNAFCKPKQL-UHFFFAOYSA-N 1 2 323.343 4.565 20 0 DJADLO c1nc(C[NH2+][C@@H](c2ccccc2)c2ccc3ccccc3c2)co1 ZINC000428865998 338063176 /nfs/dbraw/zinc/06/31/76/338063176.db2.gz XKRGRVMQDIZRMK-NRFANRHFSA-N 1 2 314.388 4.707 20 0 DJADLO CC(C)([NH2+]Cc1cc(-c2cccs2)on1)c1ccccc1F ZINC000429239580 338074434 /nfs/dbraw/zinc/07/44/34/338074434.db2.gz RDKNWHWWPQARLA-UHFFFAOYSA-N 1 2 316.401 4.567 20 0 DJADLO Cc1ccc2[nH]c(C[N@@H+]3CC(C)(C)[C@H]3c3cccnc3)cc2c1C ZINC000430094106 338096108 /nfs/dbraw/zinc/09/61/08/338096108.db2.gz IPGFRYZQEBUAAD-HXUWFJFHSA-N 1 2 319.452 4.763 20 0 DJADLO Cc1ccc2[nH]c(C[N@H+]3CC(C)(C)[C@H]3c3cccnc3)cc2c1C ZINC000430094106 338096109 /nfs/dbraw/zinc/09/61/09/338096109.db2.gz IPGFRYZQEBUAAD-HXUWFJFHSA-N 1 2 319.452 4.763 20 0 DJADLO CC(C)CCn1cccc1C[N@@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000430096728 338096243 /nfs/dbraw/zinc/09/62/43/338096243.db2.gz AXLZACVWQVFDIF-LJQANCHMSA-N 1 2 311.473 4.512 20 0 DJADLO CC(C)CCn1cccc1C[N@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000430096728 338096244 /nfs/dbraw/zinc/09/62/44/338096244.db2.gz AXLZACVWQVFDIF-LJQANCHMSA-N 1 2 311.473 4.512 20 0 DJADLO Cc1cnc([C@H](C)[NH2+]Cc2csc(Cl)c2Cl)s1 ZINC000432250170 338150960 /nfs/dbraw/zinc/15/09/60/338150960.db2.gz JCCFOXGUCRKAEM-ZETCQYMHSA-N 1 2 307.271 4.671 20 0 DJADLO Fc1ccc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)c(Cl)c1Cl ZINC000432749947 338166336 /nfs/dbraw/zinc/16/63/36/338166336.db2.gz AVSZFYORYFCRMN-ZDUSSCGKSA-N 1 2 313.203 4.798 20 0 DJADLO Fc1ccc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)c(Cl)c1Cl ZINC000432749947 338166337 /nfs/dbraw/zinc/16/63/37/338166337.db2.gz AVSZFYORYFCRMN-ZDUSSCGKSA-N 1 2 313.203 4.798 20 0 DJADLO C[C@@H](c1ccncc1)[N@H+](C)Cc1ccc(F)c(Cl)c1Cl ZINC000432914688 338172771 /nfs/dbraw/zinc/17/27/71/338172771.db2.gz BATOPUPZSQIUEG-JTQLQIEISA-N 1 2 313.203 4.721 20 0 DJADLO C[C@@H](c1ccncc1)[N@@H+](C)Cc1ccc(F)c(Cl)c1Cl ZINC000432914688 338172772 /nfs/dbraw/zinc/17/27/72/338172772.db2.gz BATOPUPZSQIUEG-JTQLQIEISA-N 1 2 313.203 4.721 20 0 DJADLO CC(C)c1noc([C@@H](C)[NH2+][C@@H](c2ccc(Cl)cc2)C(C)C)n1 ZINC000433781675 338201659 /nfs/dbraw/zinc/20/16/59/338201659.db2.gz FRKQCHGDXGLELD-IUODEOHRSA-N 1 2 321.852 4.894 20 0 DJADLO Cc1cc2cc([C@H](C)[NH2+][C@@H](C)c3nccs3)oc2cc1C ZINC000153329614 338222417 /nfs/dbraw/zinc/22/24/17/338222417.db2.gz XYSQUMYLHSIKQT-STQMWFEESA-N 1 2 300.427 4.918 20 0 DJADLO Cc1cc(CSCc2[nH+]ccn2CC(F)(F)F)c(C)s1 ZINC000435883055 338251616 /nfs/dbraw/zinc/25/16/16/338251616.db2.gz INMLFMOTLZDWBM-UHFFFAOYSA-N 1 2 320.405 4.557 20 0 DJADLO c1cn(CCSCc2ccc(-c3ccsc3)cc2)c[nH+]1 ZINC000435898333 338252239 /nfs/dbraw/zinc/25/22/39/338252239.db2.gz SDCNZPRKSVYEAM-UHFFFAOYSA-N 1 2 300.452 4.545 20 0 DJADLO Cc1cc(C)c(NC(=O)N(CC2CC2)C2CCCCC2)c(C)[nH+]1 ZINC000436489053 338273991 /nfs/dbraw/zinc/27/39/91/338273991.db2.gz FNZCVGXMKFFJQH-UHFFFAOYSA-N 1 2 315.461 4.583 20 0 DJADLO CCSCc1cc[nH+]c(N[C@@H]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000437802527 338322209 /nfs/dbraw/zinc/32/22/09/338322209.db2.gz REMAIBGPRFGJSW-CHWSQXEVSA-N 1 2 318.408 4.868 20 0 DJADLO Cc1c(Cl)cccc1NCc1c[nH+]cn1Cc1ccccc1 ZINC000438311187 338339263 /nfs/dbraw/zinc/33/92/63/338339263.db2.gz HNSDAQTURWXNDB-UHFFFAOYSA-N 1 2 311.816 4.505 20 0 DJADLO CC(C)c1ncc(C[N@H+](C)[C@H](C)c2cccc(Cl)c2F)cn1 ZINC000440472472 338387950 /nfs/dbraw/zinc/38/79/50/338387950.db2.gz UJOCKZJYTIFTTB-GFCCVEGCSA-N 1 2 321.827 4.586 20 0 DJADLO CC(C)c1ncc(C[N@@H+](C)[C@H](C)c2cccc(Cl)c2F)cn1 ZINC000440472472 338387951 /nfs/dbraw/zinc/38/79/51/338387951.db2.gz UJOCKZJYTIFTTB-GFCCVEGCSA-N 1 2 321.827 4.586 20 0 DJADLO CCC(CC)n1ccc(C[NH2+][C@H](C)c2cc3ccccc3o2)n1 ZINC000442881478 338437856 /nfs/dbraw/zinc/43/78/56/338437856.db2.gz IGKUBRASXYGJFK-CQSZACIVSA-N 1 2 311.429 4.841 20 0 DJADLO Cc1ccc(NC(=O)c2ccc(OC3CCCCC3)cc2)c(C)[nH+]1 ZINC000446437752 338528203 /nfs/dbraw/zinc/52/82/03/338528203.db2.gz CQDHCNZCKGKVOJ-UHFFFAOYSA-N 1 2 324.424 4.662 20 0 DJADLO c1c[nH+]c([C@@H](Nc2cccc3ccsc32)c2ccccc2)[nH]1 ZINC000446880592 338539263 /nfs/dbraw/zinc/53/92/63/338539263.db2.gz FSUCIGOWMFUDKY-INIZCTEOSA-N 1 2 305.406 4.826 20 0 DJADLO Clc1cc(Cl)cc(N[C@H](c2[nH]cc[nH+]2)c2ccccc2)c1 ZINC000446890050 338539698 /nfs/dbraw/zinc/53/96/98/338539698.db2.gz GBVCKOWODJPPHF-HNNXBMFYSA-N 1 2 318.207 4.918 20 0 DJADLO Cc1ccc(NC(=O)N[C@H](c2ccccc2C)C(C)C)c(C)[nH+]1 ZINC000447173818 338546856 /nfs/dbraw/zinc/54/68/56/338546856.db2.gz CLPFVCWBBXWNKN-SFHVURJKSA-N 1 2 311.429 4.526 20 0 DJADLO C[C@@H]([NH2+]C1(c2c(Cl)cccc2Cl)CCC1)c1ccncn1 ZINC000453209103 338808199 /nfs/dbraw/zinc/80/81/99/338808199.db2.gz CTDCAHVJYJRCPS-LLVKDONJSA-N 1 2 322.239 4.513 20 0 DJADLO COc1ccc([C@H]([NH2+][C@@H](C)c2ccc(C)o2)c2ccco2)cc1 ZINC000453383699 338835603 /nfs/dbraw/zinc/83/56/03/338835603.db2.gz ADLGDKBOTFSCQN-LIRRHRJNSA-N 1 2 311.381 4.630 20 0 DJADLO CC[C@H]([NH2+]Cc1c(F)cc(C)cc1Cl)c1nc(C)cs1 ZINC000459430784 339028770 /nfs/dbraw/zinc/02/87/70/339028770.db2.gz QVROPCTZKONKFV-AWEZNQCLSA-N 1 2 312.841 4.793 20 0 DJADLO CC1(CC(F)(F)F)C[NH+](Cc2cnc(C3CCCC3)s2)C1 ZINC000459640308 339039653 /nfs/dbraw/zinc/03/96/53/339039653.db2.gz QAKLKCRMBAZPCJ-UHFFFAOYSA-N 1 2 318.408 4.575 20 0 DJADLO CCCC[C@@H](C)N(C)C(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000461418562 339063625 /nfs/dbraw/zinc/06/36/25/339063625.db2.gz MMSAKWOEIRZUPS-OAHLLOKOSA-N 1 2 312.413 4.525 20 0 DJADLO CC[C@@H](C)Oc1cc(C)ccc1C[NH2+][C@@H](C)c1csc(C)n1 ZINC000462810350 339090851 /nfs/dbraw/zinc/09/08/51/339090851.db2.gz HXEQFIMFFNCOTM-KGLIPLIRSA-N 1 2 318.486 4.788 20 0 DJADLO Cc1nc([C@H](C)[NH2+][C@H](C)c2oc3ccccc3c2C)cs1 ZINC000462823580 339092226 /nfs/dbraw/zinc/09/22/26/339092226.db2.gz VZAZVYYKVHYGQY-NWDGAFQWSA-N 1 2 300.427 4.918 20 0 DJADLO COc1ccccc1-c1ccc([C@@H](C)Nc2cc(C)[nH+]cn2)cc1 ZINC000462889242 339096269 /nfs/dbraw/zinc/09/62/69/339096269.db2.gz RSTFWNZFVYXURC-OAHLLOKOSA-N 1 2 319.408 4.634 20 0 DJADLO C[C@@H](c1ccccc1)[N@H+](Cc1cscn1)Cc1ccccc1 ZINC000462905132 339097148 /nfs/dbraw/zinc/09/71/48/339097148.db2.gz CMSYOZAQXGTTOV-INIZCTEOSA-N 1 2 308.450 4.907 20 0 DJADLO C[C@@H](c1ccccc1)[N@@H+](Cc1cscn1)Cc1ccccc1 ZINC000462905132 339097149 /nfs/dbraw/zinc/09/71/49/339097149.db2.gz CMSYOZAQXGTTOV-INIZCTEOSA-N 1 2 308.450 4.907 20 0 DJADLO C[C@@H](c1ccccc1)[N@H+](Cc1nccs1)Cc1ccccc1 ZINC000462909611 339097476 /nfs/dbraw/zinc/09/74/76/339097476.db2.gz AGHBBTBFGFZUNA-INIZCTEOSA-N 1 2 308.450 4.907 20 0 DJADLO C[C@@H](c1ccccc1)[N@@H+](Cc1nccs1)Cc1ccccc1 ZINC000462909611 339097477 /nfs/dbraw/zinc/09/74/77/339097477.db2.gz AGHBBTBFGFZUNA-INIZCTEOSA-N 1 2 308.450 4.907 20 0 DJADLO CCc1ccc([C@H]2C[C@H](C)CCN2c2cc[nH+]c(C(C)C)n2)o1 ZINC000463068350 339103881 /nfs/dbraw/zinc/10/38/81/339103881.db2.gz KNZALFQUVQITBL-GDBMZVCRSA-N 1 2 313.445 4.733 20 0 DJADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2cncc(C(F)(F)F)c2)cc1 ZINC000463079190 339104931 /nfs/dbraw/zinc/10/49/31/339104931.db2.gz XSYMDCXQEIYNKA-MRXNPFEDSA-N 1 2 324.321 4.577 20 0 DJADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2cncc(C(F)(F)F)c2)cc1 ZINC000463079190 339104932 /nfs/dbraw/zinc/10/49/32/339104932.db2.gz XSYMDCXQEIYNKA-MRXNPFEDSA-N 1 2 324.321 4.577 20 0 DJADLO FC(F)(F)c1cncc(C[N@@H+]2CCCCC[C@H]2c2ccco2)c1 ZINC000463105714 339105986 /nfs/dbraw/zinc/10/59/86/339105986.db2.gz LQZYCKNUESJKLQ-HNNXBMFYSA-N 1 2 324.346 4.811 20 0 DJADLO FC(F)(F)c1cncc(C[N@H+]2CCCCC[C@H]2c2ccco2)c1 ZINC000463105714 339105987 /nfs/dbraw/zinc/10/59/87/339105987.db2.gz LQZYCKNUESJKLQ-HNNXBMFYSA-N 1 2 324.346 4.811 20 0 DJADLO Clc1ccc(SCc2cn3ccccc3[nH+]2)cc1Cl ZINC000463188014 339108475 /nfs/dbraw/zinc/10/84/75/339108475.db2.gz APKVSSGDXZZPRL-UHFFFAOYSA-N 1 2 309.221 4.933 20 0 DJADLO O=C(CC1CCC1)Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000463624641 339122870 /nfs/dbraw/zinc/12/28/70/339122870.db2.gz ZBQQUSNOBUZWEC-UHFFFAOYSA-N 1 2 316.788 4.656 20 0 DJADLO COc1ccc(CNc2[nH+]cccc2-c2ccccc2)cc1F ZINC000466620836 339210718 /nfs/dbraw/zinc/21/07/18/339210718.db2.gz WNYMXGXCOAPNDV-UHFFFAOYSA-N 1 2 308.356 4.508 20 0 DJADLO CC[C@H]1c2ccsc2CC[N@H+]1Cc1nc2ccc(F)cc2o1 ZINC000466805672 339217471 /nfs/dbraw/zinc/21/74/71/339217471.db2.gz XZKDUUBBTHUXDP-AWEZNQCLSA-N 1 2 316.401 4.538 20 0 DJADLO CC[C@H]1c2ccsc2CC[N@@H+]1Cc1nc2ccc(F)cc2o1 ZINC000466805672 339217472 /nfs/dbraw/zinc/21/74/72/339217472.db2.gz XZKDUUBBTHUXDP-AWEZNQCLSA-N 1 2 316.401 4.538 20 0 DJADLO CCc1noc(C)c1C[N@H+]([C@H](C)c1ccccc1Cl)C1CC1 ZINC000466822659 339218089 /nfs/dbraw/zinc/21/80/89/339218089.db2.gz CRUREBPUONJLGT-GFCCVEGCSA-N 1 2 318.848 4.924 20 0 DJADLO CCc1noc(C)c1C[N@@H+]([C@H](C)c1ccccc1Cl)C1CC1 ZINC000466822659 339218090 /nfs/dbraw/zinc/21/80/90/339218090.db2.gz CRUREBPUONJLGT-GFCCVEGCSA-N 1 2 318.848 4.924 20 0 DJADLO C[C@H](SCc1[nH+]ccn1Cc1ccccc1)c1ccccc1 ZINC000467224313 339228717 /nfs/dbraw/zinc/22/87/17/339228717.db2.gz JFKKUTDBXFXSEN-INIZCTEOSA-N 1 2 308.450 4.926 20 0 DJADLO Cc1ccc[nH+]c1[C@H]1CCC[C@@H](Nc2ccccc2N(C)C)C1 ZINC000467334057 339232122 /nfs/dbraw/zinc/23/21/22/339232122.db2.gz MMMAHHZHMGCRNI-DLBZAZTESA-N 1 2 309.457 4.594 20 0 DJADLO CCN(CC)c1ccc(N[C@@H](C)c2csc(C(C)C)n2)c[nH+]1 ZINC000469798359 339300921 /nfs/dbraw/zinc/30/09/21/339300921.db2.gz GBZULQLRZKAJAT-ZDUSSCGKSA-N 1 2 318.490 4.681 20 0 DJADLO C[C@@H]1C[N@H+](Cc2cccc(C(F)F)c2)[C@H](c2ccccc2)CO1 ZINC000470762033 339327007 /nfs/dbraw/zinc/32/70/07/339327007.db2.gz OCYIDHRSXPSQJC-KDOFPFPSSA-N 1 2 317.379 4.586 20 0 DJADLO C[C@@H]1C[N@@H+](Cc2cccc(C(F)F)c2)[C@H](c2ccccc2)CO1 ZINC000470762033 339327008 /nfs/dbraw/zinc/32/70/08/339327008.db2.gz OCYIDHRSXPSQJC-KDOFPFPSSA-N 1 2 317.379 4.586 20 0 DJADLO Clc1ccccc1[C@H]1CCC[N@@H+]1Cc1ccncc1Cl ZINC000470975483 339333470 /nfs/dbraw/zinc/33/34/70/339333470.db2.gz OETAJLHMLUJODO-MRXNPFEDSA-N 1 2 307.224 4.726 20 0 DJADLO Clc1ccccc1[C@H]1CCC[N@H+]1Cc1ccncc1Cl ZINC000470975483 339333471 /nfs/dbraw/zinc/33/34/71/339333471.db2.gz OETAJLHMLUJODO-MRXNPFEDSA-N 1 2 307.224 4.726 20 0 DJADLO Cc1cccc(C(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)c1F ZINC000471036265 339335158 /nfs/dbraw/zinc/33/51/58/339335158.db2.gz YBJABQKTXAHXSR-UHFFFAOYSA-N 1 2 322.339 4.574 20 0 DJADLO C[C@@H]([NH2+]Cc1ncc(Cl)s1)c1ccccc1C(F)(F)F ZINC000472050409 339360843 /nfs/dbraw/zinc/36/08/43/339360843.db2.gz YIIHTHFFTZVIJX-MRVPVSSYSA-N 1 2 320.767 4.666 20 0 DJADLO Cc1nc(-c2cccc(NCCCc3c[nH+]ccc3C)c2)cs1 ZINC000472582075 339374349 /nfs/dbraw/zinc/37/43/49/339374349.db2.gz WHXLRXWSCRXHTE-UHFFFAOYSA-N 1 2 323.465 4.867 20 0 DJADLO Cc1ccc([C@@H](C)[N@H+](C)Cc2noc(-c3ccccc3C)n2)cc1 ZINC000472755346 339376972 /nfs/dbraw/zinc/37/69/72/339376972.db2.gz UTLCMXOUOFOHIO-MRXNPFEDSA-N 1 2 321.424 4.546 20 0 DJADLO Cc1ccc([C@@H](C)[N@@H+](C)Cc2noc(-c3ccccc3C)n2)cc1 ZINC000472755346 339376973 /nfs/dbraw/zinc/37/69/73/339376973.db2.gz UTLCMXOUOFOHIO-MRXNPFEDSA-N 1 2 321.424 4.546 20 0 DJADLO Cc1ccccc1-c1nc(C[N@@H+](C)[C@H](C)c2ccccc2C)no1 ZINC000472767472 339377185 /nfs/dbraw/zinc/37/71/85/339377185.db2.gz UPJLRSHJDCFPHT-MRXNPFEDSA-N 1 2 321.424 4.546 20 0 DJADLO Cc1ccccc1-c1nc(C[N@H+](C)[C@H](C)c2ccccc2C)no1 ZINC000472767472 339377186 /nfs/dbraw/zinc/37/71/86/339377186.db2.gz UPJLRSHJDCFPHT-MRXNPFEDSA-N 1 2 321.424 4.546 20 0 DJADLO C[C@H]1CC[N@H+](Cc2ncc(Cl)s2)[C@H]1c1cccc(F)c1 ZINC000473139074 339382286 /nfs/dbraw/zinc/38/22/86/339382286.db2.gz LWHYZOHYKJZFLP-ZUZCIYMTSA-N 1 2 310.825 4.519 20 0 DJADLO C[C@H]1CC[N@@H+](Cc2ncc(Cl)s2)[C@H]1c1cccc(F)c1 ZINC000473139074 339382287 /nfs/dbraw/zinc/38/22/87/339382287.db2.gz LWHYZOHYKJZFLP-ZUZCIYMTSA-N 1 2 310.825 4.519 20 0 DJADLO Cc1ccc([C@@H]2CCCCC[N@@H+]2Cc2ncc(Cl)s2)o1 ZINC000473140197 339382337 /nfs/dbraw/zinc/38/23/37/339382337.db2.gz DOFWLPSBNQZPKE-LBPRGKRZSA-N 1 2 310.850 4.815 20 0 DJADLO Cc1ccc([C@@H]2CCCCC[N@H+]2Cc2ncc(Cl)s2)o1 ZINC000473140197 339382338 /nfs/dbraw/zinc/38/23/38/339382338.db2.gz DOFWLPSBNQZPKE-LBPRGKRZSA-N 1 2 310.850 4.815 20 0 DJADLO C[C@@H](c1cc2ccccc2o1)[N@H+](C)Cc1ncc(Cl)s1 ZINC000473147799 339382738 /nfs/dbraw/zinc/38/27/38/339382738.db2.gz PEOBRWZTKOCFQT-JTQLQIEISA-N 1 2 306.818 4.736 20 0 DJADLO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)Cc1ncc(Cl)s1 ZINC000473147799 339382739 /nfs/dbraw/zinc/38/27/39/339382739.db2.gz PEOBRWZTKOCFQT-JTQLQIEISA-N 1 2 306.818 4.736 20 0 DJADLO COc1c2ccccc2oc1C[NH2+]Cc1cccc(Cl)c1F ZINC000473986004 339396240 /nfs/dbraw/zinc/39/62/40/339396240.db2.gz BFXCVKHQIDKDBD-UHFFFAOYSA-N 1 2 319.763 4.524 20 0 DJADLO CC[C@H]1CCCC[C@@H]1C(=O)Nc1ccccc1-c1[nH]cc(C)[nH+]1 ZINC000476391246 339475843 /nfs/dbraw/zinc/47/58/43/339475843.db2.gz UOLSODGVJZOQKC-GJZGRUSLSA-N 1 2 311.429 4.540 20 0 DJADLO CC[C@H]1CCCC[C@H]1C(=O)Nc1cc(-c2[nH]cc[nH+]2)ccc1C ZINC000477996191 339506867 /nfs/dbraw/zinc/50/68/67/339506867.db2.gz CGBCRNHNEAPEOC-GOEBONIOSA-N 1 2 311.429 4.540 20 0 DJADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)c1ccc(C(C)C)cc1 ZINC000478019963 339507244 /nfs/dbraw/zinc/50/72/44/339507244.db2.gz UCVOXNQHRAICQI-UHFFFAOYSA-N 1 2 319.408 4.761 20 0 DJADLO CC(C)n1cc[nH+]c1CNc1cc(Cl)cc(C(F)(F)F)c1 ZINC000478318466 339513341 /nfs/dbraw/zinc/51/33/41/339513341.db2.gz XPWIDXCJDLFKGK-UHFFFAOYSA-N 1 2 317.742 4.748 20 0 DJADLO CCCCn1cc[nH+]c1-c1cccc(NC(=O)C[C@@H]2C=CCC2)c1 ZINC000478639395 339519867 /nfs/dbraw/zinc/51/98/67/339519867.db2.gz CJELPVBAJJUJMY-MRXNPFEDSA-N 1 2 323.440 4.645 20 0 DJADLO C[C@@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1ccc(Cl)cn1 ZINC000480187074 339562697 /nfs/dbraw/zinc/56/26/97/339562697.db2.gz ZHAZLDMSPYEXIJ-AUUYWEPGSA-N 1 2 323.827 4.570 20 0 DJADLO CC(C)N(C)c1ccc(CNc2cccc(C(C)(F)F)c2)c[nH+]1 ZINC000480274662 339566723 /nfs/dbraw/zinc/56/67/23/339566723.db2.gz OBBFPYDJZMLHMC-UHFFFAOYSA-N 1 2 319.399 4.650 20 0 DJADLO CC[C@@](C)([NH2+]Cc1ccsc1Cl)c1nc(C)cs1 ZINC000480388605 339571824 /nfs/dbraw/zinc/57/18/24/339571824.db2.gz YHWKXXDDHFVODS-CYBMUJFWSA-N 1 2 300.880 4.581 20 0 DJADLO CC[C@](C)([NH2+]Cc1ccsc1Cl)c1nc(C)cs1 ZINC000480388608 339571838 /nfs/dbraw/zinc/57/18/38/339571838.db2.gz YHWKXXDDHFVODS-ZDUSSCGKSA-N 1 2 300.880 4.581 20 0 DJADLO O=C(Nc1cccc(F)c1)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000482078240 339622119 /nfs/dbraw/zinc/62/21/19/339622119.db2.gz PZYFKUUZKQRFSA-UHFFFAOYSA-N 1 2 323.327 4.657 20 0 DJADLO CCCC1CCC(N(C)C(=O)Nc2ccc(C)[nH+]c2C)CC1 ZINC000484521549 339689165 /nfs/dbraw/zinc/68/91/65/339689165.db2.gz WPGGVCHVQMUDIC-UHFFFAOYSA-N 1 2 303.450 4.521 20 0 DJADLO Cc1c2ccccc2oc1[C@H](C)[NH2+]Cc1ncc(C(C)(C)C)o1 ZINC000484997378 339697066 /nfs/dbraw/zinc/69/70/66/339697066.db2.gz NDURCMBLAVHHDZ-ZDUSSCGKSA-N 1 2 312.413 4.878 20 0 DJADLO Cc1ccc([C@@H](C)N(C)C(=O)Nc2c(C)cc[nH+]c2C)c(C)c1 ZINC000485450303 339703446 /nfs/dbraw/zinc/70/34/46/339703446.db2.gz ICEZYRASXYKRHW-MRXNPFEDSA-N 1 2 311.429 4.540 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N(CC(C)(C)C)CC(C)(C)C ZINC000485453663 339703625 /nfs/dbraw/zinc/70/36/25/339703625.db2.gz TUOJPYORSSONBE-UHFFFAOYSA-N 1 2 305.466 4.625 20 0 DJADLO Cc1cc(NC(=O)[C@@H]2CC[C@H](C)C2)ccc1Oc1cc[nH+]cc1 ZINC000487705412 339761388 /nfs/dbraw/zinc/76/13/88/339761388.db2.gz WTWRBQXLBUPXJM-DZGCQCFKSA-N 1 2 310.397 4.557 20 0 DJADLO Cc1cc(NC(=O)C[C@H]2C=CCCC2)ccc1Oc1cc[nH+]cc1 ZINC000487709267 339761485 /nfs/dbraw/zinc/76/14/85/339761485.db2.gz NZGSOCSXRCSLJN-INIZCTEOSA-N 1 2 322.408 4.867 20 0 DJADLO Cc1ccc(C(=O)N(C)C2(C)CCCC2)cc1Oc1cc[nH+]cc1 ZINC000490654442 339836704 /nfs/dbraw/zinc/83/67/04/339836704.db2.gz MBOMPWFMLDMWMV-UHFFFAOYSA-N 1 2 324.424 4.587 20 0 DJADLO Clc1cnc(C[NH2+][C@H]2CCCc3sc(Cl)cc32)s1 ZINC000492277021 339896210 /nfs/dbraw/zinc/89/62/10/339896210.db2.gz RQDAZPWDXMJJSR-QMMMGPOBSA-N 1 2 319.282 4.679 20 0 DJADLO CCCC[C@@H](CC)CC(=O)Nc1ccccc1-c1[nH]cc(C)[nH+]1 ZINC000494618551 339955461 /nfs/dbraw/zinc/95/54/61/339955461.db2.gz WNSZDNKZEPAWGX-OAHLLOKOSA-N 1 2 313.445 4.930 20 0 DJADLO CCCc1nc(C[N@H+](CC)Cc2ccc(Cl)s2)cs1 ZINC000496535163 340007374 /nfs/dbraw/zinc/00/73/74/340007374.db2.gz MBRYDFYWLKOMNR-UHFFFAOYSA-N 1 2 314.907 4.833 20 0 DJADLO CCCc1nc(C[N@@H+](CC)Cc2ccc(Cl)s2)cs1 ZINC000496535163 340007375 /nfs/dbraw/zinc/00/73/75/340007375.db2.gz MBRYDFYWLKOMNR-UHFFFAOYSA-N 1 2 314.907 4.833 20 0 DJADLO C[C@H](c1ccc(C(F)(F)F)cc1)N(C)c1cc[nH+]c(C2CC2)n1 ZINC000498954096 340026970 /nfs/dbraw/zinc/02/69/70/340026970.db2.gz FZBFGSJIXLGFBG-LLVKDONJSA-N 1 2 321.346 4.570 20 0 DJADLO CC(C)c1noc(C[N@@H+](C)[C@H](c2ccccc2Cl)C(C)C)n1 ZINC000500211849 340053109 /nfs/dbraw/zinc/05/31/09/340053109.db2.gz PIJJTTKALMCVES-INIZCTEOSA-N 1 2 321.852 4.676 20 0 DJADLO CC(C)c1noc(C[N@H+](C)[C@H](c2ccccc2Cl)C(C)C)n1 ZINC000500211849 340053110 /nfs/dbraw/zinc/05/31/10/340053110.db2.gz PIJJTTKALMCVES-INIZCTEOSA-N 1 2 321.852 4.676 20 0 DJADLO Clc1cccc(-c2cnc(C[NH+]3Cc4ccccc4C3)o2)c1 ZINC000500247874 340054015 /nfs/dbraw/zinc/05/40/15/340054015.db2.gz ZOXUZBWLDKAWKX-UHFFFAOYSA-N 1 2 310.784 4.511 20 0 DJADLO CC(C)c1ccc(C[N@@H+](Cc2nccn2C(C)C)C2CC2)cc1 ZINC000501274252 340077890 /nfs/dbraw/zinc/07/78/90/340077890.db2.gz LOPWVWCRSUQKHM-UHFFFAOYSA-N 1 2 311.473 4.752 20 0 DJADLO CC(C)c1ccc(C[N@H+](Cc2nccn2C(C)C)C2CC2)cc1 ZINC000501274252 340077891 /nfs/dbraw/zinc/07/78/91/340077891.db2.gz LOPWVWCRSUQKHM-UHFFFAOYSA-N 1 2 311.473 4.752 20 0 DJADLO CSc1ccccc1[C@@H](C)[NH2+]Cc1ncc(-c2ccccc2)o1 ZINC000501502633 340082459 /nfs/dbraw/zinc/08/24/59/340082459.db2.gz MSVQWEDGZDKMJP-CQSZACIVSA-N 1 2 324.449 4.914 20 0 DJADLO c1[nH+]c(-c2ccc(N[C@@H]3CCC34CCC4)cc2)n2c1CCCC2 ZINC000502455184 340104296 /nfs/dbraw/zinc/10/42/96/340104296.db2.gz WMMDNMMEIHYWAJ-GOSISDBHSA-N 1 2 307.441 4.631 20 0 DJADLO CC[C@H]1C[C@@]1([NH2+]Cc1ncc(C(C)(C)C)o1)c1cccc(C)c1 ZINC000502483811 340105612 /nfs/dbraw/zinc/10/56/12/340105612.db2.gz KNYRCSGVZSXZKH-YWZLYKJASA-N 1 2 312.457 4.696 20 0 DJADLO CCCc1noc(C[N@H+](C)[C@H](c2ccccc2Cl)C(C)C)n1 ZINC000502577890 340108272 /nfs/dbraw/zinc/10/82/72/340108272.db2.gz VFCKHHSUFJLKQN-KRWDZBQOSA-N 1 2 321.852 4.505 20 0 DJADLO CCCc1noc(C[N@@H+](C)[C@H](c2ccccc2Cl)C(C)C)n1 ZINC000502577890 340108273 /nfs/dbraw/zinc/10/82/73/340108273.db2.gz VFCKHHSUFJLKQN-KRWDZBQOSA-N 1 2 321.852 4.505 20 0 DJADLO C[C@H]([NH2+]Cc1c(F)cccc1Cl)c1cnn(C2CCCC2)c1 ZINC000502734134 340112788 /nfs/dbraw/zinc/11/27/88/340112788.db2.gz IOIVZJIVIFJHMO-LBPRGKRZSA-N 1 2 321.827 4.642 20 0 DJADLO Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]C1(C(F)F)CC1 ZINC000503907014 340136366 /nfs/dbraw/zinc/13/63/66/340136366.db2.gz BOCBQDDHVGYTNZ-LLVKDONJSA-N 1 2 308.397 4.567 20 0 DJADLO C/C(=C\c1ccccc1C(F)(F)F)C[N@@H+](C)Cc1cc(C)on1 ZINC000503957939 340138744 /nfs/dbraw/zinc/13/87/44/340138744.db2.gz NMXHBBQUCOCKJJ-XYOKQWHBSA-N 1 2 324.346 4.537 20 0 DJADLO C/C(=C\c1ccccc1C(F)(F)F)C[N@H+](C)Cc1cc(C)on1 ZINC000503957939 340138745 /nfs/dbraw/zinc/13/87/45/340138745.db2.gz NMXHBBQUCOCKJJ-XYOKQWHBSA-N 1 2 324.346 4.537 20 0 DJADLO CC(C)(C)Oc1cc[nH+]cc1NC(=O)CC/C=C\c1ccccc1 ZINC000504678878 340150941 /nfs/dbraw/zinc/15/09/41/340150941.db2.gz XSIIUCHGPLUREA-XFFZJAGNSA-N 1 2 324.424 4.691 20 0 DJADLO CC[C@H](CC(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccccc1 ZINC000505098788 340161470 /nfs/dbraw/zinc/16/14/70/340161470.db2.gz NTFTZVNUHZONQW-OAHLLOKOSA-N 1 2 319.408 4.599 20 0 DJADLO CCCCc1noc(C[NH2+][C@H](c2ccc(Cl)cc2)C(C)C)n1 ZINC000505287472 340165558 /nfs/dbraw/zinc/16/55/58/340165558.db2.gz LSZQKURAUDXLDK-KRWDZBQOSA-N 1 2 321.852 4.553 20 0 DJADLO C[N@H+](Cc1cnc(C2CCCC2)s1)Cc1ccccc1F ZINC000505611512 340173022 /nfs/dbraw/zinc/17/30/22/340173022.db2.gz PSKPIRFIZORUNF-UHFFFAOYSA-N 1 2 304.434 4.572 20 0 DJADLO C[N@@H+](Cc1cnc(C2CCCC2)s1)Cc1ccccc1F ZINC000505611512 340173023 /nfs/dbraw/zinc/17/30/23/340173023.db2.gz PSKPIRFIZORUNF-UHFFFAOYSA-N 1 2 304.434 4.572 20 0 DJADLO O=C(Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1)c1ccccc1 ZINC000505721077 340175695 /nfs/dbraw/zinc/17/56/95/340175695.db2.gz WZMURLMTPDRFBS-UHFFFAOYSA-N 1 2 324.767 4.780 20 0 DJADLO Clc1ccc(C[N@H+](Cc2ccco2)Cc2ccccc2)o1 ZINC000506069526 340184915 /nfs/dbraw/zinc/18/49/15/340184915.db2.gz CJTJBTGGFODNCB-UHFFFAOYSA-N 1 2 301.773 4.728 20 0 DJADLO Clc1ccc(C[N@@H+](Cc2ccco2)Cc2ccccc2)o1 ZINC000506069526 340184916 /nfs/dbraw/zinc/18/49/16/340184916.db2.gz CJTJBTGGFODNCB-UHFFFAOYSA-N 1 2 301.773 4.728 20 0 DJADLO C[C@H]1C[C@@H]1c1ccc(C[NH+](Cc2ccco2)Cc2ccco2)o1 ZINC000506085939 340185251 /nfs/dbraw/zinc/18/52/51/340185251.db2.gz LFSRDQSAAPWLFF-KSSFIOAISA-N 1 2 311.381 4.791 20 0 DJADLO CC(C)c1ncc(C[N@H+](Cc2ccccc2F)C2CC2)s1 ZINC000506732914 340200389 /nfs/dbraw/zinc/20/03/89/340200389.db2.gz YZAOFRAJGOVMRB-UHFFFAOYSA-N 1 2 304.434 4.570 20 0 DJADLO CC(C)c1ncc(C[N@@H+](Cc2ccccc2F)C2CC2)s1 ZINC000506732914 340200390 /nfs/dbraw/zinc/20/03/90/340200390.db2.gz YZAOFRAJGOVMRB-UHFFFAOYSA-N 1 2 304.434 4.570 20 0 DJADLO CCc1nocc1C[NH+](Cc1cccs1)Cc1cccs1 ZINC000507019887 340205488 /nfs/dbraw/zinc/20/54/88/340205488.db2.gz GUBKHNWCTYMVPR-UHFFFAOYSA-N 1 2 318.467 4.562 20 0 DJADLO C[C@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1cccc(O)c1Cl ZINC000507089768 340207129 /nfs/dbraw/zinc/20/71/29/340207129.db2.gz VWNAAPGOYYSIIM-SNVBAGLBSA-N 1 2 311.759 4.517 20 0 DJADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1cccc(O)c1Cl ZINC000507089768 340207130 /nfs/dbraw/zinc/20/71/30/340207130.db2.gz VWNAAPGOYYSIIM-SNVBAGLBSA-N 1 2 311.759 4.517 20 0 DJADLO CSCc1cnc(C[N@H+]([C@@H](C)c2ccccc2)C2CC2)s1 ZINC000507158772 340210141 /nfs/dbraw/zinc/21/01/41/340210141.db2.gz FNRYWIICYNRJBY-ZDUSSCGKSA-N 1 2 318.511 4.732 20 0 DJADLO CSCc1cnc(C[N@@H+]([C@@H](C)c2ccccc2)C2CC2)s1 ZINC000507158772 340210142 /nfs/dbraw/zinc/21/01/42/340210142.db2.gz FNRYWIICYNRJBY-ZDUSSCGKSA-N 1 2 318.511 4.732 20 0 DJADLO Cc1nocc1C[N@@H+]1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000507227974 340214728 /nfs/dbraw/zinc/21/47/28/340214728.db2.gz JPGZIDWTYCFOEZ-HNNXBMFYSA-N 1 2 311.212 4.627 20 0 DJADLO Cc1nocc1C[N@H+]1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000507227974 340214729 /nfs/dbraw/zinc/21/47/29/340214729.db2.gz JPGZIDWTYCFOEZ-HNNXBMFYSA-N 1 2 311.212 4.627 20 0 DJADLO CC[C@@H]1c2ccsc2CC[N@H+]1Cc1ncc(CSC)s1 ZINC000507524395 340224338 /nfs/dbraw/zinc/22/43/38/340224338.db2.gz CLLKNSQGNRTHBV-CYBMUJFWSA-N 1 2 324.540 4.577 20 0 DJADLO CC[C@@H]1c2ccsc2CC[N@@H+]1Cc1ncc(CSC)s1 ZINC000507524395 340224339 /nfs/dbraw/zinc/22/43/39/340224339.db2.gz CLLKNSQGNRTHBV-CYBMUJFWSA-N 1 2 324.540 4.577 20 0 DJADLO CC[N@H+](Cc1ncc(CSC)s1)[C@H](C)c1ccc(F)cc1 ZINC000507621063 340226662 /nfs/dbraw/zinc/22/66/62/340226662.db2.gz MRNINGYDPDTNKE-GFCCVEGCSA-N 1 2 324.490 4.728 20 0 DJADLO CC[N@@H+](Cc1ncc(CSC)s1)[C@H](C)c1ccc(F)cc1 ZINC000507621063 340226663 /nfs/dbraw/zinc/22/66/63/340226663.db2.gz MRNINGYDPDTNKE-GFCCVEGCSA-N 1 2 324.490 4.728 20 0 DJADLO Cc1cc(C[N@H+](C)Cc2ccc(-c3ccc(C)cc3)s2)no1 ZINC000508517411 340245462 /nfs/dbraw/zinc/24/54/62/340245462.db2.gz GADCKSVABKQXDT-UHFFFAOYSA-N 1 2 312.438 4.652 20 0 DJADLO Cc1cc(C[N@@H+](C)Cc2ccc(-c3ccc(C)cc3)s2)no1 ZINC000508517411 340245463 /nfs/dbraw/zinc/24/54/63/340245463.db2.gz GADCKSVABKQXDT-UHFFFAOYSA-N 1 2 312.438 4.652 20 0 DJADLO CCC[N@H+](Cc1csc(CC)n1)[C@@H](C)c1ccccc1OC ZINC000508625242 340248463 /nfs/dbraw/zinc/24/84/63/340248463.db2.gz KHIAHOUBFYKWBK-AWEZNQCLSA-N 1 2 318.486 4.687 20 0 DJADLO CCC[N@@H+](Cc1csc(CC)n1)[C@@H](C)c1ccccc1OC ZINC000508625242 340248464 /nfs/dbraw/zinc/24/84/64/340248464.db2.gz KHIAHOUBFYKWBK-AWEZNQCLSA-N 1 2 318.486 4.687 20 0 DJADLO C[C@H](c1cccs1)[N@H+](Cc1nccs1)Cc1ccccc1 ZINC000508838628 340254069 /nfs/dbraw/zinc/25/40/69/340254069.db2.gz XWZSNRVPYOUGAA-CQSZACIVSA-N 1 2 314.479 4.968 20 0 DJADLO C[C@H](c1cccs1)[N@@H+](Cc1nccs1)Cc1ccccc1 ZINC000508838628 340254070 /nfs/dbraw/zinc/25/40/70/340254070.db2.gz XWZSNRVPYOUGAA-CQSZACIVSA-N 1 2 314.479 4.968 20 0 DJADLO CCCCn1c(SC2CCCCC2)nnc1[C@H](CC)[NH+](C)C ZINC000508988449 340257022 /nfs/dbraw/zinc/25/70/22/340257022.db2.gz UOWZBVMLOWWVKV-HNNXBMFYSA-N 1 2 324.538 4.516 20 0 DJADLO Cc1ccc(C)c(NC(=O)c2ccccc2Oc2cc[nH+]cc2)c1 ZINC000509018466 340258428 /nfs/dbraw/zinc/25/84/28/340258428.db2.gz ZXVUFUGUKPXXTH-UHFFFAOYSA-N 1 2 318.376 4.743 20 0 DJADLO C[C@H]1CCC[C@H](N(C)C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000509148543 340262327 /nfs/dbraw/zinc/26/23/27/340262327.db2.gz AQMLFPUSNTYNIC-HOTGVXAUSA-N 1 2 324.424 4.525 20 0 DJADLO C[C@@H]1CCC[C@@H](N(C)C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000509148545 340262387 /nfs/dbraw/zinc/26/23/87/340262387.db2.gz AQMLFPUSNTYNIC-HZPDHXFCSA-N 1 2 324.424 4.525 20 0 DJADLO CCC(C)(C)c1ccc(C[N@H+](C)Cc2nccn2C(F)F)cc1 ZINC000509325230 340266331 /nfs/dbraw/zinc/26/63/31/340266331.db2.gz BGLDFMZMSZDZCY-UHFFFAOYSA-N 1 2 321.415 4.598 20 0 DJADLO CCC(C)(C)c1ccc(C[N@@H+](C)Cc2nccn2C(F)F)cc1 ZINC000509325230 340266332 /nfs/dbraw/zinc/26/63/32/340266332.db2.gz BGLDFMZMSZDZCY-UHFFFAOYSA-N 1 2 321.415 4.598 20 0 DJADLO CC[N@H+](Cc1csc(C(C)(C)C)n1)[C@H](C)c1cccc(O)c1 ZINC000509562368 340273503 /nfs/dbraw/zinc/27/35/03/340273503.db2.gz ZXPJZXMANCRRQW-CYBMUJFWSA-N 1 2 318.486 4.729 20 0 DJADLO CC[N@@H+](Cc1csc(C(C)(C)C)n1)[C@H](C)c1cccc(O)c1 ZINC000509562368 340273504 /nfs/dbraw/zinc/27/35/04/340273504.db2.gz ZXPJZXMANCRRQW-CYBMUJFWSA-N 1 2 318.486 4.729 20 0 DJADLO C[C@H](NC(=O)c1ccccc1Oc1cc[nH+]cc1)C1CCCCC1 ZINC000509935017 340283048 /nfs/dbraw/zinc/28/30/48/340283048.db2.gz QOYOYSCRHMSJGM-HNNXBMFYSA-N 1 2 324.424 4.573 20 0 DJADLO CC[C@@H]1CCC[C@@H](NC(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000509949488 340283681 /nfs/dbraw/zinc/28/36/81/340283681.db2.gz QMOXCNXYSHHALV-HZPDHXFCSA-N 1 2 324.424 4.573 20 0 DJADLO CC(C)Sc1ccc(C[N@@H+]2CCCC[C@H]2c2cc[nH]n2)cc1 ZINC000510136628 340290119 /nfs/dbraw/zinc/29/01/19/340290119.db2.gz XMKKEDRDAZCVOE-SFHVURJKSA-N 1 2 315.486 4.637 20 0 DJADLO CC(C)Sc1ccc(C[N@H+]2CCCC[C@H]2c2cc[nH]n2)cc1 ZINC000510136628 340290120 /nfs/dbraw/zinc/29/01/20/340290120.db2.gz XMKKEDRDAZCVOE-SFHVURJKSA-N 1 2 315.486 4.637 20 0 DJADLO CCC[C@H]1CCCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000510258851 340294363 /nfs/dbraw/zinc/29/43/63/340294363.db2.gz QODVTZIGRBQNRI-INIZCTEOSA-N 1 2 324.424 4.526 20 0 DJADLO CCc1ccc([C@@H](C)[NH2+]Cc2ccsc2Br)o1 ZINC000510991598 340317305 /nfs/dbraw/zinc/31/73/05/340317305.db2.gz JCEISLLPCJUKEV-SECBINFHSA-N 1 2 314.248 4.517 20 0 DJADLO CSc1ccccc1C[N@H+](C)Cc1nc2ccccc2s1 ZINC000511100442 340320755 /nfs/dbraw/zinc/32/07/55/340320755.db2.gz VPEDWGLDRKKWJB-UHFFFAOYSA-N 1 2 314.479 4.650 20 0 DJADLO CSc1ccccc1C[N@@H+](C)Cc1nc2ccccc2s1 ZINC000511100442 340320756 /nfs/dbraw/zinc/32/07/56/340320756.db2.gz VPEDWGLDRKKWJB-UHFFFAOYSA-N 1 2 314.479 4.650 20 0 DJADLO Fc1ccc2oc(C[N@@H+]3CC[C@H]3c3ccc(Cl)cc3)nc2c1 ZINC000511560794 340330648 /nfs/dbraw/zinc/33/06/48/340330648.db2.gz GUVLJHKAORDTNH-HNNXBMFYSA-N 1 2 316.763 4.567 20 0 DJADLO Fc1ccc2oc(C[N@H+]3CC[C@H]3c3ccc(Cl)cc3)nc2c1 ZINC000511560794 340330649 /nfs/dbraw/zinc/33/06/49/340330649.db2.gz GUVLJHKAORDTNH-HNNXBMFYSA-N 1 2 316.763 4.567 20 0 DJADLO C[C@H]([NH2+]Cc1c(Cl)oc2ccccc21)c1c(F)cncc1F ZINC000513042576 340390369 /nfs/dbraw/zinc/39/03/69/340390369.db2.gz YNPMLJPDGQQPNX-VIFPVBQESA-N 1 2 322.742 4.610 20 0 DJADLO C[C@H]([NH2+]Cc1ccc(Cl)c(Cl)c1)c1c(F)cncc1F ZINC000513084136 340392660 /nfs/dbraw/zinc/39/26/60/340392660.db2.gz SQMJTGPDCSAORH-QMMMGPOBSA-N 1 2 317.166 4.517 20 0 DJADLO CC[C@@H]([NH2+][C@H](C)c1noc(-c2ccccc2)n1)c1cccc(C)c1 ZINC000513659389 340417740 /nfs/dbraw/zinc/41/77/40/340417740.db2.gz BXRAWQOBNXRNIA-CRAIPNDOSA-N 1 2 321.424 4.847 20 0 DJADLO Clc1cnc(C[NH2+]C(c2ccccc2)c2ccccc2)s1 ZINC000225292685 340566237 /nfs/dbraw/zinc/56/62/37/340566237.db2.gz UMAXZOXPGLXPBL-UHFFFAOYSA-N 1 2 314.841 4.676 20 0 DJADLO C[C@@H](SCCc1[nH+]c2ccccc2n1C)c1ccc(F)cc1 ZINC000522830608 340607444 /nfs/dbraw/zinc/60/74/44/340607444.db2.gz IWFASWGVYAMFDI-CYBMUJFWSA-N 1 2 314.429 4.749 20 0 DJADLO CC[C@@H](CC(=O)Nc1c(C)cc(C)[nH+]c1C)c1ccc(C)cc1 ZINC000523100489 340615343 /nfs/dbraw/zinc/61/53/43/340615343.db2.gz SAUZRGYTHKVHKH-KRWDZBQOSA-N 1 2 310.441 4.838 20 0 DJADLO Clc1cccc(Cl)c1CSc1[nH+]cnc2[nH]ccc21 ZINC000524166699 340648987 /nfs/dbraw/zinc/64/89/87/340648987.db2.gz XBOZKIPATSJPFQ-UHFFFAOYSA-N 1 2 310.209 4.557 20 0 DJADLO COc1ccccc1[C@@H]([NH2+]Cc1ccccc1F)c1ccccc1 ZINC000237233337 340669126 /nfs/dbraw/zinc/66/91/26/340669126.db2.gz AQQIFJJRYNOGTA-NRFANRHFSA-N 1 2 321.395 4.714 20 0 DJADLO Cc1cccc([C@@H]([NH2+]Cc2noc(-c3ccccc3)n2)C(C)C)c1 ZINC000528766708 340733099 /nfs/dbraw/zinc/73/30/99/340733099.db2.gz NWEQVXGOXQZGGE-IBGZPJMESA-N 1 2 321.424 4.532 20 0 DJADLO CC[C@@H]([NH2+][C@@H](C)c1nc(C(C)C)no1)c1cc(C)ccc1C ZINC000528802006 340735043 /nfs/dbraw/zinc/73/50/43/340735043.db2.gz PWJWYAFJUFIJPN-GOEBONIOSA-N 1 2 301.434 4.612 20 0 DJADLO C[C@H](C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1)c1ccccc1 ZINC000124153220 340797475 /nfs/dbraw/zinc/79/74/75/340797475.db2.gz IMWHRVVGRZDNPS-HNNXBMFYSA-N 1 2 318.376 4.616 20 0 DJADLO CC[C@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1cccc(Cl)c1 ZINC000125288610 340803404 /nfs/dbraw/zinc/80/34/04/340803404.db2.gz IPBXKWXACJXCNO-AWEZNQCLSA-N 1 2 306.837 4.866 20 0 DJADLO Cc1cnc([C@@H](C)[NH2+][C@@H](C)c2ccc(SC(C)C)cc2)o1 ZINC000539302588 340880161 /nfs/dbraw/zinc/88/01/61/340880161.db2.gz AWRAKNOIIUHCIL-UONOGXRCSA-N 1 2 304.459 4.895 20 0 DJADLO C[C@H]([NH2+]Cc1csc(C2CCCC2)n1)c1c(F)cccc1F ZINC000540325500 340927092 /nfs/dbraw/zinc/92/70/92/340927092.db2.gz UXUPGPYKZIVJHW-NSHDSACASA-N 1 2 322.424 4.930 20 0 DJADLO c1coc([C@H]([NH2+]Cc2cnc(C3CCC3)s2)c2ccccc2)c1 ZINC000130183077 341005437 /nfs/dbraw/zinc/00/54/37/341005437.db2.gz PLUBRIPTPJDRDD-GOSISDBHSA-N 1 2 324.449 4.883 20 0 DJADLO Cc1cc([C@@H]([NH2+]Cc2ccccc2F)c2cccnc2)ccc1F ZINC000542477979 341009096 /nfs/dbraw/zinc/00/90/96/341009096.db2.gz CFZRISFQIGCPBH-HXUWFJFHSA-N 1 2 324.374 4.547 20 0 DJADLO CC(C)C[C@@H]([NH2+][C@@H](C)c1nc(C(C)C)no1)c1cccs1 ZINC000542557631 341013380 /nfs/dbraw/zinc/01/33/80/341013380.db2.gz WYQLKBIZCKIEDX-QWHCGFSZSA-N 1 2 307.463 4.693 20 0 DJADLO C[C@H]([NH2+]Cc1cc2ccccc2o1)c1ncc(-c2ccccc2)o1 ZINC000542574476 341014153 /nfs/dbraw/zinc/01/41/53/341014153.db2.gz OEGIGGRBIUIIME-AWEZNQCLSA-N 1 2 318.376 4.939 20 0 DJADLO Cc1c[nH]c(-c2ccccc2NC(=O)[C@@H](C)CCC(C)(C)C)[nH+]1 ZINC000542653783 341015873 /nfs/dbraw/zinc/01/58/73/341015873.db2.gz PRUTZRKXFJCYRQ-ZDUSSCGKSA-N 1 2 313.445 4.786 20 0 DJADLO C[C@@H](c1ccc(Cl)cc1)[N@H+](C)Cc1nc(C2CC2)cs1 ZINC000543139516 341033791 /nfs/dbraw/zinc/03/37/91/341033791.db2.gz NLQOKEVJZDICAQ-NSHDSACASA-N 1 2 306.862 4.867 20 0 DJADLO C[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1nc(C2CC2)cs1 ZINC000543139516 341033792 /nfs/dbraw/zinc/03/37/92/341033792.db2.gz NLQOKEVJZDICAQ-NSHDSACASA-N 1 2 306.862 4.867 20 0 DJADLO CCc1cnc(C[N@@H+]2CCC[C@H]2c2cccc(Cl)c2)s1 ZINC000543395571 341042090 /nfs/dbraw/zinc/04/20/90/341042090.db2.gz KEICMGWPNZMTLP-HNNXBMFYSA-N 1 2 306.862 4.696 20 0 DJADLO CCc1cnc(C[N@H+]2CCC[C@H]2c2cccc(Cl)c2)s1 ZINC000543395571 341042091 /nfs/dbraw/zinc/04/20/91/341042091.db2.gz KEICMGWPNZMTLP-HNNXBMFYSA-N 1 2 306.862 4.696 20 0 DJADLO CCc1cnc(C[N@@H+]2CCC[C@@H]2c2cccc(Cl)c2)s1 ZINC000543395572 341042155 /nfs/dbraw/zinc/04/21/55/341042155.db2.gz KEICMGWPNZMTLP-OAHLLOKOSA-N 1 2 306.862 4.696 20 0 DJADLO CCc1cnc(C[N@H+]2CCC[C@@H]2c2cccc(Cl)c2)s1 ZINC000543395572 341042156 /nfs/dbraw/zinc/04/21/56/341042156.db2.gz KEICMGWPNZMTLP-OAHLLOKOSA-N 1 2 306.862 4.696 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1ccon1)c1cc2c(ccc3ccccc23)o1 ZINC000543627160 341051781 /nfs/dbraw/zinc/05/17/81/341051781.db2.gz SJQNPFZDDGEZFD-QWHCGFSZSA-N 1 2 306.365 4.986 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1cc2c(ccc3ccccc23)o1)c1ccon1 ZINC000543627161 341051786 /nfs/dbraw/zinc/05/17/86/341051786.db2.gz SJQNPFZDDGEZFD-STQMWFEESA-N 1 2 306.365 4.986 20 0 DJADLO CC(C)c1cnc(C[N@H+](C)Cc2ccc(Cl)c(F)c2)s1 ZINC000544351890 341077651 /nfs/dbraw/zinc/07/76/51/341077651.db2.gz ZUZMPTCBZWFGLN-UHFFFAOYSA-N 1 2 312.841 4.691 20 0 DJADLO CC(C)c1cnc(C[N@@H+](C)Cc2ccc(Cl)c(F)c2)s1 ZINC000544351890 341077652 /nfs/dbraw/zinc/07/76/52/341077652.db2.gz ZUZMPTCBZWFGLN-UHFFFAOYSA-N 1 2 312.841 4.691 20 0 DJADLO Cc1ccc([C@@H]([NH2+]Cc2coc(-c3ccccc3)n2)C2CCC2)o1 ZINC000544577609 341086891 /nfs/dbraw/zinc/08/68/91/341086891.db2.gz LRHNUNVMZDVYKV-IBGZPJMESA-N 1 2 322.408 4.874 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1ccccc1OCc1ccccc1)c1ccon1 ZINC000544607220 341088523 /nfs/dbraw/zinc/08/85/23/341088523.db2.gz RPZMSXNRKSKPFI-JKSUJKDBSA-N 1 2 322.408 4.665 20 0 DJADLO CC[C@](C)([NH2+]Cc1ccc(F)cc1Cl)c1nc(C)cs1 ZINC000072863430 341109500 /nfs/dbraw/zinc/10/95/00/341109500.db2.gz VOSRZTMLFHGLIA-HNNXBMFYSA-N 1 2 312.841 4.659 20 0 DJADLO CC(C)c1nc([C@H](C)[NH2+][C@H]2COc3ccc(Cl)cc32)cs1 ZINC000545279225 341118918 /nfs/dbraw/zinc/11/89/18/341118918.db2.gz OFGZWODJNVWXFN-GWCFXTLKSA-N 1 2 322.861 4.704 20 0 DJADLO Cc1cccc(C)c1[C@@H](C)[NH2+]Cc1noc(C2CCCCC2)n1 ZINC000545518188 341128198 /nfs/dbraw/zinc/12/81/98/341128198.db2.gz FXUKBAHMPKQFSV-OAHLLOKOSA-N 1 2 313.445 4.585 20 0 DJADLO Cc1cccc(C)c1[C@H](C)[NH2+]Cc1noc(C2CCCCC2)n1 ZINC000545518187 341128272 /nfs/dbraw/zinc/12/82/72/341128272.db2.gz FXUKBAHMPKQFSV-HNNXBMFYSA-N 1 2 313.445 4.585 20 0 DJADLO FC(F)(F)Cn1cc[nH+]c1CSCC1CCCCCC1 ZINC000546048806 341152784 /nfs/dbraw/zinc/15/27/84/341152784.db2.gz MBZFHZPIWLHASN-UHFFFAOYSA-N 1 2 306.397 4.649 20 0 DJADLO Cc1cnc(C[N@H+](Cc2ccccc2Cl)C2CCCC2)o1 ZINC000075715894 341181230 /nfs/dbraw/zinc/18/12/30/341181230.db2.gz IPVUAYPMRZIXMP-UHFFFAOYSA-N 1 2 304.821 4.581 20 0 DJADLO Cc1cnc(C[N@@H+](Cc2ccccc2Cl)C2CCCC2)o1 ZINC000075715894 341181231 /nfs/dbraw/zinc/18/12/31/341181231.db2.gz IPVUAYPMRZIXMP-UHFFFAOYSA-N 1 2 304.821 4.581 20 0 DJADLO CC(C)c1nc([C@H](C)[NH2+][C@H]2CSc3ccccc32)cs1 ZINC000547398945 341211062 /nfs/dbraw/zinc/21/10/62/341211062.db2.gz GNQCJTLAFMEDIE-FZMZJTMJSA-N 1 2 304.484 4.764 20 0 DJADLO C[C@@H](c1ccco1)[N@H+](C)Cc1csc(-c2ccccc2F)n1 ZINC000077376389 341223937 /nfs/dbraw/zinc/22/39/37/341223937.db2.gz BJNJSFIMHXZNKL-LBPRGKRZSA-N 1 2 316.401 4.735 20 0 DJADLO C[C@@H](c1ccco1)[N@@H+](C)Cc1csc(-c2ccccc2F)n1 ZINC000077376389 341223938 /nfs/dbraw/zinc/22/39/38/341223938.db2.gz BJNJSFIMHXZNKL-LBPRGKRZSA-N 1 2 316.401 4.735 20 0 DJADLO c1coc(C[NH2+][C@H](c2cc3ccccc3o2)c2ccccc2)c1 ZINC000078268953 341239312 /nfs/dbraw/zinc/23/93/12/341239312.db2.gz DIONBUGAWIAGTA-FQEVSTJZSA-N 1 2 303.361 4.905 20 0 DJADLO CC1(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)CCCCC1 ZINC000548036783 341244109 /nfs/dbraw/zinc/24/41/09/341244109.db2.gz MFEFTBGISVJSAO-UHFFFAOYSA-N 1 2 310.397 4.783 20 0 DJADLO CCCCc1noc([C@H](C)[NH2+][C@H](C)c2cccc3ccccc32)n1 ZINC000079287803 341256213 /nfs/dbraw/zinc/25/62/13/341256213.db2.gz OJFHTFOWJBZDNJ-CABCVRRESA-N 1 2 323.440 4.977 20 0 DJADLO Cc1cc(F)ccc1C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000137800686 341280191 /nfs/dbraw/zinc/28/01/91/341280191.db2.gz FUTSDWYUCONEHY-UHFFFAOYSA-N 1 2 322.339 4.574 20 0 DJADLO CO[C@@H](C)c1nc(C[N@H+](C)[C@H](C)c2ccc(Cl)cc2)cs1 ZINC000245459677 341295583 /nfs/dbraw/zinc/29/55/83/341295583.db2.gz DRQUGKUKRWLGFM-NEPJUHHUSA-N 1 2 324.877 4.697 20 0 DJADLO CO[C@@H](C)c1nc(C[N@@H+](C)[C@H](C)c2ccc(Cl)cc2)cs1 ZINC000245459677 341295584 /nfs/dbraw/zinc/29/55/84/341295584.db2.gz DRQUGKUKRWLGFM-NEPJUHHUSA-N 1 2 324.877 4.697 20 0 DJADLO Cc1csc(C2([NH2+]Cc3c(F)cccc3Cl)CCCC2)n1 ZINC000081596060 341298370 /nfs/dbraw/zinc/29/83/70/341298370.db2.gz AWTBPNAWZKJBAS-UHFFFAOYSA-N 1 2 324.852 4.803 20 0 DJADLO Cc1sccc1CNc1ccc(-c2[nH+]cc3n2CCCC3)cc1 ZINC000549780711 341303053 /nfs/dbraw/zinc/30/30/53/341303053.db2.gz LOGCKXXAFPNGEV-UHFFFAOYSA-N 1 2 323.465 4.868 20 0 DJADLO CC[C@@H](C)Oc1cccc(N[C@H](c2[nH]cc[nH+]2)c2ccccc2)c1 ZINC000550855969 341324521 /nfs/dbraw/zinc/32/45/21/341324521.db2.gz GHCDFESFPVCFKD-BEFAXECRSA-N 1 2 321.424 4.789 20 0 DJADLO Cc1ccnc([C@@H](C)[NH2+][C@@H](C)c2nc(C(C)(C)C)cs2)c1 ZINC000552046487 341364770 /nfs/dbraw/zinc/36/47/70/341364770.db2.gz IZBMEOXNAJORCA-OLZOCXBDSA-N 1 2 303.475 4.556 20 0 DJADLO CC(C)c1ncc(C[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)s1 ZINC000552104137 341370045 /nfs/dbraw/zinc/37/00/45/341370045.db2.gz WRIHXICSGJSJTE-HNNXBMFYSA-N 1 2 306.862 4.867 20 0 DJADLO CC(C)c1ncc(C[N@H+]2CC[C@H]2c2ccc(Cl)cc2)s1 ZINC000552104137 341370046 /nfs/dbraw/zinc/37/00/46/341370046.db2.gz WRIHXICSGJSJTE-HNNXBMFYSA-N 1 2 306.862 4.867 20 0 DJADLO CCOc1cc(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)ccc1C ZINC000552262466 341382298 /nfs/dbraw/zinc/38/22/98/341382298.db2.gz XNOBJAKOETUHQJ-GOSISDBHSA-N 1 2 313.445 4.850 20 0 DJADLO Cc1ccnc([C@@H](C)Nc2cccc([NH+]3CCCCCC3)c2)c1 ZINC000552283859 341384093 /nfs/dbraw/zinc/38/40/93/341384093.db2.gz LNDSENCYXHIYDD-QGZVFWFLSA-N 1 2 309.457 4.944 20 0 DJADLO C[C@H]([NH2+][C@@H](c1nccn1C)C1CC1)c1cccc(Cl)c1Cl ZINC000552319941 341386296 /nfs/dbraw/zinc/38/62/96/341386296.db2.gz UMZBXWYGKKLJLA-ZUZCIYMTSA-N 1 2 324.255 4.529 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1nccn1C)C1CC1)c1cccc(Cl)c1Cl ZINC000552319940 341386316 /nfs/dbraw/zinc/38/63/16/341386316.db2.gz UMZBXWYGKKLJLA-MEBBXXQBSA-N 1 2 324.255 4.529 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1ccc(Cl)c(F)c1 ZINC000552327616 341386945 /nfs/dbraw/zinc/38/69/45/341386945.db2.gz AXJJECNKVAJRLL-IUCAKERBSA-N 1 2 314.738 4.564 20 0 DJADLO Cc1c2ccc(F)cc2sc1C(=O)Nc1ccc(C)[nH+]c1C ZINC000553641785 341433019 /nfs/dbraw/zinc/43/30/19/341433019.db2.gz IDPHPNKKCOBABT-UHFFFAOYSA-N 1 2 314.385 4.613 20 0 DJADLO CCc1nc(C)c(C[NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)o1 ZINC000291954743 341705349 /nfs/dbraw/zinc/70/53/49/341705349.db2.gz RGJZLHZUMHTXNU-FQEVSTJZSA-N 1 2 324.399 4.564 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1ccccc1)c1cccc(Cl)c1)c1cnccn1 ZINC000164507316 341705745 /nfs/dbraw/zinc/70/57/45/341705745.db2.gz WLFODTVXRGCBBZ-KUHUBIRLSA-N 1 2 323.827 4.570 20 0 DJADLO C[C@H]([NH2+]Cc1coc(-c2cccs2)n1)c1cc(F)cc(F)c1 ZINC000178660043 341961137 /nfs/dbraw/zinc/96/11/37/341961137.db2.gz MCRZNTULHBJOEA-JTQLQIEISA-N 1 2 320.364 4.532 20 0 DJADLO Cc1csc(C2([NH2+]Cc3ccc(C)cc3Cl)CCC2)n1 ZINC000578018603 341971879 /nfs/dbraw/zinc/97/18/79/341971879.db2.gz UFSLZAKNERHNKA-UHFFFAOYSA-N 1 2 306.862 4.582 20 0 DJADLO Cc1cnc(C[NH+]2Cc3ccccc3-c3ccccc3C2)s1 ZINC000357305444 518191626 /nfs/dbraw/zinc/19/16/26/518191626.db2.gz KPDZPSAWOTULOH-UHFFFAOYSA-N 1 2 306.434 4.634 20 0 DJADLO CC(C)n1ccnc1C[NH+](Cc1ccccc1)Cc1ccccc1 ZINC000337313360 520026478 /nfs/dbraw/zinc/02/64/78/520026478.db2.gz ADVXPEROTCYUAA-UHFFFAOYSA-N 1 2 319.452 4.666 20 0 DJADLO CC(C)n1ccnc1C[NH2+][C@@H](c1ccc(F)cc1F)C(C)(C)C ZINC000181621177 520031503 /nfs/dbraw/zinc/03/15/03/520031503.db2.gz FMKIMKMJLCFNGU-KRWDZBQOSA-N 1 2 321.415 4.619 20 0 DJADLO CC(C)n1cc[nH+]c1CNc1ccc(CCC(F)(F)F)cc1 ZINC000124760296 520033804 /nfs/dbraw/zinc/03/38/04/520033804.db2.gz ZHXQDYFHWUMDSA-UHFFFAOYSA-N 1 2 311.351 4.571 20 0 DJADLO CCc1ccc(C[N@H+](Cc2ccco2)Cc2cccs2)nc1 ZINC000338883405 523922166 /nfs/dbraw/zinc/92/21/66/523922166.db2.gz MOOVKLZRLHQKCF-UHFFFAOYSA-N 1 2 312.438 4.501 20 0 DJADLO CCc1ccc(C[N@@H+](Cc2ccco2)Cc2cccs2)nc1 ZINC000338883405 523922170 /nfs/dbraw/zinc/92/21/70/523922170.db2.gz MOOVKLZRLHQKCF-UHFFFAOYSA-N 1 2 312.438 4.501 20 0 DJADLO COc1ccc(F)cc1[C@@H](C)[NH2+][C@@H](C)c1csc(C(C)C)n1 ZINC000181019539 524330094 /nfs/dbraw/zinc/33/00/94/524330094.db2.gz BRWZCZPTYRXOFM-NEPJUHHUSA-N 1 2 322.449 4.826 20 0 DJADLO C[C@H]([NH2+]C1(c2ccccc2F)CC1)c1nc2c(s1)CCCC2 ZINC000182234568 525286311 /nfs/dbraw/zinc/28/63/11/525286311.db2.gz GMONCHAGHSMOPX-LBPRGKRZSA-N 1 2 316.445 4.501 20 0 DJADLO Cc1cc([C@@H](C)[NH2+]Cc2cc(COC(C)(C)C)on2)c(C)s1 ZINC000186821691 525466003 /nfs/dbraw/zinc/46/60/03/525466003.db2.gz RZGFBXKLYBMHBQ-GFCCVEGCSA-N 1 2 322.474 4.519 20 0 DJADLO Cc1c[nH+]ccc1NC(=O)N1CCCCC[C@@H]1c1ccccc1 ZINC000179854975 526238657 /nfs/dbraw/zinc/23/86/57/526238657.db2.gz CKEYRSCKGHMKTC-GOSISDBHSA-N 1 2 309.413 4.539 20 0 DJADLO c1cn(-c2ccc(NCc3csc4ccccc34)cc2)c[nH+]1 ZINC000338153334 526524012 /nfs/dbraw/zinc/52/40/12/526524012.db2.gz UPDGLFRXCGYORS-UHFFFAOYSA-N 1 2 305.406 4.699 20 0 DJADLO CC(C)c1noc([C@H](C)[NH2+][C@@H](C)c2cccc3ccccc32)n1 ZINC000079287812 185163503 /nfs/dbraw/zinc/16/35/03/185163503.db2.gz JSYWHFIYVUBJST-KBPBESRZSA-N 1 2 309.413 4.758 20 0 DJADLO CC(C)c1noc([C@@H](C)[NH2+][C@H](C)c2cccc3ccccc32)n1 ZINC000079287817 185163628 /nfs/dbraw/zinc/16/36/28/185163628.db2.gz JSYWHFIYVUBJST-ZIAGYGMSSA-N 1 2 309.413 4.758 20 0 DJADLO CC(C)c1nc([C@@H](C)[NH2+][C@H]2CCOc3ccc(F)cc32)cs1 ZINC000090048812 185279759 /nfs/dbraw/zinc/27/97/59/185279759.db2.gz CGLVFQVJRCRZAY-RISCZKNCSA-N 1 2 320.433 4.580 20 0 DJADLO C[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccc(F)cc1Cl ZINC000090459566 185297658 /nfs/dbraw/zinc/29/76/58/185297658.db2.gz IIFCPOJILFZWKY-SECBINFHSA-N 1 2 310.825 4.664 20 0 DJADLO C[C@@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1ccc(F)cc1Cl ZINC000090572196 185304363 /nfs/dbraw/zinc/30/43/63/185304363.db2.gz NESOMSKTUQNGAW-GFCCVEGCSA-N 1 2 321.827 4.642 20 0 DJADLO Cc1nc(C[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)cs1 ZINC000041010326 183155711 /nfs/dbraw/zinc/15/57/11/183155711.db2.gz VDBUPHCUFMSCLW-QMMMGPOBSA-N 1 2 301.242 4.609 20 0 DJADLO Cc1nc(C[NH2+][C@H](C)c2cc(Cl)ccc2Cl)cs1 ZINC000041010327 183155880 /nfs/dbraw/zinc/15/58/80/183155880.db2.gz VDBUPHCUFMSCLW-MRVPVSSYSA-N 1 2 301.242 4.609 20 0 DJADLO COc1ccccc1[C@H](C)[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC000324018810 533009989 /nfs/dbraw/zinc/00/99/89/533009989.db2.gz LLGAJUGXBPEEJC-HRAATJIYSA-N 1 2 318.420 4.530 20 0 DJADLO C(=C/c1ccccc1)\C[N@@H+]1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC000287590735 533350923 /nfs/dbraw/zinc/35/09/23/533350923.db2.gz YGFMJONRLOSIRF-RUJXFNLJSA-N 1 2 323.440 4.578 20 0 DJADLO C(=C/c1ccccc1)\C[N@H+]1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC000287590735 533350927 /nfs/dbraw/zinc/35/09/27/533350927.db2.gz YGFMJONRLOSIRF-RUJXFNLJSA-N 1 2 323.440 4.578 20 0 DJADLO COc1ccc(C)cc1[C@@H](C)[NH2+][C@H](C)c1nc2ccccc2o1 ZINC000272139608 130001764 /nfs/dbraw/zinc/00/17/64/130001764.db2.gz ZLERYLLDUNWNBM-ZIAGYGMSSA-N 1 2 310.397 4.557 20 0 DJADLO Cc1nnc([C@H](C)[N@H+](C)Cc2ccccc2-c2ccccc2)s1 ZINC000273202768 130098005 /nfs/dbraw/zinc/09/80/05/130098005.db2.gz SHRPZNLKKXASKQ-AWEZNQCLSA-N 1 2 323.465 4.707 20 0 DJADLO Cc1nnc([C@H](C)[N@@H+](C)Cc2ccccc2-c2ccccc2)s1 ZINC000273202768 130098007 /nfs/dbraw/zinc/09/80/07/130098007.db2.gz SHRPZNLKKXASKQ-AWEZNQCLSA-N 1 2 323.465 4.707 20 0 DJADLO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc(-c3ccccc3)o2)s1 ZINC000274288446 130223699 /nfs/dbraw/zinc/22/36/99/130223699.db2.gz ZUFHGFFDQGGDQR-NWDGAFQWSA-N 1 2 313.426 4.518 20 0 DJADLO Cc1csc(C2([NH2+][C@@H](C)c3csc(C(C)C)n3)CCC2)n1 ZINC000274470840 130236968 /nfs/dbraw/zinc/23/69/68/130236968.db2.gz PPCLQOLGCNVADM-LBPRGKRZSA-N 1 2 321.515 4.761 20 0 DJADLO Cc1nccnc1[C@H](C)[NH2+][C@H](C)c1cc(Cl)ccc1Cl ZINC000275669904 130359133 /nfs/dbraw/zinc/35/91/33/130359133.db2.gz HCJVAQPBTGYJTL-KOLCDFICSA-N 1 2 310.228 4.504 20 0 DJADLO Clc1ccc(C[N@H+](Cc2csc(C3CC3)n2)C2CC2)cc1 ZINC000340181891 131013242 /nfs/dbraw/zinc/01/32/42/131013242.db2.gz JKMLWWNBWCMNEF-UHFFFAOYSA-N 1 2 318.873 4.839 20 0 DJADLO Clc1ccc(C[N@@H+](Cc2csc(C3CC3)n2)C2CC2)cc1 ZINC000340181891 131013244 /nfs/dbraw/zinc/01/32/44/131013244.db2.gz JKMLWWNBWCMNEF-UHFFFAOYSA-N 1 2 318.873 4.839 20 0 DJADLO CCc1nnc(C[N@H+](CC(C)C)[C@@H](C)c2ccccc2Cl)o1 ZINC000284339190 131071507 /nfs/dbraw/zinc/07/15/07/131071507.db2.gz CCNABOLCAMOKKM-ZDUSSCGKSA-N 1 2 321.852 4.505 20 0 DJADLO CCc1nnc(C[N@@H+](CC(C)C)[C@@H](C)c2ccccc2Cl)o1 ZINC000284339190 131071510 /nfs/dbraw/zinc/07/15/10/131071510.db2.gz CCNABOLCAMOKKM-ZDUSSCGKSA-N 1 2 321.852 4.505 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1ccc(F)cc1Cl ZINC000285587041 131183597 /nfs/dbraw/zinc/18/35/97/131183597.db2.gz HOTUVTOKNIHLDT-IUCAKERBSA-N 1 2 314.738 4.564 20 0 DJADLO Cc1ccc(-c2csc(C[N@@H+](C)[C@H](C)c3cccnc3)n2)cc1 ZINC000285661215 131190382 /nfs/dbraw/zinc/19/03/82/131190382.db2.gz PDWYIBOLTMHGBW-OAHLLOKOSA-N 1 2 323.465 4.707 20 0 DJADLO Cc1ccc(-c2csc(C[N@H+](C)[C@H](C)c3cccnc3)n2)cc1 ZINC000285661215 131190383 /nfs/dbraw/zinc/19/03/83/131190383.db2.gz PDWYIBOLTMHGBW-OAHLLOKOSA-N 1 2 323.465 4.707 20 0 DJADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+][C@@H](C)c1c(F)cncc1F ZINC000285698660 131194543 /nfs/dbraw/zinc/19/45/43/131194543.db2.gz OSYYCIZQKIAGMO-NWDGAFQWSA-N 1 2 316.351 4.826 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1c(F)cncc1F)c1ccc(F)c(Cl)c1 ZINC000285738101 131197867 /nfs/dbraw/zinc/19/78/67/131197867.db2.gz QFQJPRQZOXAVEO-RKDXNWHRSA-N 1 2 314.738 4.564 20 0 DJADLO CCCN(C(=O)Nc1c(C)cc[nH+]c1C)[C@@H]1CCc2ccccc21 ZINC000287543562 131286638 /nfs/dbraw/zinc/28/66/38/131286638.db2.gz OKZRRBJDDQWDOA-GOSISDBHSA-N 1 2 323.440 4.630 20 0 DJADLO CC[C@H](C)N(Cc1ccccc1)C(=O)Nc1c(C)cc[nH+]c1C ZINC000287596177 131288787 /nfs/dbraw/zinc/28/87/87/131288787.db2.gz RTGNDGNWNCKCBB-HNNXBMFYSA-N 1 2 311.429 4.531 20 0 DJADLO CCOCc1ccccc1CNc1[nH+]ccc2ccc(F)cc21 ZINC000340260884 131299556 /nfs/dbraw/zinc/29/95/56/131299556.db2.gz SBBAAVZKKSCHEZ-UHFFFAOYSA-N 1 2 310.372 4.523 20 0 DJADLO C[C@H]([NH2+][C@H](c1c(Cl)cccc1Cl)C1CC1)c1cnccn1 ZINC000289366534 131378756 /nfs/dbraw/zinc/37/87/56/131378756.db2.gz AHYYVTVPKJEASZ-QFYYESIMSA-N 1 2 322.239 4.585 20 0 DJADLO Clc1cccc(Cl)c1[C@@H]([NH2+]Cc1ccccn1)C1CC1 ZINC000290009099 131444689 /nfs/dbraw/zinc/44/46/89/131444689.db2.gz ZLEZHQVQRBNMEN-INIZCTEOSA-N 1 2 307.224 4.629 20 0 DJADLO Cc1nc(C[N@@H+](C)[C@@H](C)c2cccc(C(F)(F)F)c2)cs1 ZINC000340671938 132140365 /nfs/dbraw/zinc/14/03/65/132140365.db2.gz FFTHNUSQZUOMDF-JTQLQIEISA-N 1 2 314.376 4.663 20 0 DJADLO Cc1nc(C[N@H+](C)[C@@H](C)c2cccc(C(F)(F)F)c2)cs1 ZINC000340671938 132140367 /nfs/dbraw/zinc/14/03/67/132140367.db2.gz FFTHNUSQZUOMDF-JTQLQIEISA-N 1 2 314.376 4.663 20 0 DJADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2csc(C)n2)o1 ZINC000340691979 132158790 /nfs/dbraw/zinc/15/87/90/132158790.db2.gz URWWIGKVQHJYHQ-WBMJQRKESA-N 1 2 304.459 4.580 20 0 DJADLO CCc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2csc(C)n2)o1 ZINC000340691979 132158792 /nfs/dbraw/zinc/15/87/92/132158792.db2.gz URWWIGKVQHJYHQ-WBMJQRKESA-N 1 2 304.459 4.580 20 0 DJADLO Cc1ccc2sc(-c3nc(Cc4ccc(C)[nH+]c4)no3)cc2c1 ZINC000570608430 332780081 /nfs/dbraw/zinc/78/00/81/332780081.db2.gz XCUMJMDZKSBHBG-UHFFFAOYSA-N 1 2 321.405 4.554 20 0 DJADLO COc1cccc(F)c1[C@@H](C)[NH2+][C@@H](C)c1ccc(F)cc1F ZINC000174231329 332849689 /nfs/dbraw/zinc/84/96/89/332849689.db2.gz XWPZCKXIEUIMPJ-WDEREUQCSA-N 1 2 309.331 4.524 20 0 DJADLO CC(C)OCc1ccccc1CNc1cc(C(F)(F)F)cc[nH+]1 ZINC000530934381 331637253 /nfs/dbraw/zinc/63/72/53/331637253.db2.gz DRVQGHNMCNWJCJ-UHFFFAOYSA-N 1 2 324.346 4.638 20 0 DJADLO CCc1nc([C@@H](C)[NH2+][C@@H]2CCOc3c(Cl)cccc32)cs1 ZINC000162342762 332934697 /nfs/dbraw/zinc/93/46/97/332934697.db2.gz WYKRZDBZMVKWDX-ZWNOBZJWSA-N 1 2 322.861 4.533 20 0 DJADLO O=C(Nc1ccc(-c2c[nH]c[nH+]2)cc1)c1ccc(C2CCC2)cc1 ZINC000558726197 331939430 /nfs/dbraw/zinc/93/94/30/331939430.db2.gz FRTAFRDJRAUQLF-UHFFFAOYSA-N 1 2 317.392 4.597 20 0 DJADLO CC(C)c1cnc(C[NH2+]Cc2cc(C3CC3)ccc2F)s1 ZINC000449372662 332087423 /nfs/dbraw/zinc/08/74/23/332087423.db2.gz KIYYCPXOQWVKAG-UHFFFAOYSA-N 1 2 304.434 4.573 20 0 DJADLO CC[C@@H]([NH2+]Cc1c(Cl)oc2ccccc21)c1nccs1 ZINC000133203099 332138218 /nfs/dbraw/zinc/13/82/18/332138218.db2.gz ZAYPQCMCFLZABZ-GFCCVEGCSA-N 1 2 306.818 4.784 20 0 DJADLO Cc1cnc(C[N@@H+]2CCCCC[C@@H]2c2ccc(Cl)cc2)nc1 ZINC000536367922 332233389 /nfs/dbraw/zinc/23/33/89/332233389.db2.gz CMCYTXAJUDLWCS-QGZVFWFLSA-N 1 2 315.848 4.556 20 0 DJADLO Cc1cnc(C[N@H+]2CCCCC[C@@H]2c2ccc(Cl)cc2)nc1 ZINC000536367922 332233391 /nfs/dbraw/zinc/23/33/91/332233391.db2.gz CMCYTXAJUDLWCS-QGZVFWFLSA-N 1 2 315.848 4.556 20 0 DJADLO CC(C)c1cnc(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccccc2)s1 ZINC000560569183 332360965 /nfs/dbraw/zinc/36/09/65/332360965.db2.gz SXQLSQCMKVBCIM-SFHVURJKSA-N 1 2 312.482 4.994 20 0 DJADLO CC(C)c1cnc(C[N@H+]2CC3(CCC3)[C@@H]2c2ccccc2)s1 ZINC000560569183 332360967 /nfs/dbraw/zinc/36/09/67/332360967.db2.gz SXQLSQCMKVBCIM-SFHVURJKSA-N 1 2 312.482 4.994 20 0 DJADLO CC[C@@H](c1ccncc1)[N@H+](C)Cc1csc(-c2ccccc2)n1 ZINC000560638866 332371979 /nfs/dbraw/zinc/37/19/79/332371979.db2.gz TWFUHOCZVNQVDG-SFHVURJKSA-N 1 2 323.465 4.788 20 0 DJADLO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1csc(-c2ccccc2)n1 ZINC000560638866 332371981 /nfs/dbraw/zinc/37/19/81/332371981.db2.gz TWFUHOCZVNQVDG-SFHVURJKSA-N 1 2 323.465 4.788 20 0 DJADLO Cc1nc(C(C)C)oc1C[NH2+][C@H](C)c1ccc(F)cc1Cl ZINC000428332395 332487912 /nfs/dbraw/zinc/48/79/12/332487912.db2.gz RBOASBLLYCOOMG-SNVBAGLBSA-N 1 2 310.800 4.750 20 0 DJADLO Cc1cc(C)c(NC(=O)N(C)[C@H]2CCCc3ccccc32)c(C)[nH+]1 ZINC000562892607 332636957 /nfs/dbraw/zinc/63/69/57/332636957.db2.gz NVTKWNVFPFAYBH-SFHVURJKSA-N 1 2 323.440 4.548 20 0 DJADLO Clc1sccc1C[NH2+]Cc1ccsc1Br ZINC000380169398 333031756 /nfs/dbraw/zinc/03/17/56/333031756.db2.gz GLAFQVWVZKABJC-UHFFFAOYSA-N 1 2 322.680 4.515 20 0 DJADLO CCO[C@@H](C)c1nc(C[NH2+][C@H](C)c2ccc(C)c(F)c2)cs1 ZINC000181368435 333029503 /nfs/dbraw/zinc/02/95/03/333029503.db2.gz SFZHYQKSRFKKPR-OLZOCXBDSA-N 1 2 322.449 4.539 20 0 DJADLO C[C@@H]([NH2+]Cc1ncc(Cl)cc1Cl)c1cc2ccccc2o1 ZINC000182647816 333044481 /nfs/dbraw/zinc/04/44/81/333044481.db2.gz DNXWQXIZDVGMQN-SNVBAGLBSA-N 1 2 321.207 4.985 20 0 DJADLO c1c(CNc2ccc(SC3CCCC3)cc2)[nH+]c2ccccn12 ZINC000378905679 333062321 /nfs/dbraw/zinc/06/23/21/333062321.db2.gz FACYSIDFJRWYAE-UHFFFAOYSA-N 1 2 323.465 4.981 20 0 DJADLO Cc1nc(N[C@H](c2ccccc2)c2ccc(Cl)cc2)cc[nH+]1 ZINC000462921997 333131813 /nfs/dbraw/zinc/13/18/13/333131813.db2.gz FPPAVOSAWBRKBG-GOSISDBHSA-N 1 2 309.800 4.640 20 0 DJADLO Cc1cccc([C@@H](C)[NH2+][C@H](C)c2nc(C3CCCCC3)no2)c1 ZINC000185266476 335124514 /nfs/dbraw/zinc/12/45/14/335124514.db2.gz BKHKYUBGSIXKDV-HUUCEWRRSA-N 1 2 313.445 4.838 20 0 DJADLO C[C@@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1ccccc1F ZINC000119586146 333255540 /nfs/dbraw/zinc/25/55/40/333255540.db2.gz PPIWRINQWWAJNZ-FOIQADDNSA-N 1 2 306.384 4.661 20 0 DJADLO CC[C@@H]([NH2+][C@@H](C)c1nc2c(s1)CCC2)c1cc(F)ccc1F ZINC000502057910 333284397 /nfs/dbraw/zinc/28/43/97/333284397.db2.gz NRRRJVWQQLIWID-IINYFYTJSA-N 1 2 322.424 4.712 20 0 DJADLO CC(C)c1nc(C[N@@H+]2CC[C@@H](C)C[C@@H]2c2ccco2)cs1 ZINC000525781996 333307245 /nfs/dbraw/zinc/30/72/45/333307245.db2.gz NMJDKSFIVMOVHK-UKRRQHHQSA-N 1 2 304.459 4.833 20 0 DJADLO CC(C)c1nc(C[N@H+]2CC[C@@H](C)C[C@@H]2c2ccco2)cs1 ZINC000525781996 333307246 /nfs/dbraw/zinc/30/72/46/333307246.db2.gz NMJDKSFIVMOVHK-UKRRQHHQSA-N 1 2 304.459 4.833 20 0 DJADLO Cc1nc(C[N@H+](Cc2ccc3ccccc3c2)C2CC2)cs1 ZINC000525782680 333307554 /nfs/dbraw/zinc/30/75/54/333307554.db2.gz VBSJULWDVWYYOQ-UHFFFAOYSA-N 1 2 308.450 4.769 20 0 DJADLO Cc1nc(C[N@@H+](Cc2ccc3ccccc3c2)C2CC2)cs1 ZINC000525782680 333307556 /nfs/dbraw/zinc/30/75/56/333307556.db2.gz VBSJULWDVWYYOQ-UHFFFAOYSA-N 1 2 308.450 4.769 20 0 DJADLO CCc1cnc(C[N@H+](C)Cc2ccc(Cl)c(Cl)c2)s1 ZINC000531342976 333345187 /nfs/dbraw/zinc/34/51/87/333345187.db2.gz DPQWZSAJVGRIEC-UHFFFAOYSA-N 1 2 315.269 4.644 20 0 DJADLO CCc1cnc(C[N@@H+](C)Cc2ccc(Cl)c(Cl)c2)s1 ZINC000531342976 333345188 /nfs/dbraw/zinc/34/51/88/333345188.db2.gz DPQWZSAJVGRIEC-UHFFFAOYSA-N 1 2 315.269 4.644 20 0 DJADLO CCn1cc[nH+]c1CNc1cccc(COC(C)(C)CC)c1C ZINC000531403716 333349907 /nfs/dbraw/zinc/34/99/07/333349907.db2.gz PCAPYONCKWBKGP-UHFFFAOYSA-N 1 2 315.461 4.529 20 0 DJADLO Cc1nnc([C@H](C)[NH2+][C@H](C)c2cccc(Cl)c2Cl)s1 ZINC000274262769 333486004 /nfs/dbraw/zinc/48/60/04/333486004.db2.gz VDPYUJPANUPRKC-SFYZADRCSA-N 1 2 316.257 4.565 20 0 DJADLO CCOc1ccccc1[C@@H](C)[NH2+]Cc1c(F)cccc1Cl ZINC000531694291 333546556 /nfs/dbraw/zinc/54/65/56/333546556.db2.gz ICIBMZHHXPQYFM-GFCCVEGCSA-N 1 2 307.796 4.729 20 0 DJADLO CCOc1cccc(Cl)c1C[NH2+][C@@](C)(CC)c1nccs1 ZINC000563348882 333594104 /nfs/dbraw/zinc/59/41/04/333594104.db2.gz CVNTYESOFFQKFW-INIZCTEOSA-N 1 2 324.877 4.610 20 0 DJADLO Cc1ccc(C(=O)N2[C@@H](C)CCC2(C)C)cc1Oc1cc[nH+]cc1 ZINC000411094906 333632811 /nfs/dbraw/zinc/63/28/11/333632811.db2.gz XUHVCMSJXQVAGC-HNNXBMFYSA-N 1 2 324.424 4.585 20 0 DJADLO CCn1cc[nH+]c1[C@H](C)Nc1ccc(-c2cnc(C3CC3)o2)cc1 ZINC000571614514 333821154 /nfs/dbraw/zinc/82/11/54/333821154.db2.gz JQOUSXNUBWRZPL-ZDUSSCGKSA-N 1 2 322.412 4.609 20 0 DJADLO CCc1nc(C)c([C@@H](C)[N@H+](C)Cc2nc(C3CC3)cs2)s1 ZINC000343536236 335170446 /nfs/dbraw/zinc/17/04/46/335170446.db2.gz RSADBGDSSRPJOE-LLVKDONJSA-N 1 2 321.515 4.541 20 0 DJADLO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2nc(C3CC3)cs2)s1 ZINC000343536236 335170447 /nfs/dbraw/zinc/17/04/47/335170447.db2.gz RSADBGDSSRPJOE-LLVKDONJSA-N 1 2 321.515 4.541 20 0 DJADLO C[C@H](Nc1cccc([NH+]2CCCCCC2)c1)c1cscn1 ZINC000272272050 334032642 /nfs/dbraw/zinc/03/26/42/334032642.db2.gz OYEGWGJXNKIRCV-AWEZNQCLSA-N 1 2 301.459 4.697 20 0 DJADLO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2cc(Cl)cc(Cl)c2)s1 ZINC000274269998 334058640 /nfs/dbraw/zinc/05/86/40/334058640.db2.gz WNQQOAPORKCBHW-HTQZYQBOSA-N 1 2 316.257 4.565 20 0 DJADLO CCC(CC)c1cc(C[NH2+]Cc2ncc(C(C)(C)C)s2)on1 ZINC000279097675 334105428 /nfs/dbraw/zinc/10/54/28/334105428.db2.gz IYAHEYBGZSPMPP-UHFFFAOYSA-N 1 2 321.490 4.622 20 0 DJADLO C[C@H]([NH2+][C@@H]1C[C@H](C)n2ccnc21)c1cc(Cl)sc1Cl ZINC000453356178 334256328 /nfs/dbraw/zinc/25/63/28/334256328.db2.gz OZBYRUJQXBTVQG-OYNCUSHFSA-N 1 2 316.257 4.608 20 0 DJADLO C[C@@H](c1nc2ccccc2s1)[N@H+](C)Cc1ccccc1F ZINC000302608082 334287604 /nfs/dbraw/zinc/28/76/04/334287604.db2.gz XFLXOZWYWPOKHX-LBPRGKRZSA-N 1 2 300.402 4.628 20 0 DJADLO C[C@@H](c1nc2ccccc2s1)[N@@H+](C)Cc1ccccc1F ZINC000302608082 334287606 /nfs/dbraw/zinc/28/76/06/334287606.db2.gz XFLXOZWYWPOKHX-LBPRGKRZSA-N 1 2 300.402 4.628 20 0 DJADLO C[C@H](c1cccc(Cl)c1)[N@H+](C)Cc1csc(C2CC2)n1 ZINC000534689538 334330787 /nfs/dbraw/zinc/33/07/87/334330787.db2.gz BCEDNRNWWFIRPI-LLVKDONJSA-N 1 2 306.862 4.867 20 0 DJADLO C[C@H](c1cccc(Cl)c1)[N@@H+](C)Cc1csc(C2CC2)n1 ZINC000534689538 334330788 /nfs/dbraw/zinc/33/07/88/334330788.db2.gz BCEDNRNWWFIRPI-LLVKDONJSA-N 1 2 306.862 4.867 20 0 DJADLO Cc1cnc(C[N@@H+](Cc2ccc(Cl)c(Cl)c2)C(C)C)nc1 ZINC000534812020 334338206 /nfs/dbraw/zinc/33/82/06/334338206.db2.gz AMLQETINLONEHQ-UHFFFAOYSA-N 1 2 324.255 4.502 20 0 DJADLO Cc1cnc(C[N@H+](Cc2ccc(Cl)c(Cl)c2)C(C)C)nc1 ZINC000534812020 334338207 /nfs/dbraw/zinc/33/82/07/334338207.db2.gz AMLQETINLONEHQ-UHFFFAOYSA-N 1 2 324.255 4.502 20 0 DJADLO C[C@@H]1CCC[C@@H](C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000303938006 334346594 /nfs/dbraw/zinc/34/65/94/334346594.db2.gz WTZNPVMZZBGQPY-HUUCEWRRSA-N 1 2 310.397 4.639 20 0 DJADLO C[N@@H+](Cc1cscn1)Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC000535084859 334367010 /nfs/dbraw/zinc/36/70/10/334367010.db2.gz TTXWBPXLMYXDTP-UHFFFAOYSA-N 1 2 318.829 4.689 20 0 DJADLO C[N@H+](Cc1cscn1)Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC000535084859 334367011 /nfs/dbraw/zinc/36/70/11/334367011.db2.gz TTXWBPXLMYXDTP-UHFFFAOYSA-N 1 2 318.829 4.689 20 0 DJADLO Fc1cccc([C@@H]([NH2+]Cc2ccc(Cl)o2)c2ccccc2)c1 ZINC000532039960 334382100 /nfs/dbraw/zinc/38/21/00/334382100.db2.gz NXQZEHFPKAAFKH-SFHVURJKSA-N 1 2 315.775 4.951 20 0 DJADLO Cc1ccc(N[C@@H](c2[nH]cc[nH+]2)c2ccc(F)cc2)cc1Cl ZINC000188312250 334684781 /nfs/dbraw/zinc/68/47/81/334684781.db2.gz YUWROMPCOXCNEI-MRXNPFEDSA-N 1 2 315.779 4.712 20 0 DJADLO Clc1cccc(Cl)c1C[NH2+]Cc1ccc2c(n1)CCCC2 ZINC000444010215 338466928 /nfs/dbraw/zinc/46/69/28/338466928.db2.gz OLRNSYFAQAKVCX-UHFFFAOYSA-N 1 2 321.251 4.557 20 0 DJADLO Cc1cnc(C[NH2+][C@H](CC(F)(F)F)c2ccccc2C)s1 ZINC000444792601 338489136 /nfs/dbraw/zinc/48/91/36/338489136.db2.gz PXRKMNHAYXSMCM-CYBMUJFWSA-N 1 2 314.376 4.543 20 0 DJADLO Cc1cc[nH+]cc1CCCNc1ccccc1SC(C)C ZINC000519231016 335820153 /nfs/dbraw/zinc/82/01/53/335820153.db2.gz YVGWTJXSFKOXPC-UHFFFAOYSA-N 1 2 300.471 4.935 20 0 DJADLO Cc1ccc(C)c([C@H](C)[NH2+][C@@H](C)c2noc(-c3ccccc3)n2)c1 ZINC000532246130 335925945 /nfs/dbraw/zinc/92/59/45/335925945.db2.gz KRXOKQSNRDINPC-HOTGVXAUSA-N 1 2 321.424 4.765 20 0 DJADLO CSCc1cnc(C[N@@H+]2CC[C@H](C)C[C@@H]2c2ccco2)s1 ZINC000351699884 336059711 /nfs/dbraw/zinc/05/97/11/336059711.db2.gz HECXGNNXYISNST-GXTWGEPZSA-N 1 2 322.499 4.572 20 0 DJADLO CSCc1cnc(C[N@H+]2CC[C@H](C)C[C@@H]2c2ccco2)s1 ZINC000351699884 336059713 /nfs/dbraw/zinc/05/97/13/336059713.db2.gz HECXGNNXYISNST-GXTWGEPZSA-N 1 2 322.499 4.572 20 0 DJADLO Cc1c[nH]c(-c2ccccc2NC(=O)C2CCC(C)(C)CC2)[nH+]1 ZINC000332077786 336157501 /nfs/dbraw/zinc/15/75/01/336157501.db2.gz ZUOQZLGEAGNGHO-UHFFFAOYSA-N 1 2 311.429 4.540 20 0 DJADLO Cc1ccc([C@@H](C)[NH2+]Cc2noc(C3CCCCC3)n2)cc1C ZINC000332293782 336166702 /nfs/dbraw/zinc/16/67/02/336166702.db2.gz LXHIFZQQGCMQLX-OAHLLOKOSA-N 1 2 313.445 4.585 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H](CC(C)C)c1ccccc1 ZINC000351944610 336181935 /nfs/dbraw/zinc/18/19/35/336181935.db2.gz VIZFGEWUHHEEIC-QGZVFWFLSA-N 1 2 311.429 4.607 20 0 DJADLO COc1c2ccccc2oc1CNc1[nH+]ccc2ccc(F)cc21 ZINC000352594614 336226169 /nfs/dbraw/zinc/22/61/69/336226169.db2.gz JUGZIZCOHKODGQ-UHFFFAOYSA-N 1 2 322.339 4.741 20 0 DJADLO Brc1ccccc1CNc1ccc2ccccc2[nH+]1 ZINC000042316096 336238889 /nfs/dbraw/zinc/23/88/89/336238889.db2.gz UBHKJEYPTMIQGF-UHFFFAOYSA-N 1 2 313.198 4.609 20 0 DJADLO CC[C@H](c1ccc(F)cc1F)[N@@H+]1CCO[C@H](c2ccsc2)C1 ZINC000532344199 336243426 /nfs/dbraw/zinc/24/34/26/336243426.db2.gz AVWGTSWDNSMICD-SJORKVTESA-N 1 2 323.408 4.551 20 0 DJADLO CC[C@H](c1ccc(F)cc1F)[N@H+]1CCO[C@H](c2ccsc2)C1 ZINC000532344199 336243427 /nfs/dbraw/zinc/24/34/27/336243427.db2.gz AVWGTSWDNSMICD-SJORKVTESA-N 1 2 323.408 4.551 20 0 DJADLO C[C@@H](c1ccc(Cl)cc1)[N@@H+]1CCO[C@H](c2cccs2)C1 ZINC000532379406 336244188 /nfs/dbraw/zinc/24/41/88/336244188.db2.gz KEFHRLJLMHYGTO-WFASDCNBSA-N 1 2 307.846 4.536 20 0 DJADLO C[C@@H](c1ccc(Cl)cc1)[N@H+]1CCO[C@H](c2cccs2)C1 ZINC000532379406 336244189 /nfs/dbraw/zinc/24/41/89/336244189.db2.gz KEFHRLJLMHYGTO-WFASDCNBSA-N 1 2 307.846 4.536 20 0 DJADLO C[C@H]1c2cc(Cl)cc(Cl)c2CC[N@H+]1Cc1ccncc1 ZINC000532646273 336265682 /nfs/dbraw/zinc/26/56/82/336265682.db2.gz AOKFSNUZXPKGGU-NSHDSACASA-N 1 2 307.224 4.508 20 0 DJADLO C[C@H]1c2cc(Cl)cc(Cl)c2CC[N@@H+]1Cc1ccncc1 ZINC000532646273 336265683 /nfs/dbraw/zinc/26/56/83/336265683.db2.gz AOKFSNUZXPKGGU-NSHDSACASA-N 1 2 307.224 4.508 20 0 DJADLO CCc1ccc(C[NH2+][C@@H](c2ccco2)c2ccccc2OC)cc1 ZINC000532675787 336266235 /nfs/dbraw/zinc/26/62/35/336266235.db2.gz HQQNYHMTLWYWLP-OAQYLSRUSA-N 1 2 321.420 4.730 20 0 DJADLO CCc1nc(C[NH+]2CCC(=Cc3cccc(F)c3)CC2)cs1 ZINC000532748360 336269576 /nfs/dbraw/zinc/26/95/76/336269576.db2.gz CFCOQXMHHKGGKP-UHFFFAOYSA-N 1 2 316.445 4.524 20 0 DJADLO C[C@H](CCC(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1)c1ccccc1 ZINC000532756556 336269878 /nfs/dbraw/zinc/26/98/78/336269878.db2.gz DIMHTKYDMDWNBA-OAHLLOKOSA-N 1 2 319.408 4.599 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)no1)c1cc2ccccc2o1 ZINC000182628301 336276631 /nfs/dbraw/zinc/27/66/31/336276631.db2.gz PVAAPGZQFLWHLG-RYUDHWBXSA-N 1 2 313.401 4.525 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1nc2ccccc2o1)c1cc2ccccc2o1 ZINC000182627831 336276662 /nfs/dbraw/zinc/27/66/62/336276662.db2.gz MIBXDUKIHYALEA-STQMWFEESA-N 1 2 306.365 4.986 20 0 DJADLO CSc1ccc(N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000192901164 336282920 /nfs/dbraw/zinc/28/29/20/336282920.db2.gz DBGHOQLGPDIFLF-AWEZNQCLSA-N 1 2 309.438 4.767 20 0 DJADLO Cc1cc(N[C@@H](C)c2ccccc2Cl)nc(-c2cccnc2)[nH+]1 ZINC000301070023 336288313 /nfs/dbraw/zinc/28/83/13/336288313.db2.gz BXPQKWKSIYQICF-ZDUSSCGKSA-N 1 2 324.815 4.674 20 0 DJADLO Cc1cc(N[C@@H](c2ccccc2)c2ccccn2)nc(C(C)C)[nH+]1 ZINC000301080777 336288842 /nfs/dbraw/zinc/28/88/42/336288842.db2.gz NNRWIDHZAOUYNQ-IBGZPJMESA-N 1 2 318.424 4.505 20 0 DJADLO c1ccc([C@H](Nc2ccc3ccccc3[nH+]2)c2ccccn2)cc1 ZINC000301171965 336293184 /nfs/dbraw/zinc/29/31/84/336293184.db2.gz KRLJGYUXDRYFLR-NRFANRHFSA-N 1 2 311.388 4.831 20 0 DJADLO Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)Nc1cccc[nH+]1 ZINC000301174194 336293373 /nfs/dbraw/zinc/29/33/73/336293373.db2.gz FMXLZGPRRLCSKN-ZDUSSCGKSA-N 1 2 309.438 4.995 20 0 DJADLO Cc1cc(N[C@H](c2nccs2)c2ccccc2)nc(C(C)C)[nH+]1 ZINC000301187864 336294106 /nfs/dbraw/zinc/29/41/06/336294106.db2.gz KNRJRCOTXBCQMM-INIZCTEOSA-N 1 2 324.453 4.566 20 0 DJADLO Cc1cc(N[C@H](c2ccsc2)c2ccc(Cl)cc2)nc[nH+]1 ZINC000301232913 336295923 /nfs/dbraw/zinc/29/59/23/336295923.db2.gz BPRBBXYZDOOKOM-INIZCTEOSA-N 1 2 315.829 4.701 20 0 DJADLO Fc1ccc([C@H](Nc2cc[nH+]c(C3CC3)n2)c2ccccc2)cc1 ZINC000301254793 336297094 /nfs/dbraw/zinc/29/70/94/336297094.db2.gz QTWSUGHNFZYAOY-LJQANCHMSA-N 1 2 319.383 4.695 20 0 DJADLO c1csc([C@H](Cc2ccccc2)Nc2cc[nH+]c(C3CC3)n2)c1 ZINC000301326120 336300729 /nfs/dbraw/zinc/30/07/29/336300729.db2.gz YTUPGBDVDOEZLW-INIZCTEOSA-N 1 2 321.449 4.811 20 0 DJADLO C[C@@H](Nc1cc[nH+]c(C(C)(C)C)n1)c1ncc(-c2ccccc2)o1 ZINC000301566792 336315388 /nfs/dbraw/zinc/31/53/88/336315388.db2.gz JTPZHVDOISCQRW-CYBMUJFWSA-N 1 2 322.412 4.602 20 0 DJADLO CCOc1ccc([C@H](C)Nc2cc(C(F)(F)F)cc[nH+]2)cc1 ZINC000301590589 336316914 /nfs/dbraw/zinc/31/69/14/336316914.db2.gz QKPBNHYHOHDZFT-NSHDSACASA-N 1 2 310.319 4.672 20 0 DJADLO Cc1cc(N[C@@H](C)c2ncc(-c3ccccc3)o2)nc(C(C)C)[nH+]1 ZINC000301636780 336319800 /nfs/dbraw/zinc/31/98/00/336319800.db2.gz FHUMWZLMXWUOHU-AWEZNQCLSA-N 1 2 322.412 4.737 20 0 DJADLO Cc1cc2ccccc2[nH+]c1N1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000301737419 336326551 /nfs/dbraw/zinc/32/65/51/336326551.db2.gz VUVCMKVFNRUVLG-RDTXWAMCSA-N 1 2 324.449 4.571 20 0 DJADLO Cc1cc2ccccc2[nH+]c1N[C@H](C)C[C@@H](O)c1cccs1 ZINC000301788621 336329935 /nfs/dbraw/zinc/32/99/35/336329935.db2.gz MGWBYAVBNVUPHR-CZUORRHYSA-N 1 2 312.438 4.529 20 0 DJADLO CC(C)c1cc(NCc2nccc3ccccc32)nc(C(C)C)[nH+]1 ZINC000301873037 336335476 /nfs/dbraw/zinc/33/54/76/336335476.db2.gz LCMPIXAZPJYFMF-UHFFFAOYSA-N 1 2 320.440 4.884 20 0 DJADLO CCc1nc([C@@H](C)Nc2cc(C(C)C)[nH+]c(C(C)C)n2)cs1 ZINC000301881440 336335904 /nfs/dbraw/zinc/33/59/04/336335904.db2.gz WAVWRWGUVRDOSU-GFCCVEGCSA-N 1 2 318.490 4.915 20 0 DJADLO CC(C)c1nsc(Nc2cccc(Oc3cc[nH+]cc3)c2)n1 ZINC000301953937 336339731 /nfs/dbraw/zinc/33/97/31/336339731.db2.gz KBPOBUKBOLNLHY-UHFFFAOYSA-N 1 2 312.398 4.592 20 0 DJADLO CC[C@@H](Nc1cccc[nH+]1)c1cc(F)cc(Br)c1 ZINC000302037357 336344640 /nfs/dbraw/zinc/34/46/40/336344640.db2.gz VDNIKGROVPLUQL-CYBMUJFWSA-N 1 2 309.182 4.546 20 0 DJADLO CC[C@H](Nc1cccc[nH+]1)c1cc(F)cc(Br)c1 ZINC000302037358 336344769 /nfs/dbraw/zinc/34/47/69/336344769.db2.gz VDNIKGROVPLUQL-ZDUSSCGKSA-N 1 2 309.182 4.546 20 0 DJADLO C[C@@H]1CCN(c2cc(C(F)(F)F)cc[nH+]2)[C@@H](c2ccco2)C1 ZINC000302040365 336344803 /nfs/dbraw/zinc/34/48/03/336344803.db2.gz NKWQDCOOCCDJCY-DGCLKSJQSA-N 1 2 310.319 4.671 20 0 DJADLO Cc1cc2ccccc2[nH+]c1N1C[C@H](C)C[C@H]1c1cccnc1 ZINC000302124395 336349681 /nfs/dbraw/zinc/34/96/81/336349681.db2.gz HSOOLLABSZILCA-KUHUBIRLSA-N 1 2 303.409 4.526 20 0 DJADLO Cc1cc2ccccc2[nH+]c1N[C@@H]1CCO[C@H](c2ccccc2)C1 ZINC000302157633 336351418 /nfs/dbraw/zinc/35/14/18/336351418.db2.gz FUQZQBSMGSTKIA-QUCCMNQESA-N 1 2 318.420 4.875 20 0 DJADLO CC(C)c1cc(N2C[C@@H](C)C[C@@H]2c2cccnc2)nc(C(C)C)[nH+]1 ZINC000302164538 336351827 /nfs/dbraw/zinc/35/18/27/336351827.db2.gz ZLQNSGJYLRZCBO-MAUKXSAKSA-N 1 2 324.472 4.706 20 0 DJADLO Cc1cc(N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)nc[nH+]1 ZINC000302214562 336354371 /nfs/dbraw/zinc/35/43/71/336354371.db2.gz GPGUFEYFIPFRQO-OAHLLOKOSA-N 1 2 321.346 4.535 20 0 DJADLO CC(C)n1ccc(C[NH2+][C@H](C)c2ccc(-c3ccccc3)o2)n1 ZINC000514643321 336389738 /nfs/dbraw/zinc/38/97/38/336389738.db2.gz BTNCTFXBJLBPSC-OAHLLOKOSA-N 1 2 309.413 4.575 20 0 DJADLO CCc1nc([C@H](C)Nc2[nH+]ccc3ccc(F)cc32)cs1 ZINC000354327089 336467031 /nfs/dbraw/zinc/46/70/31/336467031.db2.gz GFXDXFSLSOXTMT-JTQLQIEISA-N 1 2 301.390 4.566 20 0 DJADLO CC(C)c1nc([C@H](C)[NH2+][C@@H]2c3ccc(F)cc3O[C@H]2C)cs1 ZINC000368586307 336848516 /nfs/dbraw/zinc/84/85/16/336848516.db2.gz XNOWYWUQWJVPOH-MMPTUQATSA-N 1 2 320.433 4.578 20 0 DJADLO C[C@@H]([NH2+][C@H](c1ccsc1)c1ccc(Cl)cc1)c1ncc[nH]1 ZINC000375895870 337022396 /nfs/dbraw/zinc/02/23/96/337022396.db2.gz QNWVPZGAPUYTGC-ABAIWWIYSA-N 1 2 317.845 4.565 20 0 DJADLO COc1ccccc1[C@@H](C)[NH2+][C@H](c1nccs1)c1ccccc1 ZINC000123179324 337038936 /nfs/dbraw/zinc/03/89/36/337038936.db2.gz GQLIVBAEYJBVOS-KDOFPFPSSA-N 1 2 324.449 4.592 20 0 DJADLO COc1ccc([C@@H](C)[NH2+][C@@H](c2nccs2)c2ccccc2)cc1 ZINC000123300912 337044419 /nfs/dbraw/zinc/04/44/19/337044419.db2.gz UXAOFGZFOBOAGP-RDTXWAMCSA-N 1 2 324.449 4.592 20 0 DJADLO COc1ccc([C@H](C)[NH2+][C@@H](c2nccs2)c2ccccc2)cc1 ZINC000123300694 337044421 /nfs/dbraw/zinc/04/44/21/337044421.db2.gz UXAOFGZFOBOAGP-KBXCAEBGSA-N 1 2 324.449 4.592 20 0 DJADLO C[C@@H]([NH2+][C@H](c1cc2ccccc2o1)c1ccccc1)c1ncc[nH]1 ZINC000377126774 337047294 /nfs/dbraw/zinc/04/72/94/337047294.db2.gz LGSVFOAKQPWONT-KUHUBIRLSA-N 1 2 317.392 4.596 20 0 DJADLO C[C@@H](N[C@H](c1cc2ccccc2o1)c1ccccc1)c1[nH]cc[nH+]1 ZINC000377126774 337047295 /nfs/dbraw/zinc/04/72/95/337047295.db2.gz LGSVFOAKQPWONT-KUHUBIRLSA-N 1 2 317.392 4.596 20 0 DJADLO C[C@H]([NH2+]Cc1nc(-c2ccccc2)c[nH]1)c1ccccc1Cl ZINC000194218348 337083035 /nfs/dbraw/zinc/08/30/35/337083035.db2.gz DECYISAINDEFIR-ZDUSSCGKSA-N 1 2 311.816 4.581 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1)c1ncc(-c2ccccc2)o1 ZINC000172581912 337130053 /nfs/dbraw/zinc/13/00/53/337130053.db2.gz XALDIWKZWLDEEC-UONOGXRCSA-N 1 2 310.372 4.893 20 0 DJADLO Cc1cccc([C@@H](C)[NH2+][C@@H](c2nccs2)c2ccccc2)c1 ZINC000173266778 337133924 /nfs/dbraw/zinc/13/39/24/337133924.db2.gz IHHWJVZYZSFFRV-CRAIPNDOSA-N 1 2 308.450 4.892 20 0 DJADLO Cc1cc(C)cc(C[NH2+][C@H](C)c2nc(C3CCCCC3)no2)c1 ZINC000173865129 337138741 /nfs/dbraw/zinc/13/87/41/337138741.db2.gz KHPYLYZGPBSUHQ-OAHLLOKOSA-N 1 2 313.445 4.585 20 0 DJADLO CC[C@@H]([NH2+][C@@H](C)c1ncc(-c2ccccc2)o1)c1nccs1 ZINC000174116277 337139337 /nfs/dbraw/zinc/13/93/37/337139337.db2.gz QFOKFYROYQVPTN-GXTWGEPZSA-N 1 2 313.426 4.600 20 0 DJADLO Fc1ccc2c(c1)[C@@H]([NH2+][C@@H](c1nccs1)c1ccccc1)CC2 ZINC000177695563 337158512 /nfs/dbraw/zinc/15/85/12/337158512.db2.gz CYESRUYMIAPDPM-ZWKOTPCHSA-N 1 2 324.424 4.649 20 0 DJADLO CC[C@@H]([NH2+]Cc1coc(-c2cccs2)n1)c1ccccc1F ZINC000180242907 337175516 /nfs/dbraw/zinc/17/55/16/337175516.db2.gz MWDXMKCRQKMMSZ-OAHLLOKOSA-N 1 2 316.401 4.783 20 0 DJADLO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1ncc(C(C)C)s1)CCC2 ZINC000183070360 337191166 /nfs/dbraw/zinc/19/11/66/337191166.db2.gz VVVIOVOBJNUXJV-ZDUSSCGKSA-N 1 2 321.515 4.541 20 0 DJADLO Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1ncc(C(C)C)s1)CCC2 ZINC000183070360 337191167 /nfs/dbraw/zinc/19/11/67/337191167.db2.gz VVVIOVOBJNUXJV-ZDUSSCGKSA-N 1 2 321.515 4.541 20 0 DJADLO CC(C)n1c[nH+]cc1CNc1ccccc1Cc1ccccc1 ZINC000321454086 337265629 /nfs/dbraw/zinc/26/56/29/337265629.db2.gz FVAGNTNZALKKSS-UHFFFAOYSA-N 1 2 305.425 4.667 20 0 DJADLO Cc1cccc2c1OCC[C@H]2[NH2+][C@@H](C)c1csc(C(C)C)n1 ZINC000189370134 337278977 /nfs/dbraw/zinc/27/89/77/337278977.db2.gz WNSGZDUBZYTXGM-DZGCQCFKSA-N 1 2 316.470 4.749 20 0 DJADLO Cc1cc([C@H](C)Nc2[nH+]ccc(C)c2Br)c(C)o1 ZINC000235541894 337310186 /nfs/dbraw/zinc/31/01/86/337310186.db2.gz NEKXUDDIQFIXIU-JTQLQIEISA-N 1 2 309.207 4.535 20 0 DJADLO Cc1nc([C@H](C)[NH2+][C@H](C)c2ccccc2OC(C)C)cs1 ZINC000037118921 337363168 /nfs/dbraw/zinc/36/31/68/337363168.db2.gz NYCQYTUEQRMHFX-OLZOCXBDSA-N 1 2 304.459 4.651 20 0 DJADLO CCc1nc(C[N@@H+](C)[C@H](CC)c2ccc(F)cc2F)cs1 ZINC000532925583 337393050 /nfs/dbraw/zinc/39/30/50/337393050.db2.gz BCLSDPPNLBPRIY-OAHLLOKOSA-N 1 2 310.413 4.567 20 0 DJADLO CCc1nc(C[N@H+](C)[C@H](CC)c2ccc(F)cc2F)cs1 ZINC000532925583 337393051 /nfs/dbraw/zinc/39/30/51/337393051.db2.gz BCLSDPPNLBPRIY-OAHLLOKOSA-N 1 2 310.413 4.567 20 0 DJADLO FC(F)(F)c1cc(CNc2cccc[nH+]2)cc(C(F)(F)F)c1 ZINC000532934275 337393936 /nfs/dbraw/zinc/39/39/36/337393936.db2.gz VUFQUDIXBBSLOH-UHFFFAOYSA-N 1 2 320.236 4.731 20 0 DJADLO COCc1nc(CSCc2ccc(C(C)C)[nH+]c2C)cs1 ZINC000419426389 337484066 /nfs/dbraw/zinc/48/40/66/337484066.db2.gz FXSPDDKHFRWCCQ-UHFFFAOYSA-N 1 2 322.499 4.550 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1csc(-c2ccccc2)n1)c1cscn1 ZINC000572017023 337586834 /nfs/dbraw/zinc/58/68/34/337586834.db2.gz QEFTUPJNKFYKHT-VXGBXAGGSA-N 1 2 315.467 4.678 20 0 DJADLO C[C@@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1cc2ccccc2o1 ZINC000161861204 337598127 /nfs/dbraw/zinc/59/81/27/337598127.db2.gz RNLKDUAFWGEJGH-CQSZACIVSA-N 1 2 318.376 4.939 20 0 DJADLO CCOc1ccc(Cl)cc1[C@H](C)[NH2+][C@H](C)c1nc(C)cs1 ZINC000162339948 337615013 /nfs/dbraw/zinc/61/50/13/337615013.db2.gz MYVLMVUIEFHAKF-NWDGAFQWSA-N 1 2 324.877 4.915 20 0 DJADLO C[C@@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc(F)cc1OC(F)F ZINC000423214656 337704714 /nfs/dbraw/zinc/70/47/14/337704714.db2.gz LPULKKYVHBCMQU-SNVBAGLBSA-N 1 2 322.330 4.568 20 0 DJADLO C[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1cc(Br)cs1 ZINC000423222157 337705657 /nfs/dbraw/zinc/70/56/57/337705657.db2.gz ZXTIBGQVXNVOFW-VIFPVBQESA-N 1 2 323.259 4.652 20 0 DJADLO Fc1cc(NCc2ccc(C(F)F)cc2)ccc1-n1cc[nH+]c1 ZINC000527512589 337748264 /nfs/dbraw/zinc/74/82/64/337748264.db2.gz OTHDSVWOXJDDDH-UHFFFAOYSA-N 1 2 317.314 4.561 20 0 DJADLO CC[C@H]([NH2+][C@@H](C)c1ncccc1F)c1cccc(Cl)c1F ZINC000528035395 337782360 /nfs/dbraw/zinc/78/23/60/337782360.db2.gz HDONPNOVKQJEAH-HZMBPMFUSA-N 1 2 310.775 4.815 20 0 DJADLO Cc1ccc(OC(F)F)c([C@H](C)[NH2+][C@@H](C)c2ncccc2F)c1 ZINC000528035944 337782362 /nfs/dbraw/zinc/78/23/62/337782362.db2.gz MMOCGWXGUOJJOV-RYUDHWBXSA-N 1 2 324.346 4.542 20 0 DJADLO CCc1nc([C@H](C)[NH2+][C@H](C)c2ccc(OC)cc2Cl)cs1 ZINC000424327704 337821593 /nfs/dbraw/zinc/82/15/93/337821593.db2.gz ZIGZWFYSZNKELF-MNOVXSKESA-N 1 2 324.877 4.779 20 0 DJADLO Cc1nc(C(C)(C)[NH2+]Cc2cc(Cl)ccc2F)sc1C ZINC000119287076 337856037 /nfs/dbraw/zinc/85/60/37/337856037.db2.gz XNOJHCGWHYLYJA-UHFFFAOYSA-N 1 2 312.841 4.577 20 0 DJADLO C[C@@H]([NH2+][C@H](c1ccco1)c1ccccc1)c1cc(F)cc(F)c1 ZINC000120837069 337881403 /nfs/dbraw/zinc/88/14/03/337881403.db2.gz LQENEJCSVRFVIE-YJYMSZOUSA-N 1 2 313.347 4.998 20 0 DJADLO COc1cc(C)[nH+]c(CSCc2csc(C(C)(C)C)n2)c1 ZINC000537422657 337935748 /nfs/dbraw/zinc/93/57/48/337935748.db2.gz NTOBWOQQWSUMPX-UHFFFAOYSA-N 1 2 322.499 4.586 20 0 DJADLO CSCc1cccc(N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000537531676 337940873 /nfs/dbraw/zinc/94/08/73/337940873.db2.gz SXNTZCZEYNLXPU-OAHLLOKOSA-N 1 2 323.465 4.908 20 0 DJADLO CCOc1ccccc1[C@@H](CC(C)C)[NH2+][C@H](C)c1cc(C)on1 ZINC000514895464 337973481 /nfs/dbraw/zinc/97/34/81/337973481.db2.gz YISFQBAVZJFJKM-CRAIPNDOSA-N 1 2 316.445 4.820 20 0 DJADLO c1c[nH]c([C@@H]([NH2+]Cc2ccc3sccc3c2)c2ccccc2)n1 ZINC000515493283 337990886 /nfs/dbraw/zinc/99/08/86/337990886.db2.gz PNNFVFLTBVWCOM-SFHVURJKSA-N 1 2 319.433 4.504 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)CCCCCc1ccc(F)cc1 ZINC000425596765 338015771 /nfs/dbraw/zinc/01/57/71/338015771.db2.gz PCUCTZCLAVQPQL-UHFFFAOYSA-N 1 2 314.404 4.579 20 0 DJADLO Cc1nc(C(C)C)oc1C[N@H+](C)[C@H](C)c1cc(F)ccc1F ZINC000428469583 338054029 /nfs/dbraw/zinc/05/40/29/338054029.db2.gz VTWLCVNBEKEPPF-GFCCVEGCSA-N 1 2 308.372 4.578 20 0 DJADLO Cc1nc(C(C)C)oc1C[N@@H+](C)[C@H](C)c1cc(F)ccc1F ZINC000428469583 338054030 /nfs/dbraw/zinc/05/40/30/338054030.db2.gz VTWLCVNBEKEPPF-GFCCVEGCSA-N 1 2 308.372 4.578 20 0 DJADLO C[C@@H]([NH2+]Cc1nc2ccc(F)cc2s1)c1ccc(F)cc1F ZINC000428863624 338063104 /nfs/dbraw/zinc/06/31/04/338063104.db2.gz RISPGPIRSTXLHI-SECBINFHSA-N 1 2 322.355 4.564 20 0 DJADLO c1nc(C[NH2+][C@H](c2ccccc2)c2ccc3ccccc3c2)co1 ZINC000428865999 338063330 /nfs/dbraw/zinc/06/33/30/338063330.db2.gz XKRGRVMQDIZRMK-OAQYLSRUSA-N 1 2 314.388 4.707 20 0 DJADLO C[C@H]([NH2+]Cc1nc2ccc(F)cc2s1)c1c(F)cccc1F ZINC000428869544 338063678 /nfs/dbraw/zinc/06/36/78/338063678.db2.gz BQZFXCPTJBZYGC-VIFPVBQESA-N 1 2 322.355 4.564 20 0 DJADLO CCc1nc([C@H](C)[NH2+]Cc2ccc(C(F)(F)F)s2)cs1 ZINC000428891426 338064622 /nfs/dbraw/zinc/06/46/22/338064622.db2.gz XVCOQLGOIMCPBT-QMMMGPOBSA-N 1 2 320.405 4.637 20 0 DJADLO CC(C)([NH2+]Cc1csc(C2CCCC2)n1)c1ccccc1F ZINC000429265908 338075259 /nfs/dbraw/zinc/07/52/59/338075259.db2.gz RTIGZMSLDYOTAF-UHFFFAOYSA-N 1 2 318.461 4.965 20 0 DJADLO C[C@@H](c1cccc(Cl)c1)[N@H+](C)Cc1cc(C(C)(C)C)on1 ZINC000429726326 338088510 /nfs/dbraw/zinc/08/85/10/338088510.db2.gz PNMUGASTHVDMPT-LBPRGKRZSA-N 1 2 306.837 4.819 20 0 DJADLO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)Cc1cc(C(C)(C)C)on1 ZINC000429726326 338088511 /nfs/dbraw/zinc/08/85/11/338088511.db2.gz PNMUGASTHVDMPT-LBPRGKRZSA-N 1 2 306.837 4.819 20 0 DJADLO Clc1c2ccccc2sc1C[N@@H+]1CCC[C@H]1c1cc[nH]n1 ZINC000429723827 338088540 /nfs/dbraw/zinc/08/85/40/338088540.db2.gz VSRAFWJEMGMELG-ZDUSSCGKSA-N 1 2 317.845 4.615 20 0 DJADLO Clc1c2ccccc2sc1C[N@H+]1CCC[C@H]1c1cc[nH]n1 ZINC000429723827 338088541 /nfs/dbraw/zinc/08/85/41/338088541.db2.gz VSRAFWJEMGMELG-ZDUSSCGKSA-N 1 2 317.845 4.615 20 0 DJADLO C[C@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1ccc(Cl)s1 ZINC000429784687 338089939 /nfs/dbraw/zinc/08/99/39/338089939.db2.gz JYVFWEBRRIONHD-LURJTMIESA-N 1 2 323.742 4.809 20 0 DJADLO C[C@@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1cccc(Cl)c1 ZINC000429809933 338090386 /nfs/dbraw/zinc/09/03/86/338090386.db2.gz NVBLFKOLROZJPW-MRVPVSSYSA-N 1 2 317.713 4.747 20 0 DJADLO CCc1occc1C(=O)Nc1ccc(Oc2cc[nH+]cc2)c(C)c1 ZINC000430828860 338116354 /nfs/dbraw/zinc/11/63/54/338116354.db2.gz VYMFXRBFZYNUNX-UHFFFAOYSA-N 1 2 322.364 4.590 20 0 DJADLO C[C@@H]([NH2+]Cc1cc(F)c(Cl)cc1F)c1cc(F)ccc1F ZINC000432509875 338158078 /nfs/dbraw/zinc/15/80/78/338158078.db2.gz OSAWCLHORUNRTC-MRVPVSSYSA-N 1 2 317.713 4.747 20 0 DJADLO C[C@H](c1ccco1)[N@H+](Cc1nc2ccc(F)cc2s1)C1CC1 ZINC000432739183 338165294 /nfs/dbraw/zinc/16/52/94/338165294.db2.gz WTPVRWNDPZWWRR-LLVKDONJSA-N 1 2 316.401 4.754 20 0 DJADLO C[C@H](c1ccco1)[N@@H+](Cc1nc2ccc(F)cc2s1)C1CC1 ZINC000432739183 338165295 /nfs/dbraw/zinc/16/52/95/338165295.db2.gz WTPVRWNDPZWWRR-LLVKDONJSA-N 1 2 316.401 4.754 20 0 DJADLO Fc1cc(C[NH2+]Cc2ccsc2Cl)c(F)cc1Cl ZINC000433193855 338185068 /nfs/dbraw/zinc/18/50/68/338185068.db2.gz SQDVNLVOHQBEEO-UHFFFAOYSA-N 1 2 308.180 4.623 20 0 DJADLO CCOc1ccc(Cl)cc1[C@H](C)[NH2+][C@@H](C)c1nccs1 ZINC000153346771 338222821 /nfs/dbraw/zinc/22/28/21/338222821.db2.gz ZWVWJXLGDSEIOC-QWRGUYRKSA-N 1 2 310.850 4.607 20 0 DJADLO CCC[N@H+](Cc1ncc(C(F)(F)F)s1)Cc1ccccc1 ZINC000434832628 338226119 /nfs/dbraw/zinc/22/61/19/338226119.db2.gz GHEMDIYFOJOFJE-UHFFFAOYSA-N 1 2 314.376 4.574 20 0 DJADLO CCC[N@@H+](Cc1ncc(C(F)(F)F)s1)Cc1ccccc1 ZINC000434832628 338226120 /nfs/dbraw/zinc/22/61/20/338226120.db2.gz GHEMDIYFOJOFJE-UHFFFAOYSA-N 1 2 314.376 4.574 20 0 DJADLO CC(C)[N@H+](Cc1ncc(C(F)(F)F)s1)Cc1ccccc1 ZINC000434832629 338226140 /nfs/dbraw/zinc/22/61/40/338226140.db2.gz GKXXXKONFIXJRE-UHFFFAOYSA-N 1 2 314.376 4.573 20 0 DJADLO CC(C)[N@@H+](Cc1ncc(C(F)(F)F)s1)Cc1ccccc1 ZINC000434832629 338226141 /nfs/dbraw/zinc/22/61/41/338226141.db2.gz GKXXXKONFIXJRE-UHFFFAOYSA-N 1 2 314.376 4.573 20 0 DJADLO Cc1nc(C[NH2+][C@H](C)c2cc(Cl)ccc2Cl)sc1C ZINC000153961344 338234435 /nfs/dbraw/zinc/23/44/35/338234435.db2.gz DEBSZSPADWFQGX-SECBINFHSA-N 1 2 315.269 4.918 20 0 DJADLO COc1cccc2c(N3CCC[C@@H]3c3ccsc3)cc[nH+]c12 ZINC000436190130 338261239 /nfs/dbraw/zinc/26/12/39/338261239.db2.gz YXOWGEDAVFCJKD-OAHLLOKOSA-N 1 2 310.422 4.646 20 0 DJADLO Cc1ccc(NC(=O)Nc2cc(Cl)cc(Cl)c2)c(C)[nH+]1 ZINC000436384664 338270269 /nfs/dbraw/zinc/27/02/69/338270269.db2.gz GMBNOFKHRCLYID-UHFFFAOYSA-N 1 2 310.184 4.649 20 0 DJADLO CC(F)(F)c1cccc(NCc2c[nH+]c3ccc(Cl)cn23)c1 ZINC000436410114 338271449 /nfs/dbraw/zinc/27/14/49/338271449.db2.gz ONYRPOFKSTUHAN-UHFFFAOYSA-N 1 2 321.758 4.712 20 0 DJADLO Cc1cc(C)c(NC(=O)N[C@@H](C)c2ccc(Cl)cc2)c(C)[nH+]1 ZINC000436485930 338273794 /nfs/dbraw/zinc/27/37/94/338273794.db2.gz AYXCWWRQIURDOD-LBPRGKRZSA-N 1 2 317.820 4.543 20 0 DJADLO Cc1cc(C)c(NC(=O)N2CCC[C@H]2C2CCCCC2)c(C)[nH+]1 ZINC000436485182 338273890 /nfs/dbraw/zinc/27/38/90/338273890.db2.gz AAKFXNMGJVHSDE-KRWDZBQOSA-N 1 2 315.461 4.583 20 0 DJADLO CCCC[C@H](CC)CSCc1[nH+]ccn1CC(F)(F)F ZINC000437274411 338305621 /nfs/dbraw/zinc/30/56/21/338305621.db2.gz GNYANXUBJXHTHF-LBPRGKRZSA-N 1 2 308.413 4.895 20 0 DJADLO Cc1cccc([C@@H](C)SCc2[nH+]ccn2CC(F)(F)F)c1 ZINC000437418066 338309504 /nfs/dbraw/zinc/30/95/04/338309504.db2.gz LKQFSBXUAZXTIT-GFCCVEGCSA-N 1 2 314.376 4.748 20 0 DJADLO CCSCc1cc[nH+]c(N[C@H]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000437802535 338322228 /nfs/dbraw/zinc/32/22/28/338322228.db2.gz REMAIBGPRFGJSW-STQMWFEESA-N 1 2 318.408 4.868 20 0 DJADLO COCc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(Cl)cc2F)o1 ZINC000437959676 338326481 /nfs/dbraw/zinc/32/64/81/338326481.db2.gz CXYQMZABQABRDP-MRXNPFEDSA-N 1 2 323.795 4.556 20 0 DJADLO COCc1ccc([C@H]2CCC[N@H+]2Cc2ccc(Cl)cc2F)o1 ZINC000437959676 338326482 /nfs/dbraw/zinc/32/64/82/338326482.db2.gz CXYQMZABQABRDP-MRXNPFEDSA-N 1 2 323.795 4.556 20 0 DJADLO Cc1ccc(Cl)cc1NCc1c[nH+]cn1Cc1ccccc1 ZINC000438329074 338339723 /nfs/dbraw/zinc/33/97/23/338339723.db2.gz PGBVSCCHJMFUQH-UHFFFAOYSA-N 1 2 311.816 4.505 20 0 DJADLO Cc1cc(C)c(NC(=O)[C@@H](C)c2ccc3ccccc3c2)c(C)[nH+]1 ZINC000439781134 338377785 /nfs/dbraw/zinc/37/77/85/338377785.db2.gz MLFOYZAVIUUZAE-HNNXBMFYSA-N 1 2 318.420 4.902 20 0 DJADLO Cc1cc(C)c(NC(=O)[C@H](C)c2ccc3ccccc3c2)c(C)[nH+]1 ZINC000439781135 338377914 /nfs/dbraw/zinc/37/79/14/338377914.db2.gz MLFOYZAVIUUZAE-OAHLLOKOSA-N 1 2 318.420 4.902 20 0 DJADLO CC(C)CC(C)(C)C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000439820716 338379049 /nfs/dbraw/zinc/37/90/49/338379049.db2.gz UGGOOXMCVGVWCU-UHFFFAOYSA-N 1 2 312.413 4.885 20 0 DJADLO Cc1ccc(-c2cnc(C[NH2+]C3(c4ccc(F)cc4)CC3)o2)cc1 ZINC000440297661 338385217 /nfs/dbraw/zinc/38/52/17/338385217.db2.gz WFNPFVMCEHIDDH-UHFFFAOYSA-N 1 2 322.383 4.568 20 0 DJADLO CC[C@H](F)C[N@@H+]1CCC[C@@H]1c1nc(-c2ccc(Cl)cc2)c[nH]1 ZINC000440795297 338397701 /nfs/dbraw/zinc/39/77/01/338397701.db2.gz ICTBYFHEPCFXFT-GOEBONIOSA-N 1 2 321.827 4.615 20 0 DJADLO CC[C@H](F)C[N@H+]1CCC[C@@H]1c1nc(-c2ccc(Cl)cc2)c[nH]1 ZINC000440795297 338397702 /nfs/dbraw/zinc/39/77/02/338397702.db2.gz ICTBYFHEPCFXFT-GOEBONIOSA-N 1 2 321.827 4.615 20 0 DJADLO Cc1ccc(NC(=O)N2CCCC3(C2)CCCCCC3)c(C)[nH+]1 ZINC000447176808 338547032 /nfs/dbraw/zinc/54/70/32/338547032.db2.gz SGXWJDYVJXTDFR-UHFFFAOYSA-N 1 2 315.461 4.667 20 0 DJADLO Cc1ccc(NC(=O)N[C@@H](CC(C)C)c2cccs2)c(C)[nH+]1 ZINC000447188304 338547191 /nfs/dbraw/zinc/54/71/91/338547191.db2.gz WVGJWYLWKDHLBG-HNNXBMFYSA-N 1 2 317.458 4.669 20 0 DJADLO CC(C)Cc1ccc([C@@H]([NH2+][C@H](C)c2csnn2)C2CC2)cc1 ZINC000450683651 338698834 /nfs/dbraw/zinc/69/88/34/338698834.db2.gz HKJXKWNTXXVAHU-FZKQIMNGSA-N 1 2 315.486 4.539 20 0 DJADLO C[C@H]([NH2+][C@@H]1C[C@H](C)n2ccnc21)c1cc(Cl)ccc1Cl ZINC000453078121 338790999 /nfs/dbraw/zinc/79/09/99/338790999.db2.gz BPMQTKGWUCJHID-PKFCDNJMSA-N 1 2 310.228 4.547 20 0 DJADLO CC[C@@H]([NH2+][C@@H](c1ccco1)c1ccccc1OC)c1ccncc1 ZINC000453154818 338800455 /nfs/dbraw/zinc/80/04/55/338800455.db2.gz ARDZNVKQMLPFAO-YLJYHZDGSA-N 1 2 322.408 4.514 20 0 DJADLO Cc1c(COC(C)(C)C)cccc1N[C@H]1C[C@H](C)n2cc[nH+]c21 ZINC000453165570 338801710 /nfs/dbraw/zinc/80/17/10/338801710.db2.gz MZIMOAOUDCSTSQ-GUYCJALGSA-N 1 2 313.445 4.625 20 0 DJADLO C[C@@H]([NH2+][C@@H]1C[C@H](C)n2ccnc21)c1cc(Cl)ccc1Cl ZINC000453194710 338805809 /nfs/dbraw/zinc/80/58/09/338805809.db2.gz BPMQTKGWUCJHID-IMSIIYSGSA-N 1 2 310.228 4.547 20 0 DJADLO c1cn2c([nH+]1)[C@@H](Nc1cccc(CSC3CCCC3)c1)CC2 ZINC000453196204 338806175 /nfs/dbraw/zinc/80/61/75/338806175.db2.gz UTTUQCJOVGBEJB-KRWDZBQOSA-N 1 2 313.470 4.616 20 0 DJADLO CCCc1ncc(C[NH2+][C@@H](C)c2cccc(Cl)c2Cl)o1 ZINC000453355306 338830503 /nfs/dbraw/zinc/83/05/03/338830503.db2.gz CXLZNAOPSNSTCV-JTQLQIEISA-N 1 2 313.228 4.785 20 0 DJADLO Cc1cccnc1[C@H]1CCC[C@H]([NH2+][C@@H](C(C)C)C(F)(F)F)C1 ZINC000467352306 338882369 /nfs/dbraw/zinc/88/23/69/338882369.db2.gz GDWBIKFOZPVITL-DZKIICNBSA-N 1 2 314.395 4.593 20 0 DJADLO Cc1cccc([C@@H]2CCCN2C(=O)Nc2c(C)cc(C)[nH+]c2C)c1 ZINC000455471344 338895477 /nfs/dbraw/zinc/89/54/77/338895477.db2.gz ILHVESCWQXYRPG-SFHVURJKSA-N 1 2 323.440 4.684 20 0 DJADLO C[C@H](c1nc(C2CC2)no1)[N@@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC000459578133 339036933 /nfs/dbraw/zinc/03/69/33/339036933.db2.gz XHCNZGJAIHFZSA-PBHICJAKSA-N 1 2 323.440 4.625 20 0 DJADLO C[C@H](c1nc(C2CC2)no1)[N@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC000459578133 339036934 /nfs/dbraw/zinc/03/69/34/339036934.db2.gz XHCNZGJAIHFZSA-PBHICJAKSA-N 1 2 323.440 4.625 20 0 DJADLO C[C@H](c1csnn1)[N@@H+]1CC2(CCCCC2)[C@@H]1c1ccccc1 ZINC000459752884 339046237 /nfs/dbraw/zinc/04/62/37/339046237.db2.gz RDYUCPFCSXSQIT-PBHICJAKSA-N 1 2 313.470 4.607 20 0 DJADLO C[C@H](c1csnn1)[N@H+]1CC2(CCCCC2)[C@@H]1c1ccccc1 ZINC000459752884 339046238 /nfs/dbraw/zinc/04/62/38/339046238.db2.gz RDYUCPFCSXSQIT-PBHICJAKSA-N 1 2 313.470 4.607 20 0 DJADLO Cc1cc(N2CCC[C@H]2c2cccc(C)c2C)nc(C2CC2)[nH+]1 ZINC000462866516 339095000 /nfs/dbraw/zinc/09/50/00/339095000.db2.gz NGRQFKSUVCQDON-SFHVURJKSA-N 1 2 307.441 4.621 20 0 DJADLO Fc1ccccc1C1C[NH+](Cc2ccc(C(F)(F)F)s2)C1 ZINC000463032491 339101976 /nfs/dbraw/zinc/10/19/76/339101976.db2.gz JGAGUVRSRHQKIZ-UHFFFAOYSA-N 1 2 315.335 4.505 20 0 DJADLO COc1ccccc1[C@@H](C)SCc1cn2c(cccc2C)[nH+]1 ZINC000463192095 339108747 /nfs/dbraw/zinc/10/87/47/339108747.db2.gz OTDSSJOSTPZYQM-CQSZACIVSA-N 1 2 312.438 4.646 20 0 DJADLO Cc1cnc(C[N@@H+](Cc2ccccc2)[C@H](C)c2ccccc2)nc1 ZINC000463220757 339110111 /nfs/dbraw/zinc/11/01/11/339110111.db2.gz FKYNDPDZOTVWMU-GOSISDBHSA-N 1 2 317.436 4.548 20 0 DJADLO Cc1cnc(C[N@H+](Cc2ccccc2)[C@H](C)c2ccccc2)nc1 ZINC000463220757 339110112 /nfs/dbraw/zinc/11/01/12/339110112.db2.gz FKYNDPDZOTVWMU-GOSISDBHSA-N 1 2 317.436 4.548 20 0 DJADLO CCCc1nc(C[N@@H+]2C[C@@H](C)C[C@H]2c2ccccc2F)cs1 ZINC000464725095 339150019 /nfs/dbraw/zinc/15/00/19/339150019.db2.gz LVTYMBCUKQOMDT-GUYCJALGSA-N 1 2 318.461 4.818 20 0 DJADLO CCCc1nc(C[N@H+]2C[C@@H](C)C[C@H]2c2ccccc2F)cs1 ZINC000464725095 339150020 /nfs/dbraw/zinc/15/00/20/339150020.db2.gz LVTYMBCUKQOMDT-GUYCJALGSA-N 1 2 318.461 4.818 20 0 DJADLO C[C@H](c1ccccc1Cl)[N@H+](C)Cc1nc2cc(F)ccc2o1 ZINC000464868286 339159385 /nfs/dbraw/zinc/15/93/85/339159385.db2.gz KXONQGUNXDBYQM-LLVKDONJSA-N 1 2 318.779 4.813 20 0 DJADLO C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1nc2cc(F)ccc2o1 ZINC000464868286 339159386 /nfs/dbraw/zinc/15/93/86/339159386.db2.gz KXONQGUNXDBYQM-LLVKDONJSA-N 1 2 318.779 4.813 20 0 DJADLO CC[C@H](SCc1[nH+]ccn1CC(F)(F)F)c1ccccc1 ZINC000466978124 339223205 /nfs/dbraw/zinc/22/32/05/339223205.db2.gz WOVIYAPEOZJQGK-ZDUSSCGKSA-N 1 2 314.376 4.830 20 0 DJADLO CC[C@@H](SCc1[nH+]ccn1CC(F)(F)F)c1ccccc1 ZINC000466978123 339223275 /nfs/dbraw/zinc/22/32/75/339223275.db2.gz WOVIYAPEOZJQGK-CYBMUJFWSA-N 1 2 314.376 4.830 20 0 DJADLO Cc1[nH]c2ccc(CSc3ccnc4ccccc43)cc2[nH+]1 ZINC000467202217 339228048 /nfs/dbraw/zinc/22/80/48/339228048.db2.gz QTKPBOGWPVEUGX-UHFFFAOYSA-N 1 2 305.406 4.712 20 0 DJADLO Cc1[nH]c2cc(CSc3ccnc4ccccc43)ccc2[nH+]1 ZINC000467202217 339228049 /nfs/dbraw/zinc/22/80/49/339228049.db2.gz QTKPBOGWPVEUGX-UHFFFAOYSA-N 1 2 305.406 4.712 20 0 DJADLO C[C@@H](SCc1[nH+]ccn1Cc1ccccc1)c1ccccc1 ZINC000467224314 339228714 /nfs/dbraw/zinc/22/87/14/339228714.db2.gz JFKKUTDBXFXSEN-MRXNPFEDSA-N 1 2 308.450 4.926 20 0 DJADLO CC(C)(C)C[C@H]([NH2+][C@@H]1CCC[C@H]([C@@H]2CCOC2)C1)C(F)(F)F ZINC000467346845 339232835 /nfs/dbraw/zinc/23/28/35/339232835.db2.gz QQRVUJKUGYJZLP-YJNKXOJESA-N 1 2 321.427 4.538 20 0 DJADLO COCc1cccc(N[C@H]2CCC[C@H](c3[nH+]cccc3C)C2)c1 ZINC000467374637 339235109 /nfs/dbraw/zinc/23/51/09/339235109.db2.gz ZFZQCTLNODOGGD-HKUYNNGSSA-N 1 2 310.441 4.675 20 0 DJADLO FC(F)[C@H](CCc1ccccc1)[NH2+]Cc1cccc2cc[nH]c21 ZINC000467375912 339235274 /nfs/dbraw/zinc/23/52/74/339235274.db2.gz HJYCXWVFVUUSPL-KRWDZBQOSA-N 1 2 314.379 4.524 20 0 DJADLO C[C@@H](c1cccc(Cl)c1)[N@@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000468109228 339254223 /nfs/dbraw/zinc/25/42/23/339254223.db2.gz JODZMBCJEMKISY-BLLLJJGKSA-N 1 2 307.846 4.536 20 0 DJADLO C[C@@H](c1cccc(Cl)c1)[N@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000468109228 339254224 /nfs/dbraw/zinc/25/42/24/339254224.db2.gz JODZMBCJEMKISY-BLLLJJGKSA-N 1 2 307.846 4.536 20 0 DJADLO C[C@@H](c1ccccc1Cl)[N@@H+]1CCO[C@H](c2ccsc2)C1 ZINC000468127963 339254909 /nfs/dbraw/zinc/25/49/09/339254909.db2.gz CSRPQQIDZYOWBV-LRDDRELGSA-N 1 2 307.846 4.536 20 0 DJADLO C[C@@H](c1ccccc1Cl)[N@H+]1CCO[C@H](c2ccsc2)C1 ZINC000468127963 339254910 /nfs/dbraw/zinc/25/49/10/339254910.db2.gz CSRPQQIDZYOWBV-LRDDRELGSA-N 1 2 307.846 4.536 20 0 DJADLO C[C@@H](c1ccccc1Cl)[N@H+](Cc1cncc(F)c1)C1CC1 ZINC000468490975 339264137 /nfs/dbraw/zinc/26/41/37/339264137.db2.gz CETUKQCGKLXYFE-LBPRGKRZSA-N 1 2 304.796 4.600 20 0 DJADLO C[C@@H](c1ccccc1Cl)[N@@H+](Cc1cncc(F)c1)C1CC1 ZINC000468490975 339264138 /nfs/dbraw/zinc/26/41/38/339264138.db2.gz CETUKQCGKLXYFE-LBPRGKRZSA-N 1 2 304.796 4.600 20 0 DJADLO Cc1cnc([C@@H](C)[NH+]2CCC(=Cc3ccc(F)c(F)c3)CC2)o1 ZINC000469445656 339289496 /nfs/dbraw/zinc/28/94/96/339289496.db2.gz FLDXEJULVHFQHJ-CYBMUJFWSA-N 1 2 318.367 4.502 20 0 DJADLO Cc1nc(N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)cc[nH+]1 ZINC000469560357 339293294 /nfs/dbraw/zinc/29/32/94/339293294.db2.gz LOPNIZYPKRQVHG-OAHLLOKOSA-N 1 2 321.346 4.535 20 0 DJADLO C[C@H](c1c(F)cccc1F)[N@@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000470191020 339313494 /nfs/dbraw/zinc/31/34/94/339313494.db2.gz RXDZTUFNNOBXQO-XHBSWPGZSA-N 1 2 323.408 4.549 20 0 DJADLO C[C@H](c1c(F)cccc1F)[N@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000470191020 339313495 /nfs/dbraw/zinc/31/34/95/339313495.db2.gz RXDZTUFNNOBXQO-XHBSWPGZSA-N 1 2 323.408 4.549 20 0 DJADLO C[C@@H](c1ccc(F)cc1F)[N@@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000470194442 339313737 /nfs/dbraw/zinc/31/37/37/339313737.db2.gz KJVIYEHTJNOORR-BWACUDIHSA-N 1 2 323.408 4.549 20 0 DJADLO C[C@@H](c1ccc(F)cc1F)[N@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000470194442 339313738 /nfs/dbraw/zinc/31/37/38/339313738.db2.gz KJVIYEHTJNOORR-BWACUDIHSA-N 1 2 323.408 4.549 20 0 DJADLO C[C@H]1C[N@H+](Cc2cccc(C(F)F)c2)C[C@H](c2ccsc2)O1 ZINC000470782446 339327972 /nfs/dbraw/zinc/32/79/72/339327972.db2.gz WJTBUWPJQJLVIY-BLLLJJGKSA-N 1 2 323.408 4.648 20 0 DJADLO C[C@H]1C[N@@H+](Cc2cccc(C(F)F)c2)C[C@H](c2ccsc2)O1 ZINC000470782446 339327973 /nfs/dbraw/zinc/32/79/73/339327973.db2.gz WJTBUWPJQJLVIY-BLLLJJGKSA-N 1 2 323.408 4.648 20 0 DJADLO Clc1ccccc1[C@@H]1CCC[N@@H+]1Cc1ccncc1Cl ZINC000470975482 339333600 /nfs/dbraw/zinc/33/36/00/339333600.db2.gz OETAJLHMLUJODO-INIZCTEOSA-N 1 2 307.224 4.726 20 0 DJADLO Clc1ccccc1[C@@H]1CCC[N@H+]1Cc1ccncc1Cl ZINC000470975482 339333601 /nfs/dbraw/zinc/33/36/01/339333601.db2.gz OETAJLHMLUJODO-INIZCTEOSA-N 1 2 307.224 4.726 20 0 DJADLO CSc1ccccc1C[N@H+](C)Cc1nc(C(C)(C)C)cs1 ZINC000470993917 339333966 /nfs/dbraw/zinc/33/39/66/339333966.db2.gz DLQRHCDLZVYBEB-UHFFFAOYSA-N 1 2 320.527 4.795 20 0 DJADLO CSc1ccccc1C[N@@H+](C)Cc1nc(C(C)(C)C)cs1 ZINC000470993917 339333967 /nfs/dbraw/zinc/33/39/67/339333967.db2.gz DLQRHCDLZVYBEB-UHFFFAOYSA-N 1 2 320.527 4.795 20 0 DJADLO Cc1oc(-c2cccs2)nc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000471174201 339339421 /nfs/dbraw/zinc/33/94/21/339339421.db2.gz VHQLEQJYHXADKS-INIZCTEOSA-N 1 2 310.422 4.659 20 0 DJADLO Cc1oc(-c2cccs2)nc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000471174201 339339422 /nfs/dbraw/zinc/33/94/22/339339422.db2.gz VHQLEQJYHXADKS-INIZCTEOSA-N 1 2 310.422 4.659 20 0 DJADLO C[C@@H]([NH2+][C@@H](CO)c1ccsc1)c1cc(Cl)sc1Cl ZINC000471583001 339348139 /nfs/dbraw/zinc/34/81/39/339348139.db2.gz SJJIMXAGLVXTSX-XCBNKYQSSA-N 1 2 322.282 4.501 20 0 DJADLO C[N@H+](Cc1ccc(Cl)c(Cl)c1)Cc1ccncc1Cl ZINC000471694364 339351172 /nfs/dbraw/zinc/35/11/72/339351172.db2.gz TWQWKHIZNWYVRG-UHFFFAOYSA-N 1 2 315.631 4.674 20 0 DJADLO C[N@@H+](Cc1ccc(Cl)c(Cl)c1)Cc1ccncc1Cl ZINC000471694364 339351173 /nfs/dbraw/zinc/35/11/73/339351173.db2.gz TWQWKHIZNWYVRG-UHFFFAOYSA-N 1 2 315.631 4.674 20 0 DJADLO O=C(Nc1cccc(-c2[nH]cc[nH+]2)c1)c1ccc2sccc2c1 ZINC000471778022 339353680 /nfs/dbraw/zinc/35/36/80/339353680.db2.gz DEFJGMNAEGTWCB-UHFFFAOYSA-N 1 2 319.389 4.544 20 0 DJADLO C[C@@H]([NH2+]Cc1ncc(Cl)s1)c1cccc(Cl)c1Cl ZINC000472048715 339360836 /nfs/dbraw/zinc/36/08/36/339360836.db2.gz SBDUTIMYQAHBCE-SSDOTTSWSA-N 1 2 321.660 4.954 20 0 DJADLO Clc1ccc([C@H]2CCC[N@@H+]2Cc2ccncc2Cl)cc1 ZINC000472241904 339367368 /nfs/dbraw/zinc/36/73/68/339367368.db2.gz OJPZPPDKUUYEPX-MRXNPFEDSA-N 1 2 307.224 4.726 20 0 DJADLO Clc1ccc([C@H]2CCC[N@H+]2Cc2ccncc2Cl)cc1 ZINC000472241904 339367369 /nfs/dbraw/zinc/36/73/69/339367369.db2.gz OJPZPPDKUUYEPX-MRXNPFEDSA-N 1 2 307.224 4.726 20 0 DJADLO Cc1ccccc1-c1nc(C[N@@H+](C)[C@@H](C)c2ccccc2C)no1 ZINC000472767470 339377238 /nfs/dbraw/zinc/37/72/38/339377238.db2.gz UPJLRSHJDCFPHT-INIZCTEOSA-N 1 2 321.424 4.546 20 0 DJADLO Cc1ccccc1-c1nc(C[N@H+](C)[C@@H](C)c2ccccc2C)no1 ZINC000472767470 339377239 /nfs/dbraw/zinc/37/72/39/339377239.db2.gz UPJLRSHJDCFPHT-INIZCTEOSA-N 1 2 321.424 4.546 20 0 DJADLO C[C@H](c1cccc(Cl)c1)[N@@H+]1CCO[C@H](c2cccs2)C1 ZINC000472833076 339378278 /nfs/dbraw/zinc/37/82/78/339378278.db2.gz XXPDIFMGKRPORY-DOMZBBRYSA-N 1 2 307.846 4.536 20 0 DJADLO C[C@H](c1cccc(Cl)c1)[N@H+]1CCO[C@H](c2cccs2)C1 ZINC000472833076 339378279 /nfs/dbraw/zinc/37/82/79/339378279.db2.gz XXPDIFMGKRPORY-DOMZBBRYSA-N 1 2 307.846 4.536 20 0 DJADLO C[N@H+](Cc1ncc(Cl)s1)Cc1ccc2ccccc2c1 ZINC000473131876 339381662 /nfs/dbraw/zinc/38/16/62/339381662.db2.gz ILJZTVGMNVSAMG-UHFFFAOYSA-N 1 2 302.830 4.582 20 0 DJADLO C[N@@H+](Cc1ncc(Cl)s1)Cc1ccc2ccccc2c1 ZINC000473131876 339381663 /nfs/dbraw/zinc/38/16/63/339381663.db2.gz ILJZTVGMNVSAMG-UHFFFAOYSA-N 1 2 302.830 4.582 20 0 DJADLO Cc1cc2[nH+]cn([C@@H](C)c3nc(C4(C)CC4)cs3)c2cc1C ZINC000473436376 339385224 /nfs/dbraw/zinc/38/52/24/339385224.db2.gz SVZHKCDUVXGZQK-ZDUSSCGKSA-N 1 2 311.454 4.770 20 0 DJADLO CCc1[nH+]c(C)ccc1OCc1nc(-c2cccs2)oc1C ZINC000473677927 339390190 /nfs/dbraw/zinc/39/01/90/339390190.db2.gz PJMXZSAXIPFKSX-UHFFFAOYSA-N 1 2 314.410 4.556 20 0 DJADLO CC1(C)CCC[C@H]1C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000475423313 339451115 /nfs/dbraw/zinc/45/11/15/339451115.db2.gz SMTZCZXICLBJAL-KRWDZBQOSA-N 1 2 310.397 4.639 20 0 DJADLO Cc1ccc(NC(=O)N2C[C@@H](C)CC[C@@H]2c2ccccc2)c(C)[nH+]1 ZINC000477156472 339488180 /nfs/dbraw/zinc/48/81/80/339488180.db2.gz ALESVGMDGFWKHH-IFXJQAMLSA-N 1 2 323.440 4.704 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1CCCC[C@@H]1c1ccccc1 ZINC000485483458 339704138 /nfs/dbraw/zinc/70/41/38/339704138.db2.gz VJURPIXPVFPVPN-QZTJIDSGSA-N 1 2 323.440 4.546 20 0 DJADLO CCC1(C(=O)Nc2ccc(Oc3cc[nH+]cc3)c(C)c2)CCC1 ZINC000489358804 339807043 /nfs/dbraw/zinc/80/70/43/339807043.db2.gz WRPQLBMIKRECQX-UHFFFAOYSA-N 1 2 310.397 4.701 20 0 DJADLO CC[C@H]1CCCC[C@@H]1NC(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000492514284 339902831 /nfs/dbraw/zinc/90/28/31/339902831.db2.gz HYTFFNKSBKUEEL-KXBFYZLASA-N 1 2 324.424 4.573 20 0 DJADLO Cc1ccc(N[C@H](c2[nH]cc[nH+]2)c2ccccc2)cc1OC(C)C ZINC000494463704 339950145 /nfs/dbraw/zinc/95/01/45/339950145.db2.gz GVYHXAABVQNILD-IBGZPJMESA-N 1 2 321.424 4.707 20 0 DJADLO CCCCC[N@H+](Cc1nc(C(C)C)no1)Cc1ccc(F)cc1 ZINC000497083660 340019903 /nfs/dbraw/zinc/01/99/03/340019903.db2.gz WDBZBPKYFFZCDF-UHFFFAOYSA-N 1 2 319.424 4.525 20 0 DJADLO CCCCC[N@@H+](Cc1nc(C(C)C)no1)Cc1ccc(F)cc1 ZINC000497083660 340019904 /nfs/dbraw/zinc/01/99/04/340019904.db2.gz WDBZBPKYFFZCDF-UHFFFAOYSA-N 1 2 319.424 4.525 20 0 DJADLO CC(C)c1nc(C[NH2+][C@@]2(c3ccc(Cl)cc3)C[C@H]2C)cs1 ZINC000500414719 340057552 /nfs/dbraw/zinc/05/75/52/340057552.db2.gz INKUBBZQTYTTEW-PXAZEXFGSA-N 1 2 320.889 4.945 20 0 DJADLO C[C@H]1C[C@]1([NH2+]Cc1csc(C2CC2)n1)c1ccc(Cl)cc1 ZINC000500414216 340057559 /nfs/dbraw/zinc/05/75/59/340057559.db2.gz GLTQZDJRRUJVMY-APPDUMDISA-N 1 2 318.873 4.699 20 0 DJADLO Cc1cc([C@@H](C)[NH2+]Cc2ccc(Oc3ccccc3)cc2)no1 ZINC000500484586 340060267 /nfs/dbraw/zinc/06/02/67/340060267.db2.gz GMZFECVYCZDJAS-OAHLLOKOSA-N 1 2 308.381 4.626 20 0 DJADLO Cc1cc([C@@H](C)[NH2+]Cc2ccc(Sc3ccccc3)cc2)no1 ZINC000500568098 340062632 /nfs/dbraw/zinc/06/26/32/340062632.db2.gz GBEUQVGCONYXQO-OAHLLOKOSA-N 1 2 324.449 4.985 20 0 DJADLO COCC[C@H]1CCC[C@@H]1Nc1cccc([NH+]2CCCCCC2)c1 ZINC000502461205 340104647 /nfs/dbraw/zinc/10/46/47/340104647.db2.gz IYLDFDKZNZGLKA-XLIONFOSSA-N 1 2 316.489 4.684 20 0 DJADLO COCC[C@@H]1CCC[C@@H]1Nc1cccc([NH+]2CCCCCC2)c1 ZINC000502461204 340104661 /nfs/dbraw/zinc/10/46/61/340104661.db2.gz IYLDFDKZNZGLKA-PXNSSMCTSA-N 1 2 316.489 4.684 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1F)c1cnn(C2CCCC2)c1 ZINC000502696781 340111126 /nfs/dbraw/zinc/11/11/26/340111126.db2.gz FZZACTUUULBPRA-CHWSQXEVSA-N 1 2 319.399 4.688 20 0 DJADLO Cc1cc([C@H](C)[NH2+][C@H](COCC(C)C)c2ccco2)oc1C ZINC000502700695 340111342 /nfs/dbraw/zinc/11/13/42/340111342.db2.gz QYEUBNWUMGTWSK-GOEBONIOSA-N 1 2 305.418 4.554 20 0 DJADLO CCOc1cccc2cc([C@@H](C)[NH2+][C@H](C)c3cc(C)on3)oc21 ZINC000503856061 340135344 /nfs/dbraw/zinc/13/53/44/340135344.db2.gz MSTMAAYOPBUDIL-CHWSQXEVSA-N 1 2 314.385 4.540 20 0 DJADLO C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+]C1(C(F)F)CC1 ZINC000503937760 340137588 /nfs/dbraw/zinc/13/75/88/340137588.db2.gz OZDBUIKBTFAJNN-DTWKUNHWSA-N 1 2 324.198 4.537 20 0 DJADLO Cc1ccc(SCc2[nH+]ccn2Cc2ccccc2)cc1C ZINC000505481812 340169453 /nfs/dbraw/zinc/16/94/53/340169453.db2.gz WYZSTODTVDPMRU-UHFFFAOYSA-N 1 2 308.450 4.841 20 0 DJADLO C[N@H+](Cc1ccc(Cl)s1)Cc1cnc(C(C)(C)C)s1 ZINC000506126257 340186287 /nfs/dbraw/zinc/18/62/87/340186287.db2.gz RSPVBMMPAWWCTE-UHFFFAOYSA-N 1 2 314.907 4.788 20 0 DJADLO C[N@@H+](Cc1ccc(Cl)s1)Cc1cnc(C(C)(C)C)s1 ZINC000506126257 340186288 /nfs/dbraw/zinc/18/62/88/340186288.db2.gz RSPVBMMPAWWCTE-UHFFFAOYSA-N 1 2 314.907 4.788 20 0 DJADLO CC(C)(C)c1nc(C[N@H+](Cc2ccccc2)C2CC2)cs1 ZINC000506341815 340192828 /nfs/dbraw/zinc/19/28/28/340192828.db2.gz LMCVJIUCXCNBQQ-UHFFFAOYSA-N 1 2 300.471 4.605 20 0 DJADLO CC(C)(C)c1nc(C[N@@H+](Cc2ccccc2)C2CC2)cs1 ZINC000506341815 340192829 /nfs/dbraw/zinc/19/28/29/340192829.db2.gz LMCVJIUCXCNBQQ-UHFFFAOYSA-N 1 2 300.471 4.605 20 0 DJADLO Cc1nc(C[N@H+](C)Cc2cc(-c3ccccc3)cs2)cs1 ZINC000506677266 340199390 /nfs/dbraw/zinc/19/93/90/340199390.db2.gz ZSCHILDSTANXKA-UHFFFAOYSA-N 1 2 314.479 4.812 20 0 DJADLO Cc1nc(C[N@@H+](C)Cc2cc(-c3ccccc3)cs2)cs1 ZINC000506677266 340199391 /nfs/dbraw/zinc/19/93/91/340199391.db2.gz ZSCHILDSTANXKA-UHFFFAOYSA-N 1 2 314.479 4.812 20 0 DJADLO C[C@@H]1c2ccsc2CC[N@H+]1Cc1csc(C(C)(C)C)n1 ZINC000506726294 340200166 /nfs/dbraw/zinc/20/01/66/340200166.db2.gz MMNWTDOPDJGDKX-LLVKDONJSA-N 1 2 306.500 4.621 20 0 DJADLO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1csc(C(C)(C)C)n1 ZINC000506726294 340200167 /nfs/dbraw/zinc/20/01/67/340200167.db2.gz MMNWTDOPDJGDKX-LLVKDONJSA-N 1 2 306.500 4.621 20 0 DJADLO C[N@H+](Cc1nc(-c2ccccc2)cs1)Cc1ccc(F)cc1 ZINC000506756573 340200927 /nfs/dbraw/zinc/20/09/27/340200927.db2.gz APGDGTYEQRXETD-UHFFFAOYSA-N 1 2 312.413 4.581 20 0 DJADLO C[N@@H+](Cc1nc(-c2ccccc2)cs1)Cc1ccc(F)cc1 ZINC000506756573 340200928 /nfs/dbraw/zinc/20/09/28/340200928.db2.gz APGDGTYEQRXETD-UHFFFAOYSA-N 1 2 312.413 4.581 20 0 DJADLO Clc1ccc([C@H]2CCC[N@@H+]2Cc2cncs2)cc1Cl ZINC000507132210 340208586 /nfs/dbraw/zinc/20/85/86/340208586.db2.gz JNUMWOPGJMMERX-CQSZACIVSA-N 1 2 313.253 4.787 20 0 DJADLO Clc1ccc([C@H]2CCC[N@H+]2Cc2cncs2)cc1Cl ZINC000507132210 340208587 /nfs/dbraw/zinc/20/85/87/340208587.db2.gz JNUMWOPGJMMERX-CQSZACIVSA-N 1 2 313.253 4.787 20 0 DJADLO Clc1ccc([C@H]2CCC[N@@H+]2Cc2ccncc2)cc1Cl ZINC000507131476 340208764 /nfs/dbraw/zinc/20/87/64/340208764.db2.gz IFHNSEQFNBIQML-MRXNPFEDSA-N 1 2 307.224 4.726 20 0 DJADLO Clc1ccc([C@H]2CCC[N@H+]2Cc2ccncc2)cc1Cl ZINC000507131476 340208765 /nfs/dbraw/zinc/20/87/65/340208765.db2.gz IFHNSEQFNBIQML-MRXNPFEDSA-N 1 2 307.224 4.726 20 0 DJADLO Clc1ccc([C@@H]2CCC[N@@H+]2Cc2ccccn2)cc1Cl ZINC000507132407 340208847 /nfs/dbraw/zinc/20/88/47/340208847.db2.gz LYXOKIQEIHWIOA-INIZCTEOSA-N 1 2 307.224 4.726 20 0 DJADLO Clc1ccc([C@@H]2CCC[N@H+]2Cc2ccccn2)cc1Cl ZINC000507132407 340208848 /nfs/dbraw/zinc/20/88/48/340208848.db2.gz LYXOKIQEIHWIOA-INIZCTEOSA-N 1 2 307.224 4.726 20 0 DJADLO Cc1csc(C[N@@H+](C)[C@H](C)c2ccc(Cl)cc2Cl)n1 ZINC000507225124 340214500 /nfs/dbraw/zinc/21/45/00/340214500.db2.gz BNKFLJSMLUYENB-SNVBAGLBSA-N 1 2 315.269 4.951 20 0 DJADLO Cc1csc(C[N@H+](C)[C@H](C)c2ccc(Cl)cc2Cl)n1 ZINC000507225124 340214501 /nfs/dbraw/zinc/21/45/01/340214501.db2.gz BNKFLJSMLUYENB-SNVBAGLBSA-N 1 2 315.269 4.951 20 0 DJADLO CCc1cccnc1[C@H](C)[NH2+][C@@H](c1nccs1)c1ccccc1 ZINC000507486778 340222260 /nfs/dbraw/zinc/22/22/60/340222260.db2.gz PHEQKVLHMPHTMI-KBXCAEBGSA-N 1 2 323.465 4.541 20 0 DJADLO CCc1cccnc1[C@H](C)[NH2+]Cc1cc(Cl)sc1Cl ZINC000507492923 340222643 /nfs/dbraw/zinc/22/26/43/340222643.db2.gz GGUUHSMVOITKSX-VIFPVBQESA-N 1 2 315.269 4.863 20 0 DJADLO Cc1csc(C[N@@H+](C)[C@H](C)c2ccc(Cl)c(Cl)c2)n1 ZINC000507665177 340227605 /nfs/dbraw/zinc/22/76/05/340227605.db2.gz IJUSUFSJMOZSSR-SNVBAGLBSA-N 1 2 315.269 4.951 20 0 DJADLO Cc1csc(C[N@H+](C)[C@H](C)c2ccc(Cl)c(Cl)c2)n1 ZINC000507665177 340227606 /nfs/dbraw/zinc/22/76/06/340227606.db2.gz IJUSUFSJMOZSSR-SNVBAGLBSA-N 1 2 315.269 4.951 20 0 DJADLO CC[N@H+](Cc1csc(C(C)C)n1)[C@@H](C)c1ccc(F)cc1 ZINC000507716190 340229339 /nfs/dbraw/zinc/22/93/39/340229339.db2.gz GYTHATNWNVVZHW-ZDUSSCGKSA-N 1 2 306.450 4.989 20 0 DJADLO CC[N@@H+](Cc1csc(C(C)C)n1)[C@@H](C)c1ccc(F)cc1 ZINC000507716190 340229340 /nfs/dbraw/zinc/22/93/40/340229340.db2.gz GYTHATNWNVVZHW-ZDUSSCGKSA-N 1 2 306.450 4.989 20 0 DJADLO C[C@@H](c1ccc(F)cc1)[N@@H+]1CCO[C@H](c2ccccc2Cl)C1 ZINC000507789197 340231621 /nfs/dbraw/zinc/23/16/21/340231621.db2.gz SBKRWDOOSSAUET-UGSOOPFHSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@@H](c1ccc(F)cc1)[N@H+]1CCO[C@H](c2ccccc2Cl)C1 ZINC000507789197 340231622 /nfs/dbraw/zinc/23/16/22/340231622.db2.gz SBKRWDOOSSAUET-UGSOOPFHSA-N 1 2 319.807 4.614 20 0 DJADLO Cc1noc([C@@H](C)[NH2+][C@@H](C)c2ccc(Oc3ccccc3)cc2)n1 ZINC000507898173 340235527 /nfs/dbraw/zinc/23/55/27/340235527.db2.gz YGVIGZGQGZATLQ-UONOGXRCSA-N 1 2 323.396 4.582 20 0 DJADLO CC1(C)C[C@@H]1C(=O)Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000508114884 340239406 /nfs/dbraw/zinc/23/94/06/340239406.db2.gz PZVYARYAYPBVOD-CYBMUJFWSA-N 1 2 316.788 4.512 20 0 DJADLO CCCCn1c(SC2CCCCC2)nnc1[C@@H](CC)[NH+](C)C ZINC000508988450 340257033 /nfs/dbraw/zinc/25/70/33/340257033.db2.gz UOWZBVMLOWWVKV-OAHLLOKOSA-N 1 2 324.538 4.516 20 0 DJADLO O=C(Nc1cccc(Cl)c1)c1ccccc1Oc1cc[nH+]cc1 ZINC000509016311 340258342 /nfs/dbraw/zinc/25/83/42/340258342.db2.gz YXKCQULOHNUWOZ-UHFFFAOYSA-N 1 2 324.767 4.780 20 0 DJADLO CC(C)c1nc(N2[C@@H]3CC[C@H]2C[C@@H](c2ccccc2)C3)cc[nH+]1 ZINC000509478989 340270931 /nfs/dbraw/zinc/27/09/31/340270931.db2.gz LQKXKDBWIKUZPD-BCDXTJNWSA-N 1 2 307.441 4.515 20 0 DJADLO CC[N@H+](Cc1ncc(C(C)(C)C)o1)[C@H](C)c1cccc(OC)c1 ZINC000516617733 340277845 /nfs/dbraw/zinc/27/78/45/340277845.db2.gz GWBOPBQLLUJHOX-CQSZACIVSA-N 1 2 316.445 4.564 20 0 DJADLO CC[N@@H+](Cc1ncc(C(C)(C)C)o1)[C@H](C)c1cccc(OC)c1 ZINC000516617733 340277846 /nfs/dbraw/zinc/27/78/46/340277846.db2.gz GWBOPBQLLUJHOX-CQSZACIVSA-N 1 2 316.445 4.564 20 0 DJADLO C[N@H+](Cc1csc(-c2cccs2)n1)Cc1cccc(F)c1 ZINC000302740905 340280731 /nfs/dbraw/zinc/28/07/31/340280731.db2.gz KKCJDBZJCNBYQR-UHFFFAOYSA-N 1 2 318.442 4.643 20 0 DJADLO C[N@@H+](Cc1csc(-c2cccs2)n1)Cc1cccc(F)c1 ZINC000302740905 340280732 /nfs/dbraw/zinc/28/07/32/340280732.db2.gz KKCJDBZJCNBYQR-UHFFFAOYSA-N 1 2 318.442 4.643 20 0 DJADLO Fc1cccc(C[N@H+](Cc2ccco2)Cc2cccs2)c1F ZINC000302837611 340283422 /nfs/dbraw/zinc/28/34/22/340283422.db2.gz NGOMOMSVRJLUGL-UHFFFAOYSA-N 1 2 319.376 4.822 20 0 DJADLO Fc1cccc(C[N@@H+](Cc2ccco2)Cc2cccs2)c1F ZINC000302837611 340283423 /nfs/dbraw/zinc/28/34/23/340283423.db2.gz NGOMOMSVRJLUGL-UHFFFAOYSA-N 1 2 319.376 4.822 20 0 DJADLO CC[C@H]1CCC[C@@H](NC(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000509949489 340283584 /nfs/dbraw/zinc/28/35/84/340283584.db2.gz QMOXCNXYSHHALV-JKSUJKDBSA-N 1 2 324.424 4.573 20 0 DJADLO CC1(C)CCCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)CC1 ZINC000510022662 340285565 /nfs/dbraw/zinc/28/55/65/340285565.db2.gz FOGCAWQEPZIAOC-UHFFFAOYSA-N 1 2 324.424 4.526 20 0 DJADLO CC(C)n1ccnc1C[N@@H+](Cc1ccccc1Cl)CC1CC1 ZINC000510237958 340293848 /nfs/dbraw/zinc/29/38/48/340293848.db2.gz FBUUVPMUBYPTBE-UHFFFAOYSA-N 1 2 317.864 4.530 20 0 DJADLO CC(C)n1ccnc1C[N@H+](Cc1ccccc1Cl)CC1CC1 ZINC000510237958 340293849 /nfs/dbraw/zinc/29/38/49/340293849.db2.gz FBUUVPMUBYPTBE-UHFFFAOYSA-N 1 2 317.864 4.530 20 0 DJADLO CC(C)n1cc[nH+]c1CN(Cc1ccccc1Cl)CC1CC1 ZINC000510237958 340293850 /nfs/dbraw/zinc/29/38/50/340293850.db2.gz FBUUVPMUBYPTBE-UHFFFAOYSA-N 1 2 317.864 4.530 20 0 DJADLO CC1(C)CCC[C@@H](NC(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000510390079 340297721 /nfs/dbraw/zinc/29/77/21/340297721.db2.gz QNQWTWJQDGWVAC-OAHLLOKOSA-N 1 2 324.424 4.573 20 0 DJADLO CC[N@H+](Cc1cc(-c2cccs2)on1)Cc1cccc(F)c1 ZINC000510830065 340312188 /nfs/dbraw/zinc/31/21/88/340312188.db2.gz MQEDAOVYABCVDQ-UHFFFAOYSA-N 1 2 316.401 4.564 20 0 DJADLO CC[N@@H+](Cc1cc(-c2cccs2)on1)Cc1cccc(F)c1 ZINC000510830065 340312189 /nfs/dbraw/zinc/31/21/89/340312189.db2.gz MQEDAOVYABCVDQ-UHFFFAOYSA-N 1 2 316.401 4.564 20 0 DJADLO Cc1cc([C@H](C)[NH2+]Cc2ccsc2Br)oc1C ZINC000510926895 340315033 /nfs/dbraw/zinc/31/50/33/340315033.db2.gz FWNUOPADWGSYPX-VIFPVBQESA-N 1 2 314.248 4.571 20 0 DJADLO c1cc(-c2noc(-c3ccccc3Oc3cc[nH+]cc3)n2)cs1 ZINC000511257001 340324483 /nfs/dbraw/zinc/32/44/83/340324483.db2.gz IOKMBEXBIVDRNY-UHFFFAOYSA-N 1 2 321.361 4.652 20 0 DJADLO Cc1sccc1C[N@H+]1CCCCC[C@@H]1c1noc(C(C)C)n1 ZINC000512313549 340356622 /nfs/dbraw/zinc/35/66/22/340356622.db2.gz LIOWTRBHLACDSB-OAHLLOKOSA-N 1 2 319.474 4.680 20 0 DJADLO Cc1sccc1C[N@@H+]1CCCCC[C@@H]1c1noc(C(C)C)n1 ZINC000512313549 340356623 /nfs/dbraw/zinc/35/66/23/340356623.db2.gz LIOWTRBHLACDSB-OAHLLOKOSA-N 1 2 319.474 4.680 20 0 DJADLO CSc1cccc(F)c1C[NH2+]Cc1csc(C(C)(C)C)n1 ZINC000512541041 340366061 /nfs/dbraw/zinc/36/60/61/340366061.db2.gz BYUDMBBASRGVHH-UHFFFAOYSA-N 1 2 324.490 4.591 20 0 DJADLO CCn1c2ccccc2nc1[C@H]1CCC[N@@H+]1Cc1ccccc1F ZINC000512604060 340368511 /nfs/dbraw/zinc/36/85/11/340368511.db2.gz CTHDZCBGJOESHU-LJQANCHMSA-N 1 2 323.415 4.532 20 0 DJADLO CCn1c2ccccc2nc1[C@H]1CCC[N@H+]1Cc1ccccc1F ZINC000512604060 340368512 /nfs/dbraw/zinc/36/85/12/340368512.db2.gz CTHDZCBGJOESHU-LJQANCHMSA-N 1 2 323.415 4.532 20 0 DJADLO Cc1c[nH+]ccc1NC(=O)c1ccccc1Sc1ccccc1 ZINC000173604155 340368601 /nfs/dbraw/zinc/36/86/01/340368601.db2.gz HSQNGWYUQRQSCY-UHFFFAOYSA-N 1 2 320.417 4.794 20 0 DJADLO Cc1ccc(C[NH2+][C@@H](C)c2nc(C3CCCCC3)no2)c(C)c1 ZINC000173867798 340376327 /nfs/dbraw/zinc/37/63/27/340376327.db2.gz AHOZHIXBSLUSTA-HNNXBMFYSA-N 1 2 313.445 4.585 20 0 DJADLO C[C@@H]([NH2+]Cc1csc(Cl)c1Cl)c1c(F)cncc1F ZINC000513081042 340392544 /nfs/dbraw/zinc/39/25/44/340392544.db2.gz DRKHVEZTVRISCC-ZCFIWIBFSA-N 1 2 323.195 4.579 20 0 DJADLO C[C@H]([NH2+]Cc1cc(Cl)cc(Cl)c1)c1c(F)cncc1F ZINC000513091302 340392887 /nfs/dbraw/zinc/39/28/87/340392887.db2.gz ZMSPXFTVPMQUAJ-QMMMGPOBSA-N 1 2 317.166 4.517 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1cccc(Cl)c1F ZINC000513261467 340399846 /nfs/dbraw/zinc/39/98/46/340399846.db2.gz NGGVMOZCHRBYSO-IUCAKERBSA-N 1 2 314.738 4.564 20 0 DJADLO Cc1ccccc1CSCc1[nH+]ccn1Cc1ccccc1 ZINC000219737766 340508940 /nfs/dbraw/zinc/50/89/40/340508940.db2.gz CAPSBCPUKJJDDM-UHFFFAOYSA-N 1 2 308.450 4.673 20 0 DJADLO COc1cc(Cl)ccc1C[NH2+][C@@H](C)c1csc(C(C)C)n1 ZINC000186329470 340511263 /nfs/dbraw/zinc/51/12/63/340511263.db2.gz VTBZOXXFHBNWRJ-NSHDSACASA-N 1 2 324.877 4.779 20 0 DJADLO CC(C)COC[C@H]([NH2+][C@H](C)c1cc(F)ccc1F)c1ccco1 ZINC000152570571 340527627 /nfs/dbraw/zinc/52/76/27/340527627.db2.gz DPJQOHFLIXWLAF-DYVFJYSZSA-N 1 2 323.383 4.622 20 0 DJADLO CSCCCC(=O)Nc1c2ccccc2[nH+]c(C)c1C(C)C ZINC000191956572 340560516 /nfs/dbraw/zinc/56/05/16/340560516.db2.gz HJWDDOZCLVAJKT-UHFFFAOYSA-N 1 2 316.470 4.748 20 0 DJADLO Cn1c(CCSCc2ccc(Cl)cc2)[nH+]c2ccccc21 ZINC000522829485 340607422 /nfs/dbraw/zinc/60/74/22/340607422.db2.gz HIHXKBAOMSOULS-UHFFFAOYSA-N 1 2 316.857 4.703 20 0 DJADLO Cc1cccn2cc(CNc3cccc(Cl)c3Cl)[nH+]c12 ZINC000524488635 340655083 /nfs/dbraw/zinc/65/50/83/340655083.db2.gz IHKANHQZYCMNNI-UHFFFAOYSA-N 1 2 306.196 4.562 20 0 DJADLO Fc1ccc(C[NH2+][C@H](c2ccco2)c2ccccc2)c(Cl)c1 ZINC000237790151 340673903 /nfs/dbraw/zinc/67/39/03/340673903.db2.gz NIRJNHKEASTJPD-SFHVURJKSA-N 1 2 315.775 4.951 20 0 DJADLO CCc1nc([C@H](C)[NH2+]Cc2ccsc2C(F)(F)F)cs1 ZINC000529546860 340762113 /nfs/dbraw/zinc/76/21/13/340762113.db2.gz GNNAFQQIOQHQCW-QMMMGPOBSA-N 1 2 320.405 4.637 20 0 DJADLO C[C@@H]([NH2+]Cc1ccc(Cl)o1)c1ccccc1Br ZINC000037487128 340785532 /nfs/dbraw/zinc/78/55/32/340785532.db2.gz QOBKJIFZESHEIM-SECBINFHSA-N 1 2 314.610 4.546 20 0 DJADLO CCc1nc(C[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)cs1 ZINC000124053902 340796999 /nfs/dbraw/zinc/79/69/99/340796999.db2.gz XWGVCYNLBORZEB-VIFPVBQESA-N 1 2 315.269 4.863 20 0 DJADLO CCc1ccc([C@@H](C)[NH2+][C@@H](C)c2noc(-c3ccccc3)n2)cc1 ZINC000124275180 340798142 /nfs/dbraw/zinc/79/81/42/340798142.db2.gz VERTXBYKVNBDJJ-CABCVRRESA-N 1 2 321.424 4.711 20 0 DJADLO CCCc1nc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@@H](C)CC)no1 ZINC000538188836 340812549 /nfs/dbraw/zinc/81/25/49/340812549.db2.gz ZSQXEHIICIJQOV-SJCJKPOMSA-N 1 2 321.852 4.553 20 0 DJADLO CC1CCC(Nc2cccc3c2CN(c2cccc[nH+]2)C3)CC1 ZINC000538428856 340823317 /nfs/dbraw/zinc/82/33/17/340823317.db2.gz UCNCXRLDZAVCIW-UHFFFAOYSA-N 1 2 307.441 4.592 20 0 DJADLO C[C@H]([NH2+]Cc1cc(-c2cccs2)on1)c1c(F)cccc1F ZINC000539234911 340877669 /nfs/dbraw/zinc/87/76/69/340877669.db2.gz WLEUCTOWWHNNFU-JTQLQIEISA-N 1 2 320.364 4.532 20 0 DJADLO Cc1cnc([C@@H](C)[NH2+][C@H](C)c2ccc(SC(C)C)cc2)o1 ZINC000539302589 340880183 /nfs/dbraw/zinc/88/01/83/340880183.db2.gz AWRAKNOIIUHCIL-ZIAGYGMSSA-N 1 2 304.459 4.895 20 0 DJADLO CCCc1nc(CSCc2[nH+]cc(C)c(OC)c2C)cs1 ZINC000539625657 340893309 /nfs/dbraw/zinc/89/33/09/340893309.db2.gz RBNZZQXVOHSKGO-UHFFFAOYSA-N 1 2 322.499 4.549 20 0 DJADLO CC(C)c1cnc(C[N@@H+]2CC[C@H](C)C[C@@H]2c2ccco2)s1 ZINC000542465829 341008408 /nfs/dbraw/zinc/00/84/08/341008408.db2.gz MIAZHDLGRSYDDX-UONOGXRCSA-N 1 2 304.459 4.833 20 0 DJADLO CC(C)c1cnc(C[N@H+]2CC[C@H](C)C[C@@H]2c2ccco2)s1 ZINC000542465829 341008409 /nfs/dbraw/zinc/00/84/09/341008409.db2.gz MIAZHDLGRSYDDX-UONOGXRCSA-N 1 2 304.459 4.833 20 0 DJADLO CC(C)c1ccccc1NC(=O)[C@H](C)[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000543059709 341029630 /nfs/dbraw/zinc/02/96/30/341029630.db2.gz CIBMUMPVTFLQPA-HOTGVXAUSA-N 1 2 322.452 4.714 20 0 DJADLO CC(C)c1ccccc1NC(=O)[C@H](C)[N@H+]1Cc2ccccc2[C@@H]1C ZINC000543059709 341029631 /nfs/dbraw/zinc/02/96/31/341029631.db2.gz CIBMUMPVTFLQPA-HOTGVXAUSA-N 1 2 322.452 4.714 20 0 DJADLO Cc1ccc(-c2nnc([C@@H](C)[N@@H+]3Cc4ccccc4[C@H]3C)o2)cc1 ZINC000543061270 341029838 /nfs/dbraw/zinc/02/98/38/341029838.db2.gz RWAODLNWRJPGIH-HUUCEWRRSA-N 1 2 319.408 4.683 20 0 DJADLO Cc1ccc(-c2nnc([C@@H](C)[N@H+]3Cc4ccccc4[C@H]3C)o2)cc1 ZINC000543061270 341029839 /nfs/dbraw/zinc/02/98/39/341029839.db2.gz RWAODLNWRJPGIH-HUUCEWRRSA-N 1 2 319.408 4.683 20 0 DJADLO CCc1ccc([C@@H]2CCCC[N@@H+]2Cc2nc(C3CC3)cs2)o1 ZINC000543206120 341036653 /nfs/dbraw/zinc/03/66/53/341036653.db2.gz HSRDUBYUXPAPSK-INIZCTEOSA-N 1 2 316.470 4.903 20 0 DJADLO CCc1ccc([C@@H]2CCCC[N@H+]2Cc2nc(C3CC3)cs2)o1 ZINC000543206120 341036654 /nfs/dbraw/zinc/03/66/54/341036654.db2.gz HSRDUBYUXPAPSK-INIZCTEOSA-N 1 2 316.470 4.903 20 0 DJADLO Cc1ccc(C[NH2+][C@H](c2cccnc2)c2ccc(F)cc2F)cc1 ZINC000543406272 341042689 /nfs/dbraw/zinc/04/26/89/341042689.db2.gz JOGRMKFJJUJJAX-HXUWFJFHSA-N 1 2 324.374 4.547 20 0 DJADLO Fc1ccccc1C[N@H+](Cc1ccco1)Cc1cccs1 ZINC000071805288 341048600 /nfs/dbraw/zinc/04/86/00/341048600.db2.gz QSRVSLUEJRIHHB-UHFFFAOYSA-N 1 2 301.386 4.683 20 0 DJADLO Fc1ccccc1C[N@@H+](Cc1ccco1)Cc1cccs1 ZINC000071805288 341048601 /nfs/dbraw/zinc/04/86/01/341048601.db2.gz QSRVSLUEJRIHHB-UHFFFAOYSA-N 1 2 301.386 4.683 20 0 DJADLO CCC(C)(C)OCc1ccccc1NCc1[nH+]ccn1C(C)C ZINC000543656444 341053108 /nfs/dbraw/zinc/05/31/08/341053108.db2.gz DEHWRGBTBSHRHK-UHFFFAOYSA-N 1 2 315.461 4.781 20 0 DJADLO CC(C)c1cnc(C[N@H+]2CC=C(c3ccc(F)cc3)CC2)s1 ZINC000544351806 341077676 /nfs/dbraw/zinc/07/76/76/341077676.db2.gz XAPGPKCNXRDNCL-UHFFFAOYSA-N 1 2 316.445 4.695 20 0 DJADLO CC(C)c1cnc(C[N@@H+]2CC=C(c3ccc(F)cc3)CC2)s1 ZINC000544351806 341077677 /nfs/dbraw/zinc/07/76/77/341077677.db2.gz XAPGPKCNXRDNCL-UHFFFAOYSA-N 1 2 316.445 4.695 20 0 DJADLO c1ccc(-c2ccc[nH+]c2NCc2ccnc3ccccc23)cc1 ZINC000545221003 341115243 /nfs/dbraw/zinc/11/52/43/341115243.db2.gz GABYQIRIBWGZKA-UHFFFAOYSA-N 1 2 311.388 4.909 20 0 DJADLO CC(C)c1ccc([C@@H](C)[NH2+][C@H](C)c2nc(C(C)(C)C)no2)cc1 ZINC000073984266 341124466 /nfs/dbraw/zinc/12/44/66/341124466.db2.gz CZTFHEQTDBNRRV-ZIAGYGMSSA-N 1 2 315.461 4.902 20 0 DJADLO Cc1ccc(N[C@H](Cc2cccnc2)c2ccc(Cl)cc2)c[nH+]1 ZINC000546167439 341155624 /nfs/dbraw/zinc/15/56/24/341155624.db2.gz VLEBHQKIPAIKJC-LJQANCHMSA-N 1 2 323.827 4.834 20 0 DJADLO CC[C@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1cc(F)ccc1F ZINC000133499186 341176806 /nfs/dbraw/zinc/17/68/06/341176806.db2.gz GLFIZPOUUPRZOR-AWEZNQCLSA-N 1 2 324.440 4.960 20 0 DJADLO CC[C@@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1cc(F)ccc1F ZINC000133499385 341176824 /nfs/dbraw/zinc/17/68/24/341176824.db2.gz GLFIZPOUUPRZOR-CQSZACIVSA-N 1 2 324.440 4.960 20 0 DJADLO Cc1nc([C@@H]([NH2+][C@@H](C)CCC(C)C)c2ccc(Cl)cc2)no1 ZINC000546655908 341177489 /nfs/dbraw/zinc/17/74/89/341177489.db2.gz DCTVJKPJGNIHPM-LRDDRELGSA-N 1 2 321.852 4.535 20 0 DJADLO C[N@H+](Cc1cscn1)[C@@H]1CCc2c1cc(Cl)cc2Cl ZINC000133720807 341183082 /nfs/dbraw/zinc/18/30/82/341183082.db2.gz PKHGRVNMFTUQOO-CQSZACIVSA-N 1 2 313.253 4.569 20 0 DJADLO C[N@@H+](Cc1cscn1)[C@@H]1CCc2c1cc(Cl)cc2Cl ZINC000133720807 341183083 /nfs/dbraw/zinc/18/30/83/341183083.db2.gz PKHGRVNMFTUQOO-CQSZACIVSA-N 1 2 313.253 4.569 20 0 DJADLO Cc1cccc([C@H]2CCCC[N@@H+]2Cc2nccn2C(F)F)c1C ZINC000075999529 341195314 /nfs/dbraw/zinc/19/53/14/341195314.db2.gz SETDUKWDICHUOP-MRXNPFEDSA-N 1 2 319.399 4.622 20 0 DJADLO Cc1cccc([C@H]2CCCC[N@H+]2Cc2nccn2C(F)F)c1C ZINC000075999529 341195315 /nfs/dbraw/zinc/19/53/15/341195315.db2.gz SETDUKWDICHUOP-MRXNPFEDSA-N 1 2 319.399 4.622 20 0 DJADLO Cc1[nH]c2ccc(CSc3c(F)cc(F)cc3F)cc2[nH+]1 ZINC000547349250 341207871 /nfs/dbraw/zinc/20/78/71/341207871.db2.gz GXTHORGGMXCTLG-UHFFFAOYSA-N 1 2 308.328 4.581 20 0 DJADLO Cc1[nH]c2cc(CSc3c(F)cc(F)cc3F)ccc2[nH+]1 ZINC000547349250 341207872 /nfs/dbraw/zinc/20/78/72/341207872.db2.gz GXTHORGGMXCTLG-UHFFFAOYSA-N 1 2 308.328 4.581 20 0 DJADLO C[C@@H]([NH2+][C@H](c1ccccc1)c1ccc(F)cc1)c1nccs1 ZINC000134218991 341209685 /nfs/dbraw/zinc/20/96/85/341209685.db2.gz QIVFZBBHGLVCLI-CXAGYDPISA-N 1 2 312.413 4.722 20 0 DJADLO O=C(Nc1ccc(-c2c[nH]c[nH+]2)cc1)c1cccc(C2CCC2)c1 ZINC000547379268 341210067 /nfs/dbraw/zinc/21/00/67/341210067.db2.gz PFJVVKAUVDQLKI-UHFFFAOYSA-N 1 2 317.392 4.597 20 0 DJADLO CC[N@@H+](Cc1csc(C2CC2)n1)Cc1ccc(Cl)s1 ZINC000134847003 341225133 /nfs/dbraw/zinc/22/51/33/341225133.db2.gz HQZALSJSUXGYGT-UHFFFAOYSA-N 1 2 312.891 4.758 20 0 DJADLO CC[N@H+](Cc1csc(C2CC2)n1)Cc1ccc(Cl)s1 ZINC000134847003 341225134 /nfs/dbraw/zinc/22/51/34/341225134.db2.gz HQZALSJSUXGYGT-UHFFFAOYSA-N 1 2 312.891 4.758 20 0 DJADLO CC[C@@H]([NH2+]Cc1ccc(Cl)cc1Cl)c1nccs1 ZINC000078004317 341233583 /nfs/dbraw/zinc/23/35/83/341233583.db2.gz ZXXGCTTVRCVSEH-GFCCVEGCSA-N 1 2 301.242 4.691 20 0 DJADLO CCC(=O)c1cc(Cl)ccc1OCc1ccc(C)[nH+]c1C ZINC000547821204 341234812 /nfs/dbraw/zinc/23/48/12/341234812.db2.gz GMRZYWRQDPCEBB-UHFFFAOYSA-N 1 2 303.789 4.524 20 0 DJADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2ccc(Cl)cc2F)n1 ZINC000548066219 341245389 /nfs/dbraw/zinc/24/53/89/341245389.db2.gz NXTZYFPWEBEMDH-QGZVFWFLSA-N 1 2 304.796 4.520 20 0 DJADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2ccc(Cl)cc2F)n1 ZINC000548066219 341245390 /nfs/dbraw/zinc/24/53/90/341245390.db2.gz NXTZYFPWEBEMDH-QGZVFWFLSA-N 1 2 304.796 4.520 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1ccco1)c1ccccc1)c1ccc(F)c(F)c1 ZINC000078971178 341250862 /nfs/dbraw/zinc/25/08/62/341250862.db2.gz JZRJSUVGUJHABJ-BFUOFWGJSA-N 1 2 313.347 4.998 20 0 DJADLO C[C@H]([NH2+][C@@H](c1ccco1)c1ccccc1)c1c(F)cccc1F ZINC000078991482 341251511 /nfs/dbraw/zinc/25/15/11/341251511.db2.gz WMVGVMSXTGEPLG-ORAYPTAESA-N 1 2 313.347 4.998 20 0 DJADLO CC(C)c1nc(C[NH2+][C@@H](C)c2cc3ccccc3o2)cs1 ZINC000079914891 341267509 /nfs/dbraw/zinc/26/75/09/341267509.db2.gz GXIIAYPNFMMWFX-LBPRGKRZSA-N 1 2 300.427 4.864 20 0 DJADLO Cc1nc(-c2cc([C@@H](C)[NH2+][C@@H](C)c3ccon3)cs2)cs1 ZINC000564354957 341271839 /nfs/dbraw/zinc/27/18/39/341271839.db2.gz HQDUYECFLOGMGE-ZJUUUORDSA-N 1 2 319.455 4.580 20 0 DJADLO CC[C@H](CSC)[NH2+][C@H](c1cccc(OC(C)C)c1)C(F)F ZINC000564359555 341278371 /nfs/dbraw/zinc/27/83/71/341278371.db2.gz VRNCXMBXYGLYRS-UKRRQHHQSA-N 1 2 317.445 4.511 20 0 DJADLO CC[C@H](CSC)[NH2+][C@@H](c1cccc(OC(C)C)c1)C(F)F ZINC000564359554 341278376 /nfs/dbraw/zinc/27/83/76/341278376.db2.gz VRNCXMBXYGLYRS-HIFRSBDPSA-N 1 2 317.445 4.511 20 0 DJADLO C[C@@H]1C[N@H+](Cc2ncc(-c3cccs3)o2)[C@@H]1c1ccccc1 ZINC000081574896 341297476 /nfs/dbraw/zinc/29/74/76/341297476.db2.gz PQEPDHUFQNXNEB-ACJLOTCBSA-N 1 2 310.422 4.596 20 0 DJADLO C[C@@H]1C[N@@H+](Cc2ncc(-c3cccs3)o2)[C@@H]1c1ccccc1 ZINC000081574896 341297477 /nfs/dbraw/zinc/29/74/77/341297477.db2.gz PQEPDHUFQNXNEB-ACJLOTCBSA-N 1 2 310.422 4.596 20 0 DJADLO C[C@@H](Nc1cccc([NH+]2CCCCCC2)c1)c1ccncc1F ZINC000550784039 341322887 /nfs/dbraw/zinc/32/28/87/341322887.db2.gz BRDZMHHRINXOQJ-OAHLLOKOSA-N 1 2 313.420 4.774 20 0 DJADLO CC[C@H](C)Oc1cccc(N[C@@H](c2[nH]cc[nH+]2)c2ccccc2)c1 ZINC000550855971 341324606 /nfs/dbraw/zinc/32/46/06/341324606.db2.gz GHCDFESFPVCFKD-HNAYVOBHSA-N 1 2 321.424 4.789 20 0 DJADLO Cc1ccc(NCc2cnc(-c3ccc(Cl)cc3)s2)c[nH+]1 ZINC000551434511 341341760 /nfs/dbraw/zinc/34/17/60/341341760.db2.gz JASKCUFNZNDPSM-UHFFFAOYSA-N 1 2 315.829 4.779 20 0 DJADLO Fc1ccc(C[N@H+](Cc2coc(-c3ccccc3)n2)C2CC2)cc1 ZINC000247546617 341367150 /nfs/dbraw/zinc/36/71/50/341367150.db2.gz URUPJDWPNQULHJ-UHFFFAOYSA-N 1 2 322.383 4.645 20 0 DJADLO Fc1ccc(C[N@@H+](Cc2coc(-c3ccccc3)n2)C2CC2)cc1 ZINC000247546617 341367151 /nfs/dbraw/zinc/36/71/51/341367151.db2.gz URUPJDWPNQULHJ-UHFFFAOYSA-N 1 2 322.383 4.645 20 0 DJADLO C[C@H]([NH2+][C@H](c1nccn1C)C1CC1)c1ccc(Cl)cc1Cl ZINC000552088238 341368759 /nfs/dbraw/zinc/36/87/59/341368759.db2.gz DVFLFPOKICSPQP-BONVTDFDSA-N 1 2 324.255 4.529 20 0 DJADLO C[C@H]1C[N@H+](Cc2csc(-c3ccoc3)n2)[C@H]1c1ccccc1 ZINC000248369725 341375789 /nfs/dbraw/zinc/37/57/89/341375789.db2.gz WPNRZFDTRRIBSK-SUMWQHHRSA-N 1 2 310.422 4.596 20 0 DJADLO C[C@H]1C[N@@H+](Cc2csc(-c3ccoc3)n2)[C@H]1c1ccccc1 ZINC000248369725 341375790 /nfs/dbraw/zinc/37/57/90/341375790.db2.gz WPNRZFDTRRIBSK-SUMWQHHRSA-N 1 2 310.422 4.596 20 0 DJADLO COc1ccccc1[C@@H]([NH2+][C@H](C)c1ccccn1)c1ccccc1 ZINC000089554894 341405441 /nfs/dbraw/zinc/40/54/41/341405441.db2.gz DUOSNWNFKYPPHV-IERDGZPVSA-N 1 2 318.420 4.530 20 0 DJADLO Cc1ccc(NC(=O)c2coc3ccc(C(C)C)cc23)c(C)[nH+]1 ZINC000553059827 341414563 /nfs/dbraw/zinc/41/45/63/341414563.db2.gz SNZIZQLTCZIJFK-UHFFFAOYSA-N 1 2 308.381 4.820 20 0 DJADLO CCc1noc(C)c1C[NH2+][C@@H](C)c1cc(Cl)sc1Cl ZINC000556225999 341498117 /nfs/dbraw/zinc/49/81/17/341498117.db2.gz XTLPPNVZTHFTEJ-ZETCQYMHSA-N 1 2 319.257 4.765 20 0 DJADLO CCSCCC[NH2+][C@@H](c1cccc(OC(C)C)c1)C(F)F ZINC000556254442 341499471 /nfs/dbraw/zinc/49/94/71/341499471.db2.gz USPUMTXUHDNSOD-HNNXBMFYSA-N 1 2 317.445 4.513 20 0 DJADLO Cc1nc([C@@H](C)[NH2+][C@@H](c2ccc(C(C)(C)C)cc2)C(C)C)no1 ZINC000565567121 341531317 /nfs/dbraw/zinc/53/13/17/341531317.db2.gz SCHHJDCOCRMKOV-CXAGYDPISA-N 1 2 315.461 4.723 20 0 DJADLO Cc1cc[nH+]cc1CCCNc1cccc(CC(F)(F)F)c1 ZINC000565682151 341534842 /nfs/dbraw/zinc/53/48/42/341534842.db2.gz CFHVLWSOGYPDMT-UHFFFAOYSA-N 1 2 308.347 4.540 20 0 DJADLO CC(C)c1nc(C[NH2+][C@@H](c2ccc(C(C)C)cc2)C(C)C)no1 ZINC000154355906 341588406 /nfs/dbraw/zinc/58/84/06/341588406.db2.gz IALZOOYCCNQOBT-GOSISDBHSA-N 1 2 315.461 4.803 20 0 DJADLO Cc1nc([C@H](C)[NH2+]Cc2cc(Cl)sc2Cl)cs1 ZINC000312757036 341628500 /nfs/dbraw/zinc/62/85/00/341628500.db2.gz IMVFJYBNLKZNBN-LURJTMIESA-N 1 2 307.271 4.671 20 0 DJADLO CCOc1cccc(Cl)c1C[NH2+]C(C)(C)c1nc(C)cs1 ZINC000577883926 341946288 /nfs/dbraw/zinc/94/62/88/341946288.db2.gz XREUNYNTWTUOAP-UHFFFAOYSA-N 1 2 324.877 4.529 20 0 DJADLO CC(C)(C)Oc1cc[nH+]cc1NCc1cnc(C2CCC2)s1 ZINC000338331593 518899515 /nfs/dbraw/zinc/89/95/15/518899515.db2.gz MYINIYHYTPWIFG-UHFFFAOYSA-N 1 2 317.458 4.595 20 0 DJADLO CC(C)c1csc(C[NH2+][C@@H](C)c2cc(F)c(F)c(F)c2)n1 ZINC000128607121 519854771 /nfs/dbraw/zinc/85/47/71/519854771.db2.gz JULJHVDRXUHBPR-VIFPVBQESA-N 1 2 314.376 4.535 20 0 DJADLO CC(C)n1ccc(C[NH2+]C(C)(c2ccccc2)c2ccccc2)n1 ZINC000182215643 520003575 /nfs/dbraw/zinc/00/35/75/520003575.db2.gz BGFQLPVVYLRVAO-UHFFFAOYSA-N 1 2 319.452 4.517 20 0 DJADLO CCO[C@@H](C)c1nc(C[N@@H+]2CCC[C@H]2c2ccsc2)cs1 ZINC000336832704 520268600 /nfs/dbraw/zinc/26/86/00/520268600.db2.gz AWCWPINCWIYAMQ-WFASDCNBSA-N 1 2 322.499 4.639 20 0 DJADLO CCO[C@@H](C)c1nc(C[N@H+]2CCC[C@H]2c2ccsc2)cs1 ZINC000336832704 520268609 /nfs/dbraw/zinc/26/86/09/520268609.db2.gz AWCWPINCWIYAMQ-WFASDCNBSA-N 1 2 322.499 4.639 20 0 DJADLO CCOc1cccc([C@@H](C)[NH2+]Cc2ncc(-c3ccccc3)o2)c1 ZINC000180707398 521414841 /nfs/dbraw/zinc/41/48/41/521414841.db2.gz ZMSKHNLTXQVTQF-OAHLLOKOSA-N 1 2 322.408 4.591 20 0 DJADLO CCc1cnc(C[NH2+][C@@H](C)c2cc(Cl)sc2Cl)s1 ZINC000130510171 522038488 /nfs/dbraw/zinc/03/84/88/522038488.db2.gz AYJNIWFBEJKZAY-ZETCQYMHSA-N 1 2 321.298 4.925 20 0 DJADLO CCc1nc([C@@H](C)[NH2+][C@H](C)c2csc(Cl)c2)cs1 ZINC000191280759 522422904 /nfs/dbraw/zinc/42/29/04/522422904.db2.gz XRXYOYBPMZFSCU-RKDXNWHRSA-N 1 2 300.880 4.832 20 0 DJADLO CC[C@@H]([NH2+][C@H](C)c1noc(-c2ccccc2)n1)c1ccccc1 ZINC000124300342 522941628 /nfs/dbraw/zinc/94/16/28/522941628.db2.gz DIEZWMGCOXCMPE-RHSMWYFYSA-N 1 2 307.397 4.539 20 0 DJADLO COc1ccc(C)cc1[C@H](C)[NH2+][C@@H](C)c1ncc(C(C)(C)C)o1 ZINC000267050070 523858130 /nfs/dbraw/zinc/85/81/30/523858130.db2.gz OWKOSWAFMILIQF-KBPBESRZSA-N 1 2 316.445 4.701 20 0 DJADLO CO[C@H](C)c1nc(C[N@H+](C)[C@H](C)c2ccc(C)cc2C)cs1 ZINC000267071714 523910388 /nfs/dbraw/zinc/91/03/88/523910388.db2.gz VVUOVNWALJDBNX-HUUCEWRRSA-N 1 2 318.486 4.660 20 0 DJADLO CO[C@H](C)c1nc(C[N@@H+](C)[C@H](C)c2ccc(C)cc2C)cs1 ZINC000267071714 523910392 /nfs/dbraw/zinc/91/03/92/523910392.db2.gz VVUOVNWALJDBNX-HUUCEWRRSA-N 1 2 318.486 4.660 20 0 DJADLO CCc1ccc([C@@H](C)[NH2+][C@@H](c2ccccc2)c2ccccn2)o1 ZINC000154657519 524027222 /nfs/dbraw/zinc/02/72/22/524027222.db2.gz KJZKGRZZZUBTQN-QRWLVFNGSA-N 1 2 306.409 4.677 20 0 DJADLO Cc1cccc(C(C)C)c1NC(=O)c1ccc(-n2cc[nH+]c2)cc1 ZINC000102830800 524240420 /nfs/dbraw/zinc/24/04/20/524240420.db2.gz MYNJZUCMQBGEQE-UHFFFAOYSA-N 1 2 319.408 4.556 20 0 DJADLO COc1ccc(F)cc1[C@@H](C)[NH2+][C@H](C)c1csc(C(C)C)n1 ZINC000181019518 524330803 /nfs/dbraw/zinc/33/08/03/524330803.db2.gz BRWZCZPTYRXOFM-VXGBXAGGSA-N 1 2 322.449 4.826 20 0 DJADLO C[C@H]([NH2+]Cc1csc(C2CCCCC2)n1)c1ccncc1F ZINC000338355708 525482791 /nfs/dbraw/zinc/48/27/91/525482791.db2.gz KZHKNSVNXLOSKS-LBPRGKRZSA-N 1 2 319.449 4.576 20 0 DJADLO C[C@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1cc(F)cc(F)c1 ZINC000154631412 525597449 /nfs/dbraw/zinc/59/74/49/525597449.db2.gz XRMKPBUURSHEHO-VBKZILBWSA-N 1 2 324.374 4.800 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1Cl)c1cscn1 ZINC000162310206 525657630 /nfs/dbraw/zinc/65/76/30/525657630.db2.gz LVLHPLRMLKCTJL-RKDXNWHRSA-N 1 2 301.242 4.862 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1nc(C2CC2)no1)c1cc2ccccc2s1 ZINC000184353615 525665772 /nfs/dbraw/zinc/66/57/72/525665772.db2.gz RKZATTZDRYXAOX-GHMZBOCLSA-N 1 2 313.426 4.574 20 0 DJADLO C[C@@H]([NH2+][C@H](c1ccc(F)cc1F)C(C)(C)C)c1cscn1 ZINC000271122939 525669331 /nfs/dbraw/zinc/66/93/31/525669331.db2.gz JUUGPPFDRQQCIO-MEBBXXQBSA-N 1 2 310.413 4.859 20 0 DJADLO C[C@@H](Nc1cccc([NH+]2CCCCCC2)c1)c1nccs1 ZINC000179959067 525719387 /nfs/dbraw/zinc/71/93/87/525719387.db2.gz ZBGQCJNXUJKJIA-CQSZACIVSA-N 1 2 301.459 4.697 20 0 DJADLO Cc1cnc(C[NH2+][C@@H](c2ccc(F)cc2F)C(C)(C)C)s1 ZINC000181619732 526044749 /nfs/dbraw/zinc/04/47/49/526044749.db2.gz GONOEHQPGZOYID-HNNXBMFYSA-N 1 2 310.413 4.607 20 0 DJADLO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2cc3cc(Cl)ccc3o2)s1 ZINC000338289036 526396950 /nfs/dbraw/zinc/39/69/50/526396950.db2.gz GPDJWWNVTWVDCG-RKDXNWHRSA-N 1 2 321.833 4.658 20 0 DJADLO Cc1nc(C[N@@H+](C)[C@@H](C)c2ccc(C(F)(F)F)cc2)cs1 ZINC000102923926 526843413 /nfs/dbraw/zinc/84/34/13/526843413.db2.gz IYQJHWIONCZBRU-JTQLQIEISA-N 1 2 314.376 4.663 20 0 DJADLO Cc1nc(C[N@H+](C)[C@@H](C)c2ccc(C(F)(F)F)cc2)cs1 ZINC000102923926 526843418 /nfs/dbraw/zinc/84/34/18/526843418.db2.gz IYQJHWIONCZBRU-JTQLQIEISA-N 1 2 314.376 4.663 20 0 DJADLO C[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccc(F)cc1Cl ZINC000090459563 185297531 /nfs/dbraw/zinc/29/75/31/185297531.db2.gz IIFCPOJILFZWKY-VIFPVBQESA-N 1 2 310.825 4.664 20 0 DJADLO CC[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1cc(F)ccc1F ZINC000090458844 185297574 /nfs/dbraw/zinc/29/75/74/185297574.db2.gz MKRSWFDGJSOFCS-AWEZNQCLSA-N 1 2 308.397 4.540 20 0 DJADLO C[C@@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1cc2ccccc2o1 ZINC000090572192 185304421 /nfs/dbraw/zinc/30/44/21/185304421.db2.gz JIFPPANWGNVYTG-CQSZACIVSA-N 1 2 309.413 4.595 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1cc(Cl)ccc1Cl)c1nccs1 ZINC000080266450 192019082 /nfs/dbraw/zinc/01/90/82/192019082.db2.gz QHFULOKPYVRMLD-IUCAKERBSA-N 1 2 301.242 4.862 20 0 DJADLO CCc1ccc([C@@H](C)[NH2+][C@H](c2cccc(F)c2)c2ccccn2)o1 ZINC000090956143 192965349 /nfs/dbraw/zinc/96/53/49/192965349.db2.gz SNOQOZCOFDAISH-JLTOFOAXSA-N 1 2 324.399 4.816 20 0 DJADLO Cc1cccc([C@@H](C)[NH2+]Cc2noc(C3CCCCC3)n2)c1C ZINC000183729995 335041161 /nfs/dbraw/zinc/04/11/61/335041161.db2.gz QRJFRJIODWFBFH-OAHLLOKOSA-N 1 2 313.445 4.585 20 0 DJADLO Cc1ccc([C@H]2CCCCN2C(=O)Nc2ccc(C)[nH+]c2C)cc1 ZINC000152393630 335047685 /nfs/dbraw/zinc/04/76/85/335047685.db2.gz DBTZECMTMSCOBA-LJQANCHMSA-N 1 2 323.440 4.766 20 0 DJADLO C(=C/c1ccccc1)\C[N@@H+]1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC000287590731 533350201 /nfs/dbraw/zinc/35/02/01/533350201.db2.gz YGFMJONRLOSIRF-HKMNZKMDSA-N 1 2 323.440 4.578 20 0 DJADLO C(=C/c1ccccc1)\C[N@H+]1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC000287590731 533350207 /nfs/dbraw/zinc/35/02/07/533350207.db2.gz YGFMJONRLOSIRF-HKMNZKMDSA-N 1 2 323.440 4.578 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1nc(-c2ccccc2)cs1)c1cscn1 ZINC000271506045 129926140 /nfs/dbraw/zinc/92/61/40/129926140.db2.gz RRBIEPZKHXMOTO-RYUDHWBXSA-N 1 2 315.467 4.678 20 0 DJADLO C[C@H]([NH2+]C1(c2c(Cl)cccc2Cl)CC1)c1cncs1 ZINC000272288669 130016620 /nfs/dbraw/zinc/01/66/20/130016620.db2.gz PQKYECAZHXJOFV-VIFPVBQESA-N 1 2 313.253 4.790 20 0 DJADLO CC[C@@H]([NH2+][C@@H](C)c1nnc(C(C)C)[nH]1)c1cccc(Cl)c1F ZINC000274092066 130205200 /nfs/dbraw/zinc/20/52/00/130205200.db2.gz UFAJPMJVJMRYQN-GXFFZTMASA-N 1 2 324.831 4.523 20 0 DJADLO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(-c3ccccc3)o2)s1 ZINC000274288449 130223159 /nfs/dbraw/zinc/22/31/59/130223159.db2.gz ZUFHGFFDQGGDQR-RYUDHWBXSA-N 1 2 313.426 4.518 20 0 DJADLO Cc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2csc(C3CC3)n2)o1 ZINC000340194201 131121128 /nfs/dbraw/zinc/12/11/28/131121128.db2.gz GKFJEXQPBITTOA-WBMJQRKESA-N 1 2 316.470 4.895 20 0 DJADLO Cc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2csc(C3CC3)n2)o1 ZINC000340194201 131121130 /nfs/dbraw/zinc/12/11/30/131121130.db2.gz GKFJEXQPBITTOA-WBMJQRKESA-N 1 2 316.470 4.895 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1Cl)c1c(F)cncc1F ZINC000285587038 131183479 /nfs/dbraw/zinc/18/34/79/131183479.db2.gz HOTUVTOKNIHLDT-DTWKUNHWSA-N 1 2 314.738 4.564 20 0 DJADLO Cc1cccc([C@H]2CCCN2C(=O)Nc2c(C)cc[nH+]c2C)c1C ZINC000287492829 131283443 /nfs/dbraw/zinc/28/34/43/131283443.db2.gz KZLDPGJIADSCOF-GOSISDBHSA-N 1 2 323.440 4.684 20 0 DJADLO CCOCc1ccc(CNc2[nH+]ccc3ccc(F)cc32)cc1 ZINC000340263061 131302823 /nfs/dbraw/zinc/30/28/23/131302823.db2.gz GWPRLQMDIRJUCE-UHFFFAOYSA-N 1 2 310.372 4.523 20 0 DJADLO CSCc1cnc(C[NH2+][C@@H](C)c2cc3ccccc3o2)s1 ZINC000293165448 131713156 /nfs/dbraw/zinc/71/31/56/131713156.db2.gz FWTMGNVSHVUHHY-NSHDSACASA-N 1 2 318.467 4.603 20 0 DJADLO Cc1cc([C@H](C)[NH2+][C@H](C)c2noc(-c3ccccc3)n2)cs1 ZINC000296631335 131977393 /nfs/dbraw/zinc/97/73/93/131977393.db2.gz CGKPGPGGLVYFLG-QWHCGFSZSA-N 1 2 313.426 4.518 20 0 DJADLO C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccc(F)cc2F)C(C)(C)C)c2nccn21 ZINC000297948333 132041197 /nfs/dbraw/zinc/04/11/97/132041197.db2.gz YMQPRCVHGUQJJK-LYRGGWFBSA-N 1 2 319.399 4.544 20 0 DJADLO Cc1[nH]ncc1C[NH2+][C@H](CCCc1ccccc1)c1ccccc1 ZINC000120878176 132147546 /nfs/dbraw/zinc/14/75/46/132147546.db2.gz JSWRITWEXZGMTD-OAQYLSRUSA-N 1 2 319.452 4.572 20 0 DJADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@@H+]1CC[C@](F)(c2ccccc2)C1 ZINC000563861672 335068655 /nfs/dbraw/zinc/06/86/55/335068655.db2.gz PCOSRDTVEYPXMB-IFXJQAMLSA-N 1 2 316.420 4.604 20 0 DJADLO C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+]1CC[C@](F)(c2ccccc2)C1 ZINC000563861672 335068656 /nfs/dbraw/zinc/06/86/56/335068656.db2.gz PCOSRDTVEYPXMB-IFXJQAMLSA-N 1 2 316.420 4.604 20 0 DJADLO CC[C@H]([NH2+]Cc1nc(-c2ccccc2)cs1)c1nccs1 ZINC000078004083 331674338 /nfs/dbraw/zinc/67/43/38/331674338.db2.gz DSVNETJOYSDHFN-ZDUSSCGKSA-N 1 2 315.467 4.508 20 0 DJADLO CCn1c[nH+]cc1CNc1ccc(SC2CCCC2)cc1 ZINC000090171373 331986019 /nfs/dbraw/zinc/98/60/19/331986019.db2.gz HNNFYDPVXLVOSY-UHFFFAOYSA-N 1 2 301.459 4.550 20 0 DJADLO CSc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1nc(C(C)(C)C)no1 ZINC000409841449 332059459 /nfs/dbraw/zinc/05/94/59/332059459.db2.gz FRFDIIXEQSWEEO-NEPJUHHUSA-N 1 2 319.474 4.501 20 0 DJADLO CC(C)(C)C(C)(C)C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000559755928 332279481 /nfs/dbraw/zinc/27/94/81/332279481.db2.gz OBBNDSHBUCPRGY-UHFFFAOYSA-N 1 2 312.413 4.885 20 0 DJADLO COC[C@H]([NH2+][C@H](C)c1cc2ccc(C)cc2o1)c1ccc(C)o1 ZINC000426071662 335098687 /nfs/dbraw/zinc/09/86/87/335098687.db2.gz UGOPUBGDRICJGE-ZBFHGGJFSA-N 1 2 313.397 4.681 20 0 DJADLO CC[C@@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1ccsc1 ZINC000394306020 332346110 /nfs/dbraw/zinc/34/61/10/332346110.db2.gz VDKQZABIFRHBPB-MRXNPFEDSA-N 1 2 301.459 4.697 20 0 DJADLO CSc1cccc(N[C@H](c2[nH]cc[nH+]2)C2CCCCC2)c1 ZINC000560542751 332355740 /nfs/dbraw/zinc/35/57/40/332355740.db2.gz GUGLVTQDKVSDOC-INIZCTEOSA-N 1 2 301.459 4.865 20 0 DJADLO Cc1cnc(C[N@@H+](C)[C@@H](C)c2ccc(Cl)c(Cl)c2)s1 ZINC000560840767 332389762 /nfs/dbraw/zinc/38/97/62/332389762.db2.gz GHGCIEJOAPRERF-JTQLQIEISA-N 1 2 315.269 4.951 20 0 DJADLO Cc1cnc(C[N@H+](C)[C@@H](C)c2ccc(Cl)c(Cl)c2)s1 ZINC000560840767 332389763 /nfs/dbraw/zinc/38/97/63/332389763.db2.gz GHGCIEJOAPRERF-JTQLQIEISA-N 1 2 315.269 4.951 20 0 DJADLO Cc1csc([C@H](C)Nc2cc[nH+]c3c(Cl)cccc23)n1 ZINC000561181886 332420666 /nfs/dbraw/zinc/42/06/66/332420666.db2.gz FZWFSBDRIQAMEB-JTQLQIEISA-N 1 2 303.818 4.826 20 0 DJADLO Cc1cccc([C@H]2CCCN2c2cc[nH+]c3c(Cl)cccc23)n1 ZINC000561259642 332430432 /nfs/dbraw/zinc/43/04/32/332430432.db2.gz QVDNBQKJBHCEGF-GOSISDBHSA-N 1 2 323.827 4.933 20 0 DJADLO CCOc1cc(N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)ccc1C ZINC000561298159 332435100 /nfs/dbraw/zinc/43/51/00/332435100.db2.gz DOZSPPUGYQYIIC-INIZCTEOSA-N 1 2 321.424 4.753 20 0 DJADLO CCSCc1cc[nH+]c(NCc2ccc(SC)s2)c1 ZINC000562071644 332542034 /nfs/dbraw/zinc/54/20/34/332542034.db2.gz JLDOGSMWJCVYOI-UHFFFAOYSA-N 1 2 310.513 4.730 20 0 DJADLO Cc1ccc(NC(=O)N2CCCCC[C@H]2c2ccccc2)c(C)[nH+]1 ZINC000176709514 332953321 /nfs/dbraw/zinc/95/33/21/332953321.db2.gz MIMXOXLORMJLGB-IBGZPJMESA-N 1 2 323.440 4.848 20 0 DJADLO C[C@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1ccc(F)cc1F ZINC000376522204 332974374 /nfs/dbraw/zinc/97/43/74/332974374.db2.gz WTBRJHPALMAPSS-VBKZILBWSA-N 1 2 324.374 4.800 20 0 DJADLO C[C@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1ccc(F)cc1F ZINC000376522206 332974458 /nfs/dbraw/zinc/97/44/58/332974458.db2.gz WTBRJHPALMAPSS-XOBRGWDASA-N 1 2 324.374 4.800 20 0 DJADLO Cc1nc(C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cc2)oc1C ZINC000181426844 333030289 /nfs/dbraw/zinc/03/02/89/333030289.db2.gz BGUYXELYTVSQOH-HNNXBMFYSA-N 1 2 306.409 4.809 20 0 DJADLO Cc1cccc(N[C@@H](c2[nH]cc[nH+]2)c2ccc(F)cc2)c1Cl ZINC000188432813 333045998 /nfs/dbraw/zinc/04/59/98/333045998.db2.gz WBODBIJSMQDDCO-MRXNPFEDSA-N 1 2 315.779 4.712 20 0 DJADLO CC[C@](C)([NH2+]Cc1cc(F)ccc1Cl)c1nc(C)cs1 ZINC000189200613 333066068 /nfs/dbraw/zinc/06/60/68/333066068.db2.gz RNLHEHHSTIFGAG-HNNXBMFYSA-N 1 2 312.841 4.659 20 0 DJADLO C[C@H]([NH2+]Cc1ncc(-c2ccccc2)o1)c1cc2ccccc2o1 ZINC000181763813 333074415 /nfs/dbraw/zinc/07/44/15/333074415.db2.gz PBLHMQARJAGTFZ-AWEZNQCLSA-N 1 2 318.376 4.939 20 0 DJADLO Cc1[nH]c2ccc(CSc3ccc4ccccc4n3)cc2[nH+]1 ZINC000460428036 333084744 /nfs/dbraw/zinc/08/47/44/333084744.db2.gz KFDHOZYKYSFIAN-UHFFFAOYSA-N 1 2 305.406 4.712 20 0 DJADLO Cc1[nH]c2cc(CSc3ccc4ccccc4n3)ccc2[nH+]1 ZINC000460428036 333084745 /nfs/dbraw/zinc/08/47/45/333084745.db2.gz KFDHOZYKYSFIAN-UHFFFAOYSA-N 1 2 305.406 4.712 20 0 DJADLO Cc1ccc(C[NH2+][C@@H](C)c2cc(Cl)sc2Cl)nc1C ZINC000314343341 333103897 /nfs/dbraw/zinc/10/38/97/333103897.db2.gz VGXLOBFXYFLXSJ-JTQLQIEISA-N 1 2 315.269 4.918 20 0 DJADLO C[C@H]1C[C@@H](Nc2cccc(Oc3ccccc3)c2)c2[nH+]ccn21 ZINC000379073683 333181935 /nfs/dbraw/zinc/18/19/35/333181935.db2.gz BUTBAZUSXAVFDF-KBXCAEBGSA-N 1 2 305.381 4.793 20 0 DJADLO C[C@@H](CCCC(F)(F)F)Nc1ccc(N2CCCCC2)[nH+]c1 ZINC000318604491 333193203 /nfs/dbraw/zinc/19/32/03/333193203.db2.gz NGTPFKQTGSBTGX-ZDUSSCGKSA-N 1 2 315.383 4.605 20 0 DJADLO Fc1ccc(F)c(SCc2[nH+]ccn2Cc2ccccc2)c1 ZINC000497326766 333235859 /nfs/dbraw/zinc/23/58/59/333235859.db2.gz ZNJPBMUJJCIDEI-UHFFFAOYSA-N 1 2 316.376 4.502 20 0 DJADLO CC[C@H]([NH2+][C@@H](C)c1nc2c(s1)CCC2)c1cc(F)ccc1F ZINC000502057908 333284513 /nfs/dbraw/zinc/28/45/13/333284513.db2.gz NRRRJVWQQLIWID-HZMBPMFUSA-N 1 2 322.424 4.712 20 0 DJADLO CC(C)[C@@H]([NH2+][C@H](C)c1nc(C(C)(C)C)no1)c1ccc(F)cc1 ZINC000502483952 333300361 /nfs/dbraw/zinc/30/03/61/333300361.db2.gz FDMFBKGZDQTQMZ-IUODEOHRSA-N 1 2 319.424 4.554 20 0 DJADLO CCCCc1nc(C[N@@H+]2CCc3sccc3[C@H]2C)cs1 ZINC000497998843 333318519 /nfs/dbraw/zinc/31/85/19/333318519.db2.gz WRUOWINFWWETPX-GFCCVEGCSA-N 1 2 306.500 4.667 20 0 DJADLO CCCCc1nc(C[N@H+]2CCc3sccc3[C@H]2C)cs1 ZINC000497998843 333318521 /nfs/dbraw/zinc/31/85/21/333318521.db2.gz WRUOWINFWWETPX-GFCCVEGCSA-N 1 2 306.500 4.667 20 0 DJADLO C[C@H]([NH2+]Cc1nc2ccccc2o1)c1cc(Cl)ccc1Cl ZINC000186755940 333377590 /nfs/dbraw/zinc/37/75/90/333377590.db2.gz GGQOUDBDAIKEJV-JTQLQIEISA-N 1 2 321.207 4.985 20 0 DJADLO C[C@@H]([NH2+][C@H](c1ccccc1)c1cccc(F)c1)c1cscn1 ZINC000534329339 333577435 /nfs/dbraw/zinc/57/74/35/333577435.db2.gz LNHPDAZBVVCFPC-FZKQIMNGSA-N 1 2 312.413 4.722 20 0 DJADLO CC(C)c1nc([C@H](C)[NH2+]Cc2cnccc2C(C)(C)C)cs1 ZINC000414239753 333918431 /nfs/dbraw/zinc/91/84/31/333918431.db2.gz YYBJFHAHZWGPHP-ZDUSSCGKSA-N 1 2 317.502 4.810 20 0 DJADLO CC[C@@H]([NH2+][C@@H](C)c1nc(C(C)C)no1)c1ccc(Cl)s1 ZINC000273466561 334047450 /nfs/dbraw/zinc/04/74/50/334047450.db2.gz DVLAAOLRNGHMBE-VHSXEESVSA-N 1 2 313.854 4.710 20 0 DJADLO CCn1ccnc1[C@@H](C)[NH2+][C@@H](C)c1cccc(Cl)c1Cl ZINC000453106517 334231581 /nfs/dbraw/zinc/23/15/81/334231581.db2.gz DWKZUUHUNISXEE-WDEREUQCSA-N 1 2 312.244 4.622 20 0 DJADLO C[C@H](c1nc2ccccc2s1)[N@H+](C)Cc1cccc(F)c1F ZINC000302806701 334295902 /nfs/dbraw/zinc/29/59/02/334295902.db2.gz BTVHLCOBKDFRNC-LLVKDONJSA-N 1 2 318.392 4.768 20 0 DJADLO C[C@H](c1nc2ccccc2s1)[N@@H+](C)Cc1cccc(F)c1F ZINC000302806701 334295904 /nfs/dbraw/zinc/29/59/04/334295904.db2.gz BTVHLCOBKDFRNC-LLVKDONJSA-N 1 2 318.392 4.768 20 0 DJADLO C[C@H]1CCC[C@H](C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000303938002 334346507 /nfs/dbraw/zinc/34/65/07/334346507.db2.gz WTZNPVMZZBGQPY-GJZGRUSLSA-N 1 2 310.397 4.639 20 0 DJADLO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@@H+]1Cc1nc(C2CC2)cs1 ZINC000343744976 335190224 /nfs/dbraw/zinc/19/02/24/335190224.db2.gz VWIBRRIUFARYHI-VXGBXAGGSA-N 1 2 316.445 4.667 20 0 DJADLO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@H+]1Cc1nc(C2CC2)cs1 ZINC000343744976 335190225 /nfs/dbraw/zinc/19/02/25/335190225.db2.gz VWIBRRIUFARYHI-VXGBXAGGSA-N 1 2 316.445 4.667 20 0 DJADLO Fc1ccc2oc(C[NH2+]Cc3cc(-c4ccccc4)on3)cc2c1 ZINC000343909217 335201583 /nfs/dbraw/zinc/20/15/83/335201583.db2.gz KFLUXKNEFNXZPF-UHFFFAOYSA-N 1 2 322.339 4.517 20 0 DJADLO CCc1c[nH+]ccc1[C@H](C)[C@@H](Cc1ccccn1)c1cccnc1 ZINC000345843079 335354828 /nfs/dbraw/zinc/35/48/28/335354828.db2.gz TVCKBXGSUMKRSF-HRAATJIYSA-N 1 2 317.436 4.564 20 0 DJADLO Cc1csc([C@H](C)[NH2+]Cc2csc(C3CCCCC3)n2)n1 ZINC000348108395 335554191 /nfs/dbraw/zinc/55/41/91/335554191.db2.gz JMTOXVYQEAGTDX-LBPRGKRZSA-N 1 2 321.515 4.807 20 0 DJADLO Fc1ccc([C@H](SCCn2cc[nH+]c2)c2ccccc2)cc1 ZINC000535580099 335655461 /nfs/dbraw/zinc/65/54/61/335655461.db2.gz OJYFVYUKGQRQAK-GOSISDBHSA-N 1 2 312.413 4.545 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1cc(F)c(F)c(F)c1 ZINC000532194772 335913803 /nfs/dbraw/zinc/91/38/03/335913803.db2.gz YVIPMFXLXHERPI-IUCAKERBSA-N 1 2 315.285 4.794 20 0 DJADLO CC(C)c1[nH+]c2ccccc2n1Cc1noc(/C=C\C(C)(C)C)n1 ZINC000445657700 338504912 /nfs/dbraw/zinc/50/49/12/338504912.db2.gz OLOWSKNDRSJLRZ-KHPPLWFESA-N 1 2 324.428 4.650 20 0 DJADLO O=C(CCc1ccsc1)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000351582429 336046913 /nfs/dbraw/zinc/04/69/13/336046913.db2.gz NUOBEJDUGPPHIJ-UHFFFAOYSA-N 1 2 324.405 4.507 20 0 DJADLO Cc1c[nH]c(-c2ccccc2NC(=O)CC2(C)CCCCC2)[nH+]1 ZINC000331718618 336145661 /nfs/dbraw/zinc/14/56/61/336145661.db2.gz HUYUGOUGMCWWIF-UHFFFAOYSA-N 1 2 311.429 4.684 20 0 DJADLO CC[C@H]1CC[C@H](C(=O)Nc2ccccc2-c2[nH]cc(C)[nH+]2)CC1 ZINC000332061264 336157041 /nfs/dbraw/zinc/15/70/41/336157041.db2.gz QSHUBUBDHFAKMV-SHTZXODSSA-N 1 2 311.429 4.540 20 0 DJADLO Cc1nc(C[N@H+]2CC=C(c3ccccc3Cl)CC2)c(C)s1 ZINC000351938583 336181300 /nfs/dbraw/zinc/18/13/00/336181300.db2.gz YEAOVUICGCCGIB-UHFFFAOYSA-N 1 2 318.873 4.703 20 0 DJADLO Cc1nc(C[N@@H+]2CC=C(c3ccccc3Cl)CC2)c(C)s1 ZINC000351938583 336181302 /nfs/dbraw/zinc/18/13/02/336181302.db2.gz YEAOVUICGCCGIB-UHFFFAOYSA-N 1 2 318.873 4.703 20 0 DJADLO Cc1cnc([C@@H](C)[NH2+][C@@H](C)c2ccc(Oc3cccnc3)cc2)o1 ZINC000352250480 336206840 /nfs/dbraw/zinc/20/68/40/336206840.db2.gz OADHVIRNXLORPK-LSDHHAIUSA-N 1 2 323.396 4.582 20 0 DJADLO Fc1cccc2c1CC[C@@H]2[NH2+][C@H](c1nccs1)c1ccccc1 ZINC000532463788 336249024 /nfs/dbraw/zinc/24/90/24/336249024.db2.gz DUIBFRZXXSMMTN-ROUUACIJSA-N 1 2 324.424 4.649 20 0 DJADLO Cc1ccc([C@H]([NH2+]Cc2nnc(C(C)C)s2)C2CCCC2)o1 ZINC000580364234 336260239 /nfs/dbraw/zinc/26/02/39/336260239.db2.gz GQJAUELFSZKMOE-MRXNPFEDSA-N 1 2 319.474 4.584 20 0 DJADLO CC(C)c1noc(C[N@H+]([C@H](C)c2ccc(Cl)cc2)C2CC2)n1 ZINC000532657924 336265042 /nfs/dbraw/zinc/26/50/42/336265042.db2.gz NMBUZPNTFUHGFE-GFCCVEGCSA-N 1 2 319.836 4.572 20 0 DJADLO CC(C)c1noc(C[N@@H+]([C@H](C)c2ccc(Cl)cc2)C2CC2)n1 ZINC000532657924 336265043 /nfs/dbraw/zinc/26/50/43/336265043.db2.gz NMBUZPNTFUHGFE-GFCCVEGCSA-N 1 2 319.836 4.572 20 0 DJADLO CC(C)(C)c1cnc(C[NH2+]C2(c3ccc(F)cc3)CCCC2)o1 ZINC000532698012 336266972 /nfs/dbraw/zinc/26/69/72/336266972.db2.gz GAQVWYQKMAMVCD-UHFFFAOYSA-N 1 2 316.420 4.670 20 0 DJADLO CCCOc1cccc(N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000324884424 336270871 /nfs/dbraw/zinc/27/08/71/336270871.db2.gz MVWGZGDSASUYSH-MRXNPFEDSA-N 1 2 321.424 4.834 20 0 DJADLO c1sc(-c2ccccc2)nc1CNc1ccc2ccccc2[nH+]1 ZINC000301073088 336288596 /nfs/dbraw/zinc/28/85/96/336288596.db2.gz GOZNLNWBEYJAIY-UHFFFAOYSA-N 1 2 317.417 4.970 20 0 DJADLO Cc1cc(NCc2nc(-c3ccccc3)cs2)nc(C(C)C)[nH+]1 ZINC000301129742 336291501 /nfs/dbraw/zinc/29/15/01/336291501.db2.gz ZKHBXWOIYXVCOE-UHFFFAOYSA-N 1 2 324.453 4.644 20 0 DJADLO Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)Nc1cccc[nH+]1 ZINC000301171778 336293300 /nfs/dbraw/zinc/29/33/00/336293300.db2.gz FHIDNRYXUTVCSJ-LLVKDONJSA-N 1 2 313.401 4.826 20 0 DJADLO c1ccc([C@@H](Nc2ccc3ccccc3[nH+]2)c2ccccn2)cc1 ZINC000301171966 336293302 /nfs/dbraw/zinc/29/33/02/336293302.db2.gz KRLJGYUXDRYFLR-OAQYLSRUSA-N 1 2 311.388 4.831 20 0 DJADLO Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)Nc1cccc[nH+]1 ZINC000301174193 336293338 /nfs/dbraw/zinc/29/33/38/336293338.db2.gz FMXLZGPRRLCSKN-CYBMUJFWSA-N 1 2 309.438 4.995 20 0 DJADLO c1ccc2c(c1)cccc2[C@H]1CCCN1c1cc[nH+]c(C2CC2)n1 ZINC000301233394 336295910 /nfs/dbraw/zinc/29/59/10/336295910.db2.gz KJOJPXICFHGBMZ-LJQANCHMSA-N 1 2 315.420 4.849 20 0 DJADLO Cc1ccc([C@H](C)Nc2nc(-c3ccncc3)[nH+]c(C)c2C)s1 ZINC000301302219 336299869 /nfs/dbraw/zinc/29/98/69/336299869.db2.gz YDHVWZTVITVLFI-AWEZNQCLSA-N 1 2 324.453 4.698 20 0 DJADLO c1csc([C@@H](Cc2ccccc2)Nc2cc[nH+]c(C3CC3)n2)c1 ZINC000301326121 336300635 /nfs/dbraw/zinc/30/06/35/336300635.db2.gz YTUPGBDVDOEZLW-MRXNPFEDSA-N 1 2 321.449 4.811 20 0 DJADLO c1oc(-c2ccccc2)nc1CNc1ccc2ccccc2[nH+]1 ZINC000301425187 336305870 /nfs/dbraw/zinc/30/58/70/336305870.db2.gz OUASCDGPMWNTKH-UHFFFAOYSA-N 1 2 301.349 4.502 20 0 DJADLO CC(C)(C)c1nc(N[C@H]2CCSc3ccc(F)cc32)cc[nH+]1 ZINC000301503932 336310986 /nfs/dbraw/zinc/31/09/86/336310986.db2.gz GDUWQOOVQDRTPO-ZDUSSCGKSA-N 1 2 317.433 4.562 20 0 DJADLO C[C@H](Nc1cc[nH+]c(C(C)(C)C)n1)c1ncc(-c2ccccc2)o1 ZINC000301566793 336315477 /nfs/dbraw/zinc/31/54/77/336315477.db2.gz JTPZHVDOISCQRW-ZDUSSCGKSA-N 1 2 322.412 4.602 20 0 DJADLO Cc1cc2ccccc2[nH+]c1NC[C@H]1CCO[C@@H]1c1ccccc1 ZINC000301719532 336325389 /nfs/dbraw/zinc/32/53/89/336325389.db2.gz MACHUWGJODJMCG-UYAOXDASSA-N 1 2 318.420 4.733 20 0 DJADLO Cc1cc2ccccc2[nH+]c1N[C@H](C)C[C@H](O)c1cccs1 ZINC000301788619 336329973 /nfs/dbraw/zinc/32/99/73/336329973.db2.gz MGWBYAVBNVUPHR-CJNGLKHVSA-N 1 2 312.438 4.529 20 0 DJADLO Cc1cccc([C@H]2CCCN2c2cc(C(C)C)[nH+]c(C(C)C)n2)n1 ZINC000301872724 336335341 /nfs/dbraw/zinc/33/53/41/336335341.db2.gz QFESXCHIIQGIHW-GOSISDBHSA-N 1 2 324.472 4.768 20 0 DJADLO C[C@H]1CCN(c2cc(C(F)(F)F)cc[nH+]2)[C@@H](c2ccco2)C1 ZINC000302040367 336344855 /nfs/dbraw/zinc/34/48/55/336344855.db2.gz NKWQDCOOCCDJCY-WCQYABFASA-N 1 2 310.319 4.671 20 0 DJADLO FC(F)c1ccc(CNc2cc(C(F)(F)F)cc[nH+]2)cc1 ZINC000302168094 336352064 /nfs/dbraw/zinc/35/20/64/336352064.db2.gz KLRQTLGGNHXHOJ-UHFFFAOYSA-N 1 2 302.246 4.650 20 0 DJADLO CC(C)c1nc(N2CCC[C@H]2c2ccncc2)cc(C(C)(C)C)[nH+]1 ZINC000302771994 336368496 /nfs/dbraw/zinc/36/84/96/336368496.db2.gz CLESAPIQBUOAJH-INIZCTEOSA-N 1 2 324.472 4.634 20 0 DJADLO Cc1csc([C@@H](C)Nc2cc(C(C)(C)C)[nH+]c(C(C)C)n2)n1 ZINC000302885276 336373254 /nfs/dbraw/zinc/37/32/54/336373254.db2.gz KPXBRJSBFOVRBS-GFCCVEGCSA-N 1 2 318.490 4.836 20 0 DJADLO CC(C)c1cc(CNc2cc(C(C)(C)C)[nH+]c(C(C)C)n2)on1 ZINC000302905547 336374055 /nfs/dbraw/zinc/37/40/55/336374055.db2.gz SMPOSLRAWNHYAJ-UHFFFAOYSA-N 1 2 316.449 4.621 20 0 DJADLO CCC[N@H+](Cc1cccc(C)n1)Cc1c(F)cccc1Cl ZINC000514633101 336386928 /nfs/dbraw/zinc/38/69/28/336386928.db2.gz SPRNBJBDCHEKEI-UHFFFAOYSA-N 1 2 306.812 4.595 20 0 DJADLO CCC[N@@H+](Cc1cccc(C)n1)Cc1c(F)cccc1Cl ZINC000514633101 336386929 /nfs/dbraw/zinc/38/69/29/336386929.db2.gz SPRNBJBDCHEKEI-UHFFFAOYSA-N 1 2 306.812 4.595 20 0 DJADLO Fc1ccc2c(c1)[C@H]([NH2+]Cc1c(F)cccc1Cl)CCCO2 ZINC000358646798 336638151 /nfs/dbraw/zinc/63/81/51/336638151.db2.gz DQQXAUMPPOLYAP-MRXNPFEDSA-N 1 2 323.770 4.622 20 0 DJADLO Cc1nc([C@@H](C)[NH2+][C@H]2CC3(CCC3)Oc3ccccc32)cs1 ZINC000360994204 336731430 /nfs/dbraw/zinc/73/14/30/336731430.db2.gz DIDIPGHHEBDHNB-DOMZBBRYSA-N 1 2 314.454 4.549 20 0 DJADLO COc1ccsc1[C@H](C)[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC000375085664 337002985 /nfs/dbraw/zinc/00/29/85/337002985.db2.gz ZYLCMRCHMDMIAI-KBXCAEBGSA-N 1 2 324.449 4.592 20 0 DJADLO C[C@@H](Nc1cccc(-c2cn3c([nH+]2)CCCC3)c1)c1nccs1 ZINC000376165177 337028780 /nfs/dbraw/zinc/02/87/80/337028780.db2.gz HROPVTIPECLGIY-CYBMUJFWSA-N 1 2 324.453 4.516 20 0 DJADLO COc1ccc([C@H](C)[NH2+][C@H](c2nccs2)c2ccccc2)cc1 ZINC000123300361 337044339 /nfs/dbraw/zinc/04/43/39/337044339.db2.gz UXAOFGZFOBOAGP-KSSFIOAISA-N 1 2 324.449 4.592 20 0 DJADLO C[C@H]([NH2+][C@@H](c1cc2ccccc2o1)c1ccccc1)c1ncc[nH]1 ZINC000377126773 337047321 /nfs/dbraw/zinc/04/73/21/337047321.db2.gz LGSVFOAKQPWONT-IFXJQAMLSA-N 1 2 317.392 4.596 20 0 DJADLO C[C@H](N[C@@H](c1cc2ccccc2o1)c1ccccc1)c1[nH]cc[nH+]1 ZINC000377126773 337047322 /nfs/dbraw/zinc/04/73/22/337047322.db2.gz LGSVFOAKQPWONT-IFXJQAMLSA-N 1 2 317.392 4.596 20 0 DJADLO C[C@@H]1C[C@@H]1c1ccc(C[NH2+][C@@H](c2ccccc2)c2cccnc2)o1 ZINC000171440402 337087297 /nfs/dbraw/zinc/08/72/97/337087297.db2.gz HWTXCOUIHPZQSW-JJXUHFIVSA-N 1 2 318.420 4.677 20 0 DJADLO CC[C@H]([NH2+][C@@H](C)c1ncc(-c2ccccc2)o1)c1nccs1 ZINC000174116264 337139356 /nfs/dbraw/zinc/13/93/56/337139356.db2.gz QFOKFYROYQVPTN-JSGCOSHPSA-N 1 2 313.426 4.600 20 0 DJADLO C[C@H]([NH2+][C@@H](c1nccs1)c1ccccc1)c1ccsc1 ZINC000178197796 337161319 /nfs/dbraw/zinc/16/13/19/337161319.db2.gz GKIWLJXYDMSMKW-SWLSCSKDSA-N 1 2 300.452 4.645 20 0 DJADLO CCc1ccccc1C[NH2+][C@@H](c1nccs1)c1ccccc1 ZINC000183284534 337192749 /nfs/dbraw/zinc/19/27/49/337192749.db2.gz ZKKIJHABCYDSPS-GOSISDBHSA-N 1 2 308.450 4.585 20 0 DJADLO Cc1csc([C@@H](C)[NH2+][C@H](C)c2ncc(-c3ccccc3)o2)n1 ZINC000184274561 337197720 /nfs/dbraw/zinc/19/77/20/337197720.db2.gz YLPQWABQVLDSKV-CHWSQXEVSA-N 1 2 313.426 4.518 20 0 DJADLO Cc1ccc(C[N@@H+](C)[C@@H](C)c2nc3ccccc3s2)c(C)n1 ZINC000187194057 337263607 /nfs/dbraw/zinc/26/36/07/337263607.db2.gz DQNSXPZWNFPGIQ-AWEZNQCLSA-N 1 2 311.454 4.501 20 0 DJADLO Cc1ccc(C[N@H+](C)[C@@H](C)c2nc3ccccc3s2)c(C)n1 ZINC000187194057 337263608 /nfs/dbraw/zinc/26/36/08/337263608.db2.gz DQNSXPZWNFPGIQ-AWEZNQCLSA-N 1 2 311.454 4.501 20 0 DJADLO C[C@H]([NH2+]Cc1cccc2c1OC(C)(C)C2)c1c(F)cccc1F ZINC000321494049 337271460 /nfs/dbraw/zinc/27/14/60/337271460.db2.gz SBFCEGXQTYDCMV-LBPRGKRZSA-N 1 2 317.379 4.529 20 0 DJADLO CC[C@@H](C)Sc1ccc(NCc2[nH]c(C)c(C)[nH+]2)c(C)c1 ZINC000583274152 337299923 /nfs/dbraw/zinc/29/99/23/337299923.db2.gz PBFMAZVJMZVFBJ-GFCCVEGCSA-N 1 2 303.475 4.838 20 0 DJADLO COc1cc(C)[nH+]c(CNc2ccccc2-c2ccccc2)c1 ZINC000321899782 337301916 /nfs/dbraw/zinc/30/19/16/337301916.db2.gz PZNURFIXLQBVRR-UHFFFAOYSA-N 1 2 304.393 4.678 20 0 DJADLO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1c(F)cccc1Cl ZINC000035015119 337392398 /nfs/dbraw/zinc/39/23/98/337392398.db2.gz WFWMANMZUTXONY-GFCCVEGCSA-N 1 2 307.796 4.647 20 0 DJADLO Cc1nc(C[NH2+][C@H](C)c2cccc(Cl)c2Cl)cs1 ZINC000117951346 337393768 /nfs/dbraw/zinc/39/37/68/337393768.db2.gz QLTFXJPBQBWPRN-MRVPVSSYSA-N 1 2 301.242 4.609 20 0 DJADLO COc1ccccc1[C@@H]([NH2+][C@H](C)c1ccccc1)c1ccco1 ZINC000130805014 337434380 /nfs/dbraw/zinc/43/43/80/337434380.db2.gz LNQLEKBHSBOVKS-FOIQADDNSA-N 1 2 307.393 4.728 20 0 DJADLO Clc1ccc([C@@H]([NH2+]Cc2cscn2)c2cccs2)cc1 ZINC000060526643 337459203 /nfs/dbraw/zinc/45/92/03/337459203.db2.gz PLHIAVKPYCNSPG-OAHLLOKOSA-N 1 2 320.870 4.737 20 0 DJADLO Clc1ccc(C[NH2+][C@@H](c2nccs2)c2ccccc2)cc1 ZINC000237699796 337469252 /nfs/dbraw/zinc/46/92/52/337469252.db2.gz YREQACPKRLRHEL-MRXNPFEDSA-N 1 2 314.841 4.676 20 0 DJADLO CC[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccccc1OC(F)F ZINC000423212929 337704524 /nfs/dbraw/zinc/70/45/24/337704524.db2.gz JGKHRYAIGODCLI-HNNXBMFYSA-N 1 2 318.367 4.819 20 0 DJADLO CC(C)Oc1ccc(Cl)cc1NCc1c[nH+]cn1C(C)C ZINC000424184202 337801060 /nfs/dbraw/zinc/80/10/60/337801060.db2.gz XFPQYSILARRYBC-UHFFFAOYSA-N 1 2 307.825 4.517 20 0 DJADLO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2nc(C)cs2)c(Cl)c1 ZINC000424261671 337813119 /nfs/dbraw/zinc/81/31/19/337813119.db2.gz CPLOITJEZXSJMK-MNOVXSKESA-N 1 2 310.850 4.525 20 0 DJADLO COc1ccc([C@H](C)[NH2+][C@@H](C)c2nc(C)cs2)c(Cl)c1 ZINC000424261673 337813134 /nfs/dbraw/zinc/81/31/34/337813134.db2.gz CPLOITJEZXSJMK-QWRGUYRKSA-N 1 2 310.850 4.525 20 0 DJADLO Cc1csc(C[NH2+][C@@H](C)c2cccc(Cl)c2Cl)n1 ZINC000117951329 337849639 /nfs/dbraw/zinc/84/96/39/337849639.db2.gz CUMVHUAARWIIBD-VIFPVBQESA-N 1 2 301.242 4.609 20 0 DJADLO COc1ccccc1[C@H]([NH2+][C@@H](C)c1cccs1)c1ccccn1 ZINC000090913492 337887110 /nfs/dbraw/zinc/88/71/10/337887110.db2.gz FGJNPBCUXXRPAU-LIRRHRJNSA-N 1 2 324.449 4.592 20 0 DJADLO COc1ccccc1[C@@H]([NH2+][C@H](C)c1ccsc1)c1ccccn1 ZINC000090913631 337887152 /nfs/dbraw/zinc/88/71/52/337887152.db2.gz ZGGWICYPOPPBLJ-AUUYWEPGSA-N 1 2 324.449 4.592 20 0 DJADLO C[C@H](c1ccco1)[N@H+](Cc1ncc(-c2ccccc2)o1)C1CC1 ZINC000086233373 338013648 /nfs/dbraw/zinc/01/36/48/338013648.db2.gz YTZCBEWFSJSEME-CQSZACIVSA-N 1 2 308.381 4.660 20 0 DJADLO C[C@H](c1ccco1)[N@@H+](Cc1ncc(-c2ccccc2)o1)C1CC1 ZINC000086233373 338013649 /nfs/dbraw/zinc/01/36/49/338013649.db2.gz YTZCBEWFSJSEME-CQSZACIVSA-N 1 2 308.381 4.660 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)[C@H](C)c1cccc(CC(C)C)c1 ZINC000425597672 338015915 /nfs/dbraw/zinc/01/59/15/338015915.db2.gz UGRDDPCZVHCWRL-OAHLLOKOSA-N 1 2 310.441 4.639 20 0 DJADLO Cc1ccc2cc([C@H](C)[NH2+]Cc3nnc(C(C)C)s3)oc2c1 ZINC000426020123 338019477 /nfs/dbraw/zinc/01/94/77/338019477.db2.gz HMDHPFKPXHVJQM-LBPRGKRZSA-N 1 2 315.442 4.567 20 0 DJADLO Cc1nc(C(C)C)oc1C[NH2+]C1(c2ccc(F)cc2F)CCC1 ZINC000428301813 338046387 /nfs/dbraw/zinc/04/63/87/338046387.db2.gz BQHCNEALRRYMLH-UHFFFAOYSA-N 1 2 320.383 4.554 20 0 DJADLO CC(C)([NH2+]Cc1csc(-c2ccoc2)n1)c1ccccc1F ZINC000429267113 338075257 /nfs/dbraw/zinc/07/52/57/338075257.db2.gz WLLVGXAGKCKVTG-UHFFFAOYSA-N 1 2 316.401 4.567 20 0 DJADLO CC[N@@H+](Cc1cc(C(C)(C)C)on1)Cc1ccc(Cl)s1 ZINC000429714934 338088203 /nfs/dbraw/zinc/08/82/03/338088203.db2.gz MCBIHUOGFHCTDS-UHFFFAOYSA-N 1 2 312.866 4.709 20 0 DJADLO CC[N@H+](Cc1cc(C(C)(C)C)on1)Cc1ccc(Cl)s1 ZINC000429714934 338088204 /nfs/dbraw/zinc/08/82/04/338088204.db2.gz MCBIHUOGFHCTDS-UHFFFAOYSA-N 1 2 312.866 4.709 20 0 DJADLO C[C@@]12CC[N@H+](Cc3csc(Cl)c3Cl)C[C@@H]1C2(F)F ZINC000430090828 338095826 /nfs/dbraw/zinc/09/58/26/338095826.db2.gz UEGCKGVSWPIHEU-GZMMTYOYSA-N 1 2 312.212 4.532 20 0 DJADLO C[C@@]12CC[N@@H+](Cc3csc(Cl)c3Cl)C[C@@H]1C2(F)F ZINC000430090828 338095827 /nfs/dbraw/zinc/09/58/27/338095827.db2.gz UEGCKGVSWPIHEU-GZMMTYOYSA-N 1 2 312.212 4.532 20 0 DJADLO Cc1cc2[nH]c(C[N@@H+]3CC(C)(C)[C@H]3c3cccnc3)cc2c(C)c1 ZINC000430104355 338096839 /nfs/dbraw/zinc/09/68/39/338096839.db2.gz NFSMOUCIXNJDFS-HXUWFJFHSA-N 1 2 319.452 4.763 20 0 DJADLO Cc1cc2[nH]c(C[N@H+]3CC(C)(C)[C@H]3c3cccnc3)cc2c(C)c1 ZINC000430104355 338096840 /nfs/dbraw/zinc/09/68/40/338096840.db2.gz NFSMOUCIXNJDFS-HXUWFJFHSA-N 1 2 319.452 4.763 20 0 DJADLO Cc1csc([C@H](C)[NH2+]Cc2ccc(F)c(Cl)c2Cl)n1 ZINC000432242465 338150088 /nfs/dbraw/zinc/15/00/88/338150088.db2.gz KTDQTROKFJRQIJ-QMMMGPOBSA-N 1 2 319.232 4.748 20 0 DJADLO CC(C)([NH2+]Cc1csc(Cl)c1Cl)c1nccs1 ZINC000432250015 338150865 /nfs/dbraw/zinc/15/08/65/338150865.db2.gz IKEGLOSOGCPAFS-UHFFFAOYSA-N 1 2 307.271 4.536 20 0 DJADLO Cc1cnc([C@@H](C)[NH2+]Cc2ccc(F)c(Cl)c2Cl)s1 ZINC000432250152 338150889 /nfs/dbraw/zinc/15/08/89/338150889.db2.gz IUZLBJBYKGDQNC-MRVPVSSYSA-N 1 2 319.232 4.748 20 0 DJADLO Clc1ccc(-c2ccc(NCc3cncs3)[nH+]c2)s1 ZINC000432731030 338164597 /nfs/dbraw/zinc/16/45/97/338164597.db2.gz NUIRIVFUQWRHNI-UHFFFAOYSA-N 1 2 307.831 4.532 20 0 DJADLO CC(C)c1nc(C[N@H+](C)Cc2ccc(F)c(Cl)c2)cs1 ZINC000432791489 338167888 /nfs/dbraw/zinc/16/78/88/338167888.db2.gz GQVURPYPIXZNOR-UHFFFAOYSA-N 1 2 312.841 4.691 20 0 DJADLO CC(C)c1nc(C[N@@H+](C)Cc2ccc(F)c(Cl)c2)cs1 ZINC000432791489 338167889 /nfs/dbraw/zinc/16/78/89/338167889.db2.gz GQVURPYPIXZNOR-UHFFFAOYSA-N 1 2 312.841 4.691 20 0 DJADLO C[C@H](c1ccncc1)[N@H+](C)Cc1ccc(F)c(Cl)c1Cl ZINC000432914689 338172699 /nfs/dbraw/zinc/17/26/99/338172699.db2.gz BATOPUPZSQIUEG-SNVBAGLBSA-N 1 2 313.203 4.721 20 0 DJADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1ccc(F)c(Cl)c1Cl ZINC000432914689 338172700 /nfs/dbraw/zinc/17/27/00/338172700.db2.gz BATOPUPZSQIUEG-SNVBAGLBSA-N 1 2 313.203 4.721 20 0 DJADLO C[C@H](c1ccncc1)[N@H+](C)Cc1csc(Cl)c1Cl ZINC000432916983 338172870 /nfs/dbraw/zinc/17/28/70/338172870.db2.gz KHGBLUFSQRDEHL-SECBINFHSA-N 1 2 301.242 4.643 20 0 DJADLO C[C@H](c1ccncc1)[N@@H+](C)Cc1csc(Cl)c1Cl ZINC000432916983 338172871 /nfs/dbraw/zinc/17/28/71/338172871.db2.gz KHGBLUFSQRDEHL-SECBINFHSA-N 1 2 301.242 4.643 20 0 DJADLO CC[C@H](C)Oc1cccc(NC(=O)Nc2ccc(C)[nH+]c2C)c1 ZINC000433018976 338176502 /nfs/dbraw/zinc/17/65/02/338176502.db2.gz HKCAYZCPWMTDJZ-ZDUSSCGKSA-N 1 2 313.401 4.520 20 0 DJADLO CC(C)c1cc(N2CC[C@@H](CC(F)(F)F)C2)nc(C(C)C)[nH+]1 ZINC000433798148 338202323 /nfs/dbraw/zinc/20/23/23/338202323.db2.gz DKDCJRNBJXFSPJ-LBPRGKRZSA-N 1 2 315.383 4.502 20 0 DJADLO CC[C@H]([NH2+][C@@H](C)c1nccs1)c1cc(Cl)ccc1OC ZINC000153328214 338222457 /nfs/dbraw/zinc/22/24/57/338222457.db2.gz KEDKSWHFYXSDTN-GWCFXTLKSA-N 1 2 310.850 4.607 20 0 DJADLO CCc1ccccc1C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000153483260 338225655 /nfs/dbraw/zinc/22/56/55/338225655.db2.gz KBDBIRADRZIJRV-UHFFFAOYSA-N 1 2 318.376 4.689 20 0 DJADLO c1c[nH]c([C@H]2CCC[N@H+]2Cc2csc(Nc3ccccc3)n2)c1 ZINC000153579583 338226621 /nfs/dbraw/zinc/22/66/21/338226621.db2.gz NLWLNNACUUPYQO-QGZVFWFLSA-N 1 2 324.453 4.552 20 0 DJADLO c1c[nH]c([C@H]2CCC[N@@H+]2Cc2csc(Nc3ccccc3)n2)c1 ZINC000153579583 338226622 /nfs/dbraw/zinc/22/66/22/338226622.db2.gz NLWLNNACUUPYQO-QGZVFWFLSA-N 1 2 324.453 4.552 20 0 DJADLO COc1cccc2c(N3CCC[C@H]3c3ccsc3)cc[nH+]c12 ZINC000436190129 338261257 /nfs/dbraw/zinc/26/12/57/338261257.db2.gz YXOWGEDAVFCJKD-HNNXBMFYSA-N 1 2 310.422 4.646 20 0 DJADLO Cc1cccn2cc(CSc3nc(-c4ccccc4)co3)[nH+]c12 ZINC000436247948 338263541 /nfs/dbraw/zinc/26/35/41/338263541.db2.gz QYXUCYWUTJULLA-UHFFFAOYSA-N 1 2 321.405 4.590 20 0 DJADLO Cc1[nH+]c2ccccn2c1CSc1nc(-c2ccccc2)co1 ZINC000436256399 338263826 /nfs/dbraw/zinc/26/38/26/338263826.db2.gz BDQFEDRNUDQGTB-UHFFFAOYSA-N 1 2 321.405 4.590 20 0 DJADLO Cc1cc(C)c(NC(=O)N[C@H](C)c2ccc(Cl)cc2)c(C)[nH+]1 ZINC000436485923 338273811 /nfs/dbraw/zinc/27/38/11/338273811.db2.gz AYXCWWRQIURDOD-GFCCVEGCSA-N 1 2 317.820 4.543 20 0 DJADLO CCC(CC)n1ccc(C[N@H+](C)Cc2cc3ccccc3o2)n1 ZINC000437576085 338314023 /nfs/dbraw/zinc/31/40/23/338314023.db2.gz FGLIFXJDRUHHID-UHFFFAOYSA-N 1 2 311.429 4.622 20 0 DJADLO CCC(CC)n1ccc(C[N@@H+](C)Cc2cc3ccccc3o2)n1 ZINC000437576085 338314024 /nfs/dbraw/zinc/31/40/24/338314024.db2.gz FGLIFXJDRUHHID-UHFFFAOYSA-N 1 2 311.429 4.622 20 0 DJADLO CCSCc1cc[nH+]c(N[C@@H]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000437802532 338322180 /nfs/dbraw/zinc/32/21/80/338322180.db2.gz REMAIBGPRFGJSW-QWHCGFSZSA-N 1 2 318.408 4.868 20 0 DJADLO CSc1cccc(NCc2c[nH+]cn2Cc2ccccc2)c1C ZINC000438310262 338339178 /nfs/dbraw/zinc/33/91/78/338339178.db2.gz ARTRLIDUXBFZEA-UHFFFAOYSA-N 1 2 323.465 4.574 20 0 DJADLO CC[C@H](F)C[N@@H+]1CCC[C@H]1c1nc(-c2ccc(Cl)cc2)c[nH]1 ZINC000440795298 338397788 /nfs/dbraw/zinc/39/77/88/338397788.db2.gz ICTBYFHEPCFXFT-HOCLYGCPSA-N 1 2 321.827 4.615 20 0 DJADLO CC[C@H](F)C[N@H+]1CCC[C@H]1c1nc(-c2ccc(Cl)cc2)c[nH]1 ZINC000440795298 338397789 /nfs/dbraw/zinc/39/77/89/338397789.db2.gz ICTBYFHEPCFXFT-HOCLYGCPSA-N 1 2 321.827 4.615 20 0 DJADLO CCCCc1nc(C[N@H+]([C@@H](C)c2ccco2)C2CC2)cs1 ZINC000440888270 338399366 /nfs/dbraw/zinc/39/93/66/338399366.db2.gz FPLROWZZRUXHMN-ZDUSSCGKSA-N 1 2 304.459 4.804 20 0 DJADLO CCCCc1nc(C[N@@H+]([C@@H](C)c2ccco2)C2CC2)cs1 ZINC000440888270 338399367 /nfs/dbraw/zinc/39/93/67/338399367.db2.gz FPLROWZZRUXHMN-ZDUSSCGKSA-N 1 2 304.459 4.804 20 0 DJADLO C[C@@H](CCC(=O)Nc1cccc(-c2[nH]cc[nH+]2)c1)c1ccccc1 ZINC000442142670 338421850 /nfs/dbraw/zinc/42/18/50/338421850.db2.gz VUORVOBZXBOEMJ-HNNXBMFYSA-N 1 2 319.408 4.599 20 0 DJADLO C[C@@H]([NH2+]Cc1nc2ccc(F)cc2o1)c1cc2ccccc2o1 ZINC000442889873 338438472 /nfs/dbraw/zinc/43/84/72/338438472.db2.gz ITYXPERBKWPZOX-LLVKDONJSA-N 1 2 310.328 4.564 20 0 DJADLO Cc1ccc(NC(=O)[C@H]2C[C@H]2c2cccc3ccccc32)c(C)[nH+]1 ZINC000446419806 338527601 /nfs/dbraw/zinc/52/76/01/338527601.db2.gz XXHNSLKLBKVIRC-OALUTQOASA-N 1 2 316.404 4.594 20 0 DJADLO Cc1nc(C(C)(C)[NH2+]Cc2ncc(C(C)(C)C)s2)sc1C ZINC000447938106 338572074 /nfs/dbraw/zinc/57/20/74/338572074.db2.gz DKFWNFSKECLSJE-UHFFFAOYSA-N 1 2 323.531 4.539 20 0 DJADLO CC[C@](C)([NH2+]Cc1cc(Cl)sc1Cl)c1nccs1 ZINC000449153314 338597257 /nfs/dbraw/zinc/59/72/57/338597257.db2.gz CWLSPDPQESVZLU-LBPRGKRZSA-N 1 2 321.298 4.926 20 0 DJADLO COCC[C@@H]([NH2+]Cc1cc(Cl)sc1Cl)c1ccco1 ZINC000449230142 338604757 /nfs/dbraw/zinc/60/47/57/338604757.db2.gz HVMOKHZYYJYMIR-SNVBAGLBSA-N 1 2 320.241 4.515 20 0 DJADLO Cc1nc([C@@H]([NH2+][C@@H](C)CC(C)(C)C)c2ccc(Cl)cc2)no1 ZINC000449255035 338607359 /nfs/dbraw/zinc/60/73/59/338607359.db2.gz ZMICBJDDPBEJEM-NHYWBVRUSA-N 1 2 321.852 4.535 20 0 DJADLO CC(C)(C)c1nc(C[NH2+]Cc2cc(C3CC3)ccc2F)cs1 ZINC000449373507 338618929 /nfs/dbraw/zinc/61/89/29/338618929.db2.gz RKUYOXDTLAAQMZ-UHFFFAOYSA-N 1 2 318.461 4.747 20 0 DJADLO CCC[C@@H]1CCC[C@H]1C(=O)Nc1ccccc1-c1[nH]cc(C)[nH+]1 ZINC000450209838 338671256 /nfs/dbraw/zinc/67/12/56/338671256.db2.gz YKZXXMKLMYGILR-HUUCEWRRSA-N 1 2 311.429 4.540 20 0 DJADLO Fc1ccc([C@@H]([NH2+]Cc2ncc(C3CC3)o2)C2CC2)cc1Cl ZINC000451355218 338731004 /nfs/dbraw/zinc/73/10/04/338731004.db2.gz PFEXJOACHBZUAV-KRWDZBQOSA-N 1 2 320.795 4.585 20 0 DJADLO CC[C@H]([NH2+][C@H](c1ccco1)c1ccccc1OC)c1ccncc1 ZINC000453154813 338800446 /nfs/dbraw/zinc/80/04/46/338800446.db2.gz ARDZNVKQMLPFAO-PXNSSMCTSA-N 1 2 322.408 4.514 20 0 DJADLO CC[C@H]([NH2+][C@@H](c1ccco1)c1ccccc1OC)c1ccncc1 ZINC000453154810 338800448 /nfs/dbraw/zinc/80/04/48/338800448.db2.gz ARDZNVKQMLPFAO-FXAWDEMLSA-N 1 2 322.408 4.514 20 0 DJADLO C[C@@H]([NH2+][C@H]1C[C@@H](C)n2ccnc21)c1cc(Cl)ccc1Cl ZINC000453194713 338805830 /nfs/dbraw/zinc/80/58/30/338805830.db2.gz BPMQTKGWUCJHID-RULNRJAQSA-N 1 2 310.228 4.547 20 0 DJADLO C[C@H]([NH2+]Cc1cnc(C2CC2)o1)c1cc(Cl)ccc1Cl ZINC000453338690 338827405 /nfs/dbraw/zinc/82/74/05/338827405.db2.gz CHXKYYDUBVOSNA-VIFPVBQESA-N 1 2 311.212 4.710 20 0 DJADLO Cc1nnc([C@@H](C)[N@@H+]2CC3(CCCC3)[C@H]2c2ccccc2)s1 ZINC000459575939 339036926 /nfs/dbraw/zinc/03/69/26/339036926.db2.gz LDDZNUXAWPOQFE-CZUORRHYSA-N 1 2 313.470 4.525 20 0 DJADLO Cc1nnc([C@@H](C)[N@H+]2CC3(CCCC3)[C@H]2c2ccccc2)s1 ZINC000459575939 339036927 /nfs/dbraw/zinc/03/69/27/339036927.db2.gz LDDZNUXAWPOQFE-CZUORRHYSA-N 1 2 313.470 4.525 20 0 DJADLO C[C@@H](c1nc(C2CC2)no1)[N@@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC000459578136 339037036 /nfs/dbraw/zinc/03/70/36/339037036.db2.gz XHCNZGJAIHFZSA-YOEHRIQHSA-N 1 2 323.440 4.625 20 0 DJADLO C[C@@H](c1nc(C2CC2)no1)[N@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC000459578136 339037037 /nfs/dbraw/zinc/03/70/37/339037037.db2.gz XHCNZGJAIHFZSA-YOEHRIQHSA-N 1 2 323.440 4.625 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1cccc(Cl)c1F)c1nc2c(s1)CCC2 ZINC000459631901 339039368 /nfs/dbraw/zinc/03/93/68/339039368.db2.gz LXXLTSGHUSSJBP-VHSXEESVSA-N 1 2 324.852 4.836 20 0 DJADLO CCc1c2ccccc2oc1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000459926749 339050809 /nfs/dbraw/zinc/05/08/09/339050809.db2.gz HBQIGHWMFJDDIQ-UHFFFAOYSA-N 1 2 308.381 4.568 20 0 DJADLO Cc1cc(OCc2cncc(C(F)(F)F)c2)c2ccccc2[nH+]1 ZINC000461077178 339058697 /nfs/dbraw/zinc/05/86/97/339058697.db2.gz SNPWAJBNWLSHSD-UHFFFAOYSA-N 1 2 318.298 4.536 20 0 DJADLO c1cn(Cc2ccccc2)c(CNc2cccc(C3CCC3)c2)[nH+]1 ZINC000461747112 339066447 /nfs/dbraw/zinc/06/64/47/339066447.db2.gz QDKNFJCZUQPTNV-UHFFFAOYSA-N 1 2 317.436 4.811 20 0 DJADLO Cc1ccc(NC(=O)N2CC[C@@H](C)C3(CCCCC3)C2)c(C)[nH+]1 ZINC000462282896 339075241 /nfs/dbraw/zinc/07/52/41/339075241.db2.gz XZCJVVAPMTYHOI-CQSZACIVSA-N 1 2 315.461 4.523 20 0 DJADLO Cc1nc(N[C@H](c2ccsc2)c2ccc(Cl)cc2)cc[nH+]1 ZINC000462374067 339077257 /nfs/dbraw/zinc/07/72/57/339077257.db2.gz UHEBBGNQFWLFNI-INIZCTEOSA-N 1 2 315.829 4.701 20 0 DJADLO Cc1nc([C@H](C)[NH2+][C@H](c2ccc(F)cc2F)C(C)C)cs1 ZINC000462806434 339090351 /nfs/dbraw/zinc/09/03/51/339090351.db2.gz PJUOZGCRQYZBEE-QFYYESIMSA-N 1 2 310.413 4.778 20 0 DJADLO Cc1ccsc1[C@@H](Cc1ccccc1)Nc1cc[nH+]c(C)n1 ZINC000462853862 339094476 /nfs/dbraw/zinc/09/44/76/339094476.db2.gz QRXWIPLSUAUILN-MRXNPFEDSA-N 1 2 309.438 4.551 20 0 DJADLO C[C@H](c1ccccc1)[N@H+](Cc1nccs1)Cc1ccccc1 ZINC000462904688 339097263 /nfs/dbraw/zinc/09/72/63/339097263.db2.gz AGHBBTBFGFZUNA-MRXNPFEDSA-N 1 2 308.450 4.907 20 0 DJADLO C[C@H](c1ccccc1)[N@@H+](Cc1nccs1)Cc1ccccc1 ZINC000462904688 339097264 /nfs/dbraw/zinc/09/72/64/339097264.db2.gz AGHBBTBFGFZUNA-MRXNPFEDSA-N 1 2 308.450 4.907 20 0 DJADLO Cc1ccc(-c2cnc(CSc3[nH+]cc4ccccn43)o2)cc1 ZINC000463040682 339102656 /nfs/dbraw/zinc/10/26/56/339102656.db2.gz AHLXYCOELRXUJC-UHFFFAOYSA-N 1 2 321.405 4.590 20 0 DJADLO CCc1ccc([C@@H]2C[C@H](C)CCN2c2cc[nH+]c(C(C)C)n2)o1 ZINC000463068357 339103832 /nfs/dbraw/zinc/10/38/32/339103832.db2.gz KNZALFQUVQITBL-ZBFHGGJFSA-N 1 2 313.445 4.733 20 0 DJADLO COc1ccccc1[C@@H](C)SCc1c(C)[nH+]c2ccccn21 ZINC000463206522 339109329 /nfs/dbraw/zinc/10/93/29/339109329.db2.gz PRAVMINPUFYRQT-CQSZACIVSA-N 1 2 312.438 4.646 20 0 DJADLO CCCc1nc(C[N@@H+]2C[C@H](C)C[C@H]2c2ccccc2F)cs1 ZINC000464725094 339150110 /nfs/dbraw/zinc/15/01/10/339150110.db2.gz LVTYMBCUKQOMDT-DYVFJYSZSA-N 1 2 318.461 4.818 20 0 DJADLO CCCc1nc(C[N@H+]2C[C@H](C)C[C@H]2c2ccccc2F)cs1 ZINC000464725094 339150111 /nfs/dbraw/zinc/15/01/11/339150111.db2.gz LVTYMBCUKQOMDT-DYVFJYSZSA-N 1 2 318.461 4.818 20 0 DJADLO Cc1cccc([C@@H]2CCCC[N@H+]2Cc2noc(C(C)C)n2)c1C ZINC000464777106 339152776 /nfs/dbraw/zinc/15/27/76/339152776.db2.gz MDRFWBMANSYIPX-KRWDZBQOSA-N 1 2 313.445 4.537 20 0 DJADLO Cc1cccc([C@@H]2CCCC[N@@H+]2Cc2noc(C(C)C)n2)c1C ZINC000464777106 339152777 /nfs/dbraw/zinc/15/27/77/339152777.db2.gz MDRFWBMANSYIPX-KRWDZBQOSA-N 1 2 313.445 4.537 20 0 DJADLO C[C@@H](c1ccccc1Cl)[N@H+](C)Cc1nc2cc(F)ccc2o1 ZINC000464868287 339159332 /nfs/dbraw/zinc/15/93/32/339159332.db2.gz KXONQGUNXDBYQM-NSHDSACASA-N 1 2 318.779 4.813 20 0 DJADLO C[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1nc2cc(F)ccc2o1 ZINC000464868287 339159333 /nfs/dbraw/zinc/15/93/33/339159333.db2.gz KXONQGUNXDBYQM-NSHDSACASA-N 1 2 318.779 4.813 20 0 DJADLO COCc1ccc(CNc2[nH+]cccc2-c2ccccc2)cc1 ZINC000466615314 339210603 /nfs/dbraw/zinc/21/06/03/339210603.db2.gz FEXYWVJAYDXEBZ-UHFFFAOYSA-N 1 2 304.393 4.507 20 0 DJADLO Cc1ccc([C@H]2CCCC[N@@H+]2Cc2nc3ccc(F)cc3o2)o1 ZINC000466956937 339222579 /nfs/dbraw/zinc/22/25/79/339222579.db2.gz CQUKAZGWCWCGFZ-OAHLLOKOSA-N 1 2 314.360 4.596 20 0 DJADLO Cc1ccc([C@H]2CCCC[N@H+]2Cc2nc3ccc(F)cc3o2)o1 ZINC000466956937 339222580 /nfs/dbraw/zinc/22/25/80/339222580.db2.gz CQUKAZGWCWCGFZ-OAHLLOKOSA-N 1 2 314.360 4.596 20 0 DJADLO Fc1ccc(CSCc2[nH+]ccn2Cc2ccccc2)cc1 ZINC000467225512 339228726 /nfs/dbraw/zinc/22/87/26/339228726.db2.gz QQZARECCNNQROQ-UHFFFAOYSA-N 1 2 312.413 4.504 20 0 DJADLO Cc1nc2cc(N[C@@H]3CCC[C@H](c4[nH+]cccc4C)C3)ccc2o1 ZINC000467369478 339234689 /nfs/dbraw/zinc/23/46/89/339234689.db2.gz YWMYFPWIXXDSNX-JKSUJKDBSA-N 1 2 321.424 4.978 20 0 DJADLO Fc1ccc(N[C@@H](c2[nH]cc[nH+]2)c2ccccc2)cc1C1CC1 ZINC000467439509 339238784 /nfs/dbraw/zinc/23/87/84/339238784.db2.gz VSEOWXBRLQTDIH-GOSISDBHSA-N 1 2 307.372 4.628 20 0 DJADLO C[C@@H]1C[C@@H](c2ccccc2)CC[N@@H+]1Cc1ncc(Cl)s1 ZINC000467549822 339241853 /nfs/dbraw/zinc/24/18/53/339241853.db2.gz CWPQKXWIYVXJKM-OCCSQVGLSA-N 1 2 306.862 4.565 20 0 DJADLO C[C@@H]1C[C@@H](c2ccccc2)CC[N@H+]1Cc1ncc(Cl)s1 ZINC000467549822 339241854 /nfs/dbraw/zinc/24/18/54/339241854.db2.gz CWPQKXWIYVXJKM-OCCSQVGLSA-N 1 2 306.862 4.565 20 0 DJADLO C[C@@H](c1ccc(Cl)cc1Cl)[N@H+](C)Cc1ccc(F)cn1 ZINC000468920525 339274798 /nfs/dbraw/zinc/27/47/98/339274798.db2.gz JCBXMQMXSNYICM-JTQLQIEISA-N 1 2 313.203 4.721 20 0 DJADLO C[C@@H](c1ccc(Cl)cc1Cl)[N@@H+](C)Cc1ccc(F)cn1 ZINC000468920525 339274799 /nfs/dbraw/zinc/27/47/99/339274799.db2.gz JCBXMQMXSNYICM-JTQLQIEISA-N 1 2 313.203 4.721 20 0 DJADLO C[C@@H]1CC[C@@H](CC(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)C1 ZINC000468924476 339274893 /nfs/dbraw/zinc/27/48/93/339274893.db2.gz KUBRCPFGRJAEDQ-HUUCEWRRSA-N 1 2 310.397 4.639 20 0 DJADLO Cc1cnc(C[N@@H+]2CCCC[C@H]2c2cccc(C(F)(F)F)c2)o1 ZINC000469533387 339292799 /nfs/dbraw/zinc/29/27/99/339292799.db2.gz OAOXQEGYSFUGDD-HNNXBMFYSA-N 1 2 324.346 4.729 20 0 DJADLO Cc1cnc(C[N@H+]2CCCC[C@H]2c2cccc(C(F)(F)F)c2)o1 ZINC000469533387 339292800 /nfs/dbraw/zinc/29/28/00/339292800.db2.gz OAOXQEGYSFUGDD-HNNXBMFYSA-N 1 2 324.346 4.729 20 0 DJADLO C[C@H](CCC1CC1)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000469767369 339298404 /nfs/dbraw/zinc/29/84/04/339298404.db2.gz FNTRCLUKSPISCK-OAHLLOKOSA-N 1 2 307.441 4.592 20 0 DJADLO Cc1ccc2c(c1C)OC[C@H]2[NH2+][C@@H](C)c1csc(C(C)C)n1 ZINC000469789387 339300244 /nfs/dbraw/zinc/30/02/44/339300244.db2.gz YIWNKTOQVFJLAE-DZGCQCFKSA-N 1 2 316.470 4.668 20 0 DJADLO C[C@@H](c1ccc(F)cc1F)[N@@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000470194443 339313760 /nfs/dbraw/zinc/31/37/60/339313760.db2.gz KJVIYEHTJNOORR-PEBVRCNWSA-N 1 2 323.408 4.549 20 0 DJADLO C[C@@H](c1ccc(F)cc1F)[N@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000470194443 339313761 /nfs/dbraw/zinc/31/37/61/339313761.db2.gz KJVIYEHTJNOORR-PEBVRCNWSA-N 1 2 323.408 4.549 20 0 DJADLO C[C@H](c1cc(F)ccc1F)[N@@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000470209929 339314286 /nfs/dbraw/zinc/31/42/86/339314286.db2.gz PHEQEWPQESRILN-PSTGCABASA-N 1 2 323.408 4.549 20 0 DJADLO C[C@H](c1cc(F)ccc1F)[N@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000470209929 339314287 /nfs/dbraw/zinc/31/42/87/339314287.db2.gz PHEQEWPQESRILN-PSTGCABASA-N 1 2 323.408 4.549 20 0 DJADLO C[C@H]1C[N@H+](Cc2cccc(C(F)F)c2)[C@H](c2ccccc2)CO1 ZINC000470762034 339327149 /nfs/dbraw/zinc/32/71/49/339327149.db2.gz OCYIDHRSXPSQJC-KSSFIOAISA-N 1 2 317.379 4.586 20 0 DJADLO C[C@H]1C[N@@H+](Cc2cccc(C(F)F)c2)[C@H](c2ccccc2)CO1 ZINC000470762034 339327150 /nfs/dbraw/zinc/32/71/50/339327150.db2.gz OCYIDHRSXPSQJC-KSSFIOAISA-N 1 2 317.379 4.586 20 0 DJADLO Fc1ccccc1-c1nc(C[N@@H+]2CC[C@H]2c2ccccc2)cs1 ZINC000471167540 339339314 /nfs/dbraw/zinc/33/93/14/339339314.db2.gz CSKTZILVWLZUPT-SFHVURJKSA-N 1 2 324.424 4.896 20 0 DJADLO Fc1ccccc1-c1nc(C[N@H+]2CC[C@H]2c2ccccc2)cs1 ZINC000471167540 339339315 /nfs/dbraw/zinc/33/93/15/339339315.db2.gz CSKTZILVWLZUPT-SFHVURJKSA-N 1 2 324.424 4.896 20 0 DJADLO CC(C)CCOc1ccccc1C[NH2+]Cc1ncc(Cl)s1 ZINC000472034487 339359764 /nfs/dbraw/zinc/35/97/64/339359764.db2.gz DZCGFYYBQNSGIV-UHFFFAOYSA-N 1 2 324.877 4.511 20 0 DJADLO CCc1cnc(C[NH2+]C(C)(C)c2cccc(Cl)c2F)s1 ZINC000472139000 339364013 /nfs/dbraw/zinc/36/40/13/339364013.db2.gz VEOHXXIUKHIQDN-UHFFFAOYSA-N 1 2 312.841 4.523 20 0 DJADLO C[C@H](c1ccccc1Cl)[N@@H+]1CCO[C@H](c2cccs2)C1 ZINC000472806723 339377855 /nfs/dbraw/zinc/37/78/55/339377855.db2.gz CDVILCLZHSWBKM-DOMZBBRYSA-N 1 2 307.846 4.536 20 0 DJADLO C[C@H](c1ccccc1Cl)[N@H+]1CCO[C@H](c2cccs2)C1 ZINC000472806723 339377856 /nfs/dbraw/zinc/37/78/56/339377856.db2.gz CDVILCLZHSWBKM-DOMZBBRYSA-N 1 2 307.846 4.536 20 0 DJADLO Fc1cccc(C[N@H+](Cc2ncc(Cl)s2)C2CCCC2)c1 ZINC000473140770 339381528 /nfs/dbraw/zinc/38/15/28/339381528.db2.gz RYBUBTRNOKKQDH-UHFFFAOYSA-N 1 2 324.852 4.880 20 0 DJADLO Fc1cccc(C[N@@H+](Cc2ncc(Cl)s2)C2CCCC2)c1 ZINC000473140770 339381529 /nfs/dbraw/zinc/38/15/29/339381529.db2.gz RYBUBTRNOKKQDH-UHFFFAOYSA-N 1 2 324.852 4.880 20 0 DJADLO CCC[N@H+](Cc1ncc(Cl)s1)[C@H](C)c1ccccc1OC ZINC000473140932 339382262 /nfs/dbraw/zinc/38/22/62/339382262.db2.gz DMOUOYDCQRWYCN-GFCCVEGCSA-N 1 2 324.877 4.778 20 0 DJADLO CCC[N@@H+](Cc1ncc(Cl)s1)[C@H](C)c1ccccc1OC ZINC000473140932 339382263 /nfs/dbraw/zinc/38/22/63/339382263.db2.gz DMOUOYDCQRWYCN-GFCCVEGCSA-N 1 2 324.877 4.778 20 0 DJADLO Cc1ccc(CNc2cc(Br)c(F)cc2C)c(C)[nH+]1 ZINC000473675838 339390187 /nfs/dbraw/zinc/39/01/87/339390187.db2.gz JPMKVYNGCZJDPX-UHFFFAOYSA-N 1 2 323.209 4.521 20 0 DJADLO CCc1[nH+]c(C)ccc1OCc1nc(-c2ccsc2)oc1C ZINC000473680413 339390289 /nfs/dbraw/zinc/39/02/89/339390289.db2.gz XEHYQFVMGQAHJI-UHFFFAOYSA-N 1 2 314.410 4.556 20 0 DJADLO COc1c2ccccc2oc1C[NH2+]Cc1c(F)cccc1Cl ZINC000474021206 339397338 /nfs/dbraw/zinc/39/73/38/339397338.db2.gz ZLBXAKKRXDDKMW-UHFFFAOYSA-N 1 2 319.763 4.524 20 0 DJADLO Cc1nc(-c2cccc(NCCCc3ccc(C)[nH+]c3)c2)oc1C ZINC000474387425 339411970 /nfs/dbraw/zinc/41/19/70/339411970.db2.gz HKNDAQRQRWCCOV-UHFFFAOYSA-N 1 2 321.424 4.707 20 0 DJADLO CC1(C)CCC[C@@H]1C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000475423314 339451106 /nfs/dbraw/zinc/45/11/06/339451106.db2.gz SMTZCZXICLBJAL-QGZVFWFLSA-N 1 2 310.397 4.639 20 0 DJADLO CC(C)[C@H]([NH2+][C@H](C)c1noc(-c2ccccc2)n1)c1ccccc1 ZINC000477665096 339498914 /nfs/dbraw/zinc/49/89/14/339498914.db2.gz PUXWGZSWVRORRO-QAPCUYQASA-N 1 2 321.424 4.785 20 0 DJADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)C[C@@H]1CCC[C@H](C)C1 ZINC000477983457 339506766 /nfs/dbraw/zinc/50/67/66/339506766.db2.gz JZRNYSVCWRSRAM-DZGCQCFKSA-N 1 2 311.429 4.540 20 0 DJADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@@H]1CCCC(C)(C)C1 ZINC000477989162 339506848 /nfs/dbraw/zinc/50/68/48/339506848.db2.gz LLTSORWSIUHVQQ-OAHLLOKOSA-N 1 2 311.429 4.540 20 0 DJADLO CCCCn1cc[nH+]c1-c1cccc(NC(=O)[C@@H]2CC=CCC2)c1 ZINC000478619754 339519538 /nfs/dbraw/zinc/51/95/38/339519538.db2.gz HUNVQVSKPCVZBG-MRXNPFEDSA-N 1 2 323.440 4.645 20 0 DJADLO CCCCn1cc[nH+]c1-c1cccc(NC(=O)c2ccc(C)o2)c1 ZINC000478624886 339519623 /nfs/dbraw/zinc/51/96/23/339519623.db2.gz VVVRNSZUFLGXHB-UHFFFAOYSA-N 1 2 323.396 4.504 20 0 DJADLO Cc1ccc(CSc2ncc(C(C)C)n2C(C)C)c(C)[nH+]1 ZINC000478842573 339523178 /nfs/dbraw/zinc/52/31/78/339523178.db2.gz FRDHQLARODLCGQ-UHFFFAOYSA-N 1 2 303.475 4.892 20 0 DJADLO Cc1cc2[nH]c(CNc3ccc(-n4cc[nH+]c4)cc3)cc2c(C)c1 ZINC000479550095 339540738 /nfs/dbraw/zinc/54/07/38/339540738.db2.gz YYNJLYKIGULNCV-UHFFFAOYSA-N 1 2 316.408 4.583 20 0 DJADLO CC(C)c1cc(N2CC[C@H](C(F)(F)F)[C@@H]2C)nc(C(C)C)[nH+]1 ZINC000480558413 339577389 /nfs/dbraw/zinc/57/73/89/339577389.db2.gz UFKMWKQDGKQGBY-RYUDHWBXSA-N 1 2 315.383 4.501 20 0 DJADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)C1CCCCCC1 ZINC000482751437 339641589 /nfs/dbraw/zinc/64/15/89/339641589.db2.gz PCTFKGVBWWYGQX-UHFFFAOYSA-N 1 2 310.397 4.783 20 0 DJADLO CCc1ccc(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)cc1 ZINC000482775196 339642309 /nfs/dbraw/zinc/64/23/09/339642309.db2.gz ISUHGHVSMGZAEX-UHFFFAOYSA-N 1 2 318.376 4.689 20 0 DJADLO CCCC[C@@H](C)N(C)C(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000485175442 339699680 /nfs/dbraw/zinc/69/96/80/339699680.db2.gz VVQACWZKUMJVDX-OAHLLOKOSA-N 1 2 312.413 4.525 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H]1c2ccccc2CCC[C@H]1C ZINC000485427242 339703121 /nfs/dbraw/zinc/70/31/21/339703121.db2.gz BUBFUMRAMAFXIV-BFUOFWGJSA-N 1 2 323.440 4.534 20 0 DJADLO CCCN(CC1CCCCC1)C(=O)Nc1c(C)cc[nH+]c1C ZINC000485449625 339703479 /nfs/dbraw/zinc/70/34/79/339703479.db2.gz DDTWDTQMBMKWRU-UHFFFAOYSA-N 1 2 303.450 4.523 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N(CCC(C)C)CCC(C)C ZINC000485456040 339703620 /nfs/dbraw/zinc/70/36/20/339703620.db2.gz FPUPILWMYWVEBM-UHFFFAOYSA-N 1 2 305.466 4.625 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1CCCC[C@H]1c1ccccc1 ZINC000485483460 339704178 /nfs/dbraw/zinc/70/41/78/339704178.db2.gz VJURPIXPVFPVPN-ZWKOTPCHSA-N 1 2 323.440 4.546 20 0 DJADLO Cc1ccc(NC(=O)N[C@H]2CCC[C@H](c3ccccc3)C2)c(C)[nH+]1 ZINC000486912117 339737889 /nfs/dbraw/zinc/73/78/89/339737889.db2.gz IXYFTVSQSPGMFZ-ROUUACIJSA-N 1 2 323.440 4.546 20 0 DJADLO CC[C@H]([NH2+][C@@H](COCC(C)C)c1ccco1)c1ccccc1F ZINC000490190552 339828255 /nfs/dbraw/zinc/82/82/55/339828255.db2.gz JUHMEFKGOKDCHC-ROUUACIJSA-N 1 2 319.420 4.873 20 0 DJADLO Cc1ccc(NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)c(C)c1 ZINC000492583179 339904526 /nfs/dbraw/zinc/90/45/26/339904526.db2.gz ZMFPPBCZVFEFET-UHFFFAOYSA-N 1 2 318.376 4.743 20 0 DJADLO COc1cc(C)cc(N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)c1C ZINC000494452133 339949633 /nfs/dbraw/zinc/94/96/33/339949633.db2.gz MZWDMVZVQYDUAP-INIZCTEOSA-N 1 2 321.424 4.671 20 0 DJADLO c1ccc2nc(Nc3cccc(Oc4cc[nH+]cc4)c3)cnc2c1 ZINC000495367665 339981740 /nfs/dbraw/zinc/98/17/40/339981740.db2.gz CKWGNYSBKZPUFO-UHFFFAOYSA-N 1 2 314.348 4.561 20 0 DJADLO CC(C)c1nc(N(C)[C@@H](C)c2ccc(C(F)(F)F)cc2)cc[nH+]1 ZINC000498960737 340027043 /nfs/dbraw/zinc/02/70/43/340027043.db2.gz SXNQXMTYVJYNKK-LBPRGKRZSA-N 1 2 323.362 4.816 20 0 DJADLO Cc1cnc([C@@H](C)[NH2+]Cc2ccc(-c3ccccc3)cc2F)o1 ZINC000500400701 340056977 /nfs/dbraw/zinc/05/69/77/340056977.db2.gz HCYUEAUZRWPLGC-CQSZACIVSA-N 1 2 310.372 4.640 20 0 DJADLO Cc1ccccc1C[N@H+]1CCCCC[C@H]1c1noc(C(C)C)n1 ZINC000501720060 340087197 /nfs/dbraw/zinc/08/71/97/340087197.db2.gz MISCIUPCKSCFSV-KRWDZBQOSA-N 1 2 313.445 4.619 20 0 DJADLO Cc1ccccc1C[N@@H+]1CCCCC[C@H]1c1noc(C(C)C)n1 ZINC000501720060 340087198 /nfs/dbraw/zinc/08/71/98/340087198.db2.gz MISCIUPCKSCFSV-KRWDZBQOSA-N 1 2 313.445 4.619 20 0 DJADLO CC[N@H+](Cc1csc(-c2ccc(C)cc2)n1)Cc1ccncc1 ZINC000502762835 340113086 /nfs/dbraw/zinc/11/30/86/340113086.db2.gz NDPKBXRJWMXQQV-UHFFFAOYSA-N 1 2 323.465 4.536 20 0 DJADLO CC[N@@H+](Cc1csc(-c2ccc(C)cc2)n1)Cc1ccncc1 ZINC000502762835 340113087 /nfs/dbraw/zinc/11/30/87/340113087.db2.gz NDPKBXRJWMXQQV-UHFFFAOYSA-N 1 2 323.465 4.536 20 0 DJADLO CC[C@H]1c2ccsc2CC[N@H+]1Cc1ncc(C(C)(C)C)o1 ZINC000503164520 340122309 /nfs/dbraw/zinc/12/23/09/340122309.db2.gz KWGPLRFPJFJHBE-ZDUSSCGKSA-N 1 2 304.459 4.543 20 0 DJADLO CC[C@H]1c2ccsc2CC[N@@H+]1Cc1ncc(C(C)(C)C)o1 ZINC000503164520 340122310 /nfs/dbraw/zinc/12/23/10/340122310.db2.gz KWGPLRFPJFJHBE-ZDUSSCGKSA-N 1 2 304.459 4.543 20 0 DJADLO C[C@H]1C[C@]1([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccc(Cl)cc1 ZINC000503413022 340127714 /nfs/dbraw/zinc/12/77/14/340127714.db2.gz QYYWXJQWBPUISS-KPZWWZAWSA-N 1 2 318.848 4.650 20 0 DJADLO CC[C@H]([NH2+]C1(C(F)F)CC1)c1ccc2cc(OC)ccc2c1 ZINC000503906090 340136334 /nfs/dbraw/zinc/13/63/34/340136334.db2.gz YOPHZJWKWRMUSK-INIZCTEOSA-N 1 2 305.368 4.687 20 0 DJADLO CC[C@@H]([NH2+]C1(C(F)F)CC1)c1ccc2cc(OC)ccc2c1 ZINC000503906091 340136385 /nfs/dbraw/zinc/13/63/85/340136385.db2.gz YOPHZJWKWRMUSK-MRXNPFEDSA-N 1 2 305.368 4.687 20 0 DJADLO Cc1ccc(/C=C\CC(=O)Nc2c[nH+]ccc2OC(C)(C)C)cc1 ZINC000504611512 340150187 /nfs/dbraw/zinc/15/01/87/340150187.db2.gz HBYGHHVTGWTKMA-WAYWQWQTSA-N 1 2 324.424 4.609 20 0 DJADLO CC(C)c1ccc(C(=O)Nc2c[nH+]ccc2OC(C)(C)C)cc1 ZINC000504700969 340151414 /nfs/dbraw/zinc/15/14/14/340151414.db2.gz PSVXLUPQRMXGOG-UHFFFAOYSA-N 1 2 312.413 4.635 20 0 DJADLO CCC(CC)C(=O)Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000504769688 340152314 /nfs/dbraw/zinc/15/23/14/340152314.db2.gz IGHIOBRLZOSSGZ-UHFFFAOYSA-N 1 2 318.804 4.902 20 0 DJADLO Fc1cc(F)c(C[N@@H+]2CCCCC[C@@H]2c2ccncc2)cc1F ZINC000505265657 340165150 /nfs/dbraw/zinc/16/51/50/340165150.db2.gz LZHAFSLUYNDTDI-GOSISDBHSA-N 1 2 320.358 4.616 20 0 DJADLO Fc1cc(F)c(C[N@H+]2CCCCC[C@@H]2c2ccncc2)cc1F ZINC000505265657 340165151 /nfs/dbraw/zinc/16/51/51/340165151.db2.gz LZHAFSLUYNDTDI-GOSISDBHSA-N 1 2 320.358 4.616 20 0 DJADLO CC(C)[N@@H+](Cc1csc(-c2cccs2)n1)Cc1ccco1 ZINC000506442223 340194717 /nfs/dbraw/zinc/19/47/17/340194717.db2.gz CSJZNQRMBFSAKL-UHFFFAOYSA-N 1 2 318.467 4.875 20 0 DJADLO CC(C)[N@H+](Cc1csc(-c2cccs2)n1)Cc1ccco1 ZINC000506442223 340194718 /nfs/dbraw/zinc/19/47/18/340194718.db2.gz CSJZNQRMBFSAKL-UHFFFAOYSA-N 1 2 318.467 4.875 20 0 DJADLO Cc1nc(C[N@@H+](C)Cc2ccc(OCCC(C)C)cc2)cs1 ZINC000506668638 340199006 /nfs/dbraw/zinc/19/90/06/340199006.db2.gz KQTKGNLVJSWCJW-UHFFFAOYSA-N 1 2 318.486 4.508 20 0 DJADLO Cc1nc(C[N@H+](C)Cc2ccc(OCCC(C)C)cc2)cs1 ZINC000506668638 340199007 /nfs/dbraw/zinc/19/90/07/340199007.db2.gz KQTKGNLVJSWCJW-UHFFFAOYSA-N 1 2 318.486 4.508 20 0 DJADLO CCc1ccc(C[N@H+](C)[C@@H](C)c2nc3ccccc3s2)o1 ZINC000506722475 340200105 /nfs/dbraw/zinc/20/01/05/340200105.db2.gz VPUDNSNVCJJGTP-LBPRGKRZSA-N 1 2 300.427 4.645 20 0 DJADLO CCc1ccc(C[N@@H+](C)[C@@H](C)c2nc3ccccc3s2)o1 ZINC000506722475 340200106 /nfs/dbraw/zinc/20/01/06/340200106.db2.gz VPUDNSNVCJJGTP-LBPRGKRZSA-N 1 2 300.427 4.645 20 0 DJADLO C[C@@H]1C[C@H]1c1ccc(C[N@H+](C)Cc2nc3ccccc3s2)o1 ZINC000506732220 340200259 /nfs/dbraw/zinc/20/02/59/340200259.db2.gz VBSFKJQQSGEWAH-TZMCWYRMSA-N 1 2 312.438 4.645 20 0 DJADLO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](C)Cc2nc3ccccc3s2)o1 ZINC000506732220 340200260 /nfs/dbraw/zinc/20/02/60/340200260.db2.gz VBSFKJQQSGEWAH-TZMCWYRMSA-N 1 2 312.438 4.645 20 0 DJADLO Cc1nc(C)c(C[N@@H+](C)Cc2c(Cl)cccc2Cl)s1 ZINC000507132459 340208734 /nfs/dbraw/zinc/20/87/34/340208734.db2.gz MRGQKWZKJUOGSO-UHFFFAOYSA-N 1 2 315.269 4.699 20 0 DJADLO Cc1nc(C)c(C[N@H+](C)Cc2c(Cl)cccc2Cl)s1 ZINC000507132459 340208735 /nfs/dbraw/zinc/20/87/35/340208735.db2.gz MRGQKWZKJUOGSO-UHFFFAOYSA-N 1 2 315.269 4.699 20 0 DJADLO CCn1nccc1C[N@@H+]1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000507131901 340208878 /nfs/dbraw/zinc/20/88/78/340208878.db2.gz MKGQMVWNPWDIJK-INIZCTEOSA-N 1 2 324.255 4.547 20 0 DJADLO CCn1nccc1C[N@H+]1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000507131901 340208879 /nfs/dbraw/zinc/20/88/79/340208879.db2.gz MKGQMVWNPWDIJK-INIZCTEOSA-N 1 2 324.255 4.547 20 0 DJADLO CC(C)c1nc(C[N@H+](Cc2ccccc2F)C(C)C)cs1 ZINC000507167669 340210571 /nfs/dbraw/zinc/21/05/71/340210571.db2.gz NNQOVHWBPUQKAQ-UHFFFAOYSA-N 1 2 306.450 4.816 20 0 DJADLO CC(C)c1nc(C[N@@H+](Cc2ccccc2F)C(C)C)cs1 ZINC000507167669 340210572 /nfs/dbraw/zinc/21/05/72/340210572.db2.gz NNQOVHWBPUQKAQ-UHFFFAOYSA-N 1 2 306.450 4.816 20 0 DJADLO CSCc1cnc(C[N@H+](C)[C@@H](C)c2cc(C)ccc2C)s1 ZINC000507193106 340212442 /nfs/dbraw/zinc/21/24/42/340212442.db2.gz NBQIRVABLFWOMP-AWEZNQCLSA-N 1 2 320.527 4.816 20 0 DJADLO CSCc1cnc(C[N@@H+](C)[C@@H](C)c2cc(C)ccc2C)s1 ZINC000507193106 340212443 /nfs/dbraw/zinc/21/24/43/340212443.db2.gz NBQIRVABLFWOMP-AWEZNQCLSA-N 1 2 320.527 4.816 20 0 DJADLO Cc1ncsc1C[N@H+](Cc1ccco1)Cc1cccc(C)c1 ZINC000507202673 340212891 /nfs/dbraw/zinc/21/28/91/340212891.db2.gz KGAYLENLSUBIGF-UHFFFAOYSA-N 1 2 312.438 4.555 20 0 DJADLO Cc1ncsc1C[N@@H+](Cc1ccco1)Cc1cccc(C)c1 ZINC000507202673 340212892 /nfs/dbraw/zinc/21/28/92/340212892.db2.gz KGAYLENLSUBIGF-UHFFFAOYSA-N 1 2 312.438 4.555 20 0 DJADLO Cc1ccc(-c2nc(C[N@@H+](C)[C@H](C)c3ccco3)cs2)cc1 ZINC000507221886 340214457 /nfs/dbraw/zinc/21/44/57/340214457.db2.gz PEEHCGWCJNYAMM-CQSZACIVSA-N 1 2 312.438 4.905 20 0 DJADLO Cc1ccc(-c2nc(C[N@H+](C)[C@H](C)c3ccco3)cs2)cc1 ZINC000507221886 340214458 /nfs/dbraw/zinc/21/44/58/340214458.db2.gz PEEHCGWCJNYAMM-CQSZACIVSA-N 1 2 312.438 4.905 20 0 DJADLO CCc1cccnc1[C@H](C)[NH2+]Cc1csc(-c2ccccc2)n1 ZINC000507466789 340221016 /nfs/dbraw/zinc/22/10/16/340221016.db2.gz DJWMRNXABRVMSM-AWEZNQCLSA-N 1 2 323.465 4.618 20 0 DJADLO C[C@H](c1ccc(F)cc1)[N@@H+]1CCO[C@@H](c2ccccc2Cl)C1 ZINC000507789195 340231642 /nfs/dbraw/zinc/23/16/42/340231642.db2.gz SBKRWDOOSSAUET-FZKQIMNGSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@H](c1ccc(F)cc1)[N@H+]1CCO[C@@H](c2ccccc2Cl)C1 ZINC000507789195 340231643 /nfs/dbraw/zinc/23/16/43/340231643.db2.gz SBKRWDOOSSAUET-FZKQIMNGSA-N 1 2 319.807 4.614 20 0 DJADLO CC1(C)C[C@H]1C(=O)Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000508114885 340239388 /nfs/dbraw/zinc/23/93/88/340239388.db2.gz PZVYARYAYPBVOD-ZDUSSCGKSA-N 1 2 316.788 4.512 20 0 DJADLO Cc1ccccc1C[N@H+](Cc1nccs1)Cc1ccccc1 ZINC000508756658 340252602 /nfs/dbraw/zinc/25/26/02/340252602.db2.gz JHHOCPDMAXTHDS-UHFFFAOYSA-N 1 2 308.450 4.654 20 0 DJADLO Cc1ccccc1C[N@@H+](Cc1nccs1)Cc1ccccc1 ZINC000508756658 340252603 /nfs/dbraw/zinc/25/26/03/340252603.db2.gz JHHOCPDMAXTHDS-UHFFFAOYSA-N 1 2 308.450 4.654 20 0 DJADLO C[C@@H](c1ncc(-c2ccccc2)o1)[N@@H+]1CCc2cc(F)ccc2C1 ZINC000509456252 340270115 /nfs/dbraw/zinc/27/01/15/340270115.db2.gz WOAPRGAVSNKVHS-AWEZNQCLSA-N 1 2 322.383 4.600 20 0 DJADLO C[C@@H](c1ncc(-c2ccccc2)o1)[N@H+]1CCc2cc(F)ccc2C1 ZINC000509456252 340270116 /nfs/dbraw/zinc/27/01/16/340270116.db2.gz WOAPRGAVSNKVHS-AWEZNQCLSA-N 1 2 322.383 4.600 20 0 DJADLO C[C@H](c1ncc(-c2ccccc2)o1)[N@@H+]1CCc2cc(F)ccc2C1 ZINC000509456253 340270140 /nfs/dbraw/zinc/27/01/40/340270140.db2.gz WOAPRGAVSNKVHS-CQSZACIVSA-N 1 2 322.383 4.600 20 0 DJADLO C[C@H](c1ncc(-c2ccccc2)o1)[N@H+]1CCc2cc(F)ccc2C1 ZINC000509456253 340270141 /nfs/dbraw/zinc/27/01/41/340270141.db2.gz WOAPRGAVSNKVHS-CQSZACIVSA-N 1 2 322.383 4.600 20 0 DJADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cc(Cl)cc(Cl)c2)on1 ZINC000509779597 340278988 /nfs/dbraw/zinc/27/89/88/340278988.db2.gz BERWYKKATLGZTH-AWEZNQCLSA-N 1 2 311.212 4.627 20 0 DJADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2cc(Cl)cc(Cl)c2)on1 ZINC000509779597 340278989 /nfs/dbraw/zinc/27/89/89/340278989.db2.gz BERWYKKATLGZTH-AWEZNQCLSA-N 1 2 311.212 4.627 20 0 DJADLO C[N@H+](Cc1coc(-c2cccs2)n1)Cc1cccc(Cl)c1 ZINC000302749546 340281157 /nfs/dbraw/zinc/28/11/57/340281157.db2.gz VMUYXZDVGJTONL-UHFFFAOYSA-N 1 2 318.829 4.689 20 0 DJADLO C[N@@H+](Cc1coc(-c2cccs2)n1)Cc1cccc(Cl)c1 ZINC000302749546 340281158 /nfs/dbraw/zinc/28/11/58/340281158.db2.gz VMUYXZDVGJTONL-UHFFFAOYSA-N 1 2 318.829 4.689 20 0 DJADLO CC1(C)CCC(NC(=O)c2ccccc2Oc2cc[nH+]cc2)CC1 ZINC000509958687 340283968 /nfs/dbraw/zinc/28/39/68/340283968.db2.gz OKEUZNZNLMGEAO-UHFFFAOYSA-N 1 2 324.424 4.573 20 0 DJADLO COc1cccc(C2([NH2+]Cc3c(Cl)cccc3Cl)CC2)c1 ZINC000510122694 340289492 /nfs/dbraw/zinc/28/94/92/340289492.db2.gz AJWPCGXLUOZVHJ-UHFFFAOYSA-N 1 2 322.235 4.781 20 0 DJADLO CC1(C)CCCCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000510407707 340298240 /nfs/dbraw/zinc/29/82/40/340298240.db2.gz NREADVNBTWMMKQ-UHFFFAOYSA-N 1 2 324.424 4.526 20 0 DJADLO Cc1ccc([C@@H](C)[N@H+](C)Cc2noc(-c3ccccc3)n2)c(C)c1 ZINC000511599748 340331871 /nfs/dbraw/zinc/33/18/71/340331871.db2.gz OUAMOMPOWXAHGE-MRXNPFEDSA-N 1 2 321.424 4.546 20 0 DJADLO Cc1ccc([C@@H](C)[N@@H+](C)Cc2noc(-c3ccccc3)n2)c(C)c1 ZINC000511599748 340331872 /nfs/dbraw/zinc/33/18/72/340331872.db2.gz OUAMOMPOWXAHGE-MRXNPFEDSA-N 1 2 321.424 4.546 20 0 DJADLO Cc1ccc(-c2cccc(C[N@H+](C)Cc3cscn3)c2)cc1 ZINC000512050701 340346687 /nfs/dbraw/zinc/34/66/87/340346687.db2.gz DVBKCAIEJYXQKT-UHFFFAOYSA-N 1 2 308.450 4.751 20 0 DJADLO Cc1ccc(-c2cccc(C[N@@H+](C)Cc3cscn3)c2)cc1 ZINC000512050701 340346688 /nfs/dbraw/zinc/34/66/88/340346688.db2.gz DVBKCAIEJYXQKT-UHFFFAOYSA-N 1 2 308.450 4.751 20 0 DJADLO c1cn(-c2ccc(NCc3ccc(-c4ccccc4)o3)cc2)c[nH+]1 ZINC000512924692 340384279 /nfs/dbraw/zinc/38/42/79/340384279.db2.gz RPBGQLMNGCZIRZ-UHFFFAOYSA-N 1 2 315.376 4.744 20 0 DJADLO Clc1cccc(Cl)c1CNc1ccc(-n2cc[nH+]c2)cc1 ZINC000512984921 340387020 /nfs/dbraw/zinc/38/70/20/340387020.db2.gz LRHXXBCVQABCST-UHFFFAOYSA-N 1 2 318.207 4.791 20 0 DJADLO Cc1cc2cc(C[NH2+][C@H](C)c3c(F)cncc3F)oc2cc1C ZINC000513056716 340391338 /nfs/dbraw/zinc/39/13/38/340391338.db2.gz KRNQUDKOWZHDCM-GFCCVEGCSA-N 1 2 316.351 4.574 20 0 DJADLO C[C@H]([NH2+]Cc1c(Cl)cccc1Cl)c1c(F)cncc1F ZINC000513228799 340398390 /nfs/dbraw/zinc/39/83/90/340398390.db2.gz MPIGGNUNRMSEDG-QMMMGPOBSA-N 1 2 317.166 4.517 20 0 DJADLO C[C@@H]([NH2+]Cc1c(Cl)cccc1Cl)c1c(F)cncc1F ZINC000513228798 340398419 /nfs/dbraw/zinc/39/84/19/340398419.db2.gz MPIGGNUNRMSEDG-MRVPVSSYSA-N 1 2 317.166 4.517 20 0 DJADLO C[C@H]([NH2+]C1c2ccccc2-c2ccccc21)c1c(F)cncc1F ZINC000513236494 340398899 /nfs/dbraw/zinc/39/88/99/340398899.db2.gz MDJJGRXQDFLVKA-LBPRGKRZSA-N 1 2 322.358 4.780 20 0 DJADLO CN(C(=O)c1ccccc1Oc1cc[nH+]cc1)[C@H]1CCC(C)(C)C1 ZINC000514065147 340443802 /nfs/dbraw/zinc/44/38/02/340443802.db2.gz OOKVRJPPGIGKPL-HNNXBMFYSA-N 1 2 324.424 4.525 20 0 DJADLO CCCC[C@@H]([NH2+]Cc1cc[nH]n1)c1ccc(Cl)cc1Cl ZINC000521074985 340479827 /nfs/dbraw/zinc/47/98/27/340479827.db2.gz KSRIPXPVPUTYBT-OAHLLOKOSA-N 1 2 312.244 4.738 20 0 DJADLO Cc1ccc[nH+]c1CCc1noc([C@@H](F)CC2CCCCC2)n1 ZINC000564168259 340527671 /nfs/dbraw/zinc/52/76/71/340527671.db2.gz LTCAEAZDHSEBLO-HNNXBMFYSA-N 1 2 317.408 4.539 20 0 DJADLO Clc1csc(C[NH2+][C@@H](c2nccs2)c2ccccc2)c1 ZINC000193070335 340572079 /nfs/dbraw/zinc/57/20/79/340572079.db2.gz MVXYOWWCSAXTFK-CQSZACIVSA-N 1 2 320.870 4.737 20 0 DJADLO Cc1cc(C)c(C(=O)Nc2ccc(Oc3cc[nH+]cc3)c(C)c2)o1 ZINC000193184683 340573749 /nfs/dbraw/zinc/57/37/49/340573749.db2.gz DKSGYZBWSDNLOL-UHFFFAOYSA-N 1 2 322.364 4.644 20 0 DJADLO CC[C@H]([NH2+][C@H](C)c1nc(C(C)(C)C)no1)c1cc(C)ccc1C ZINC000528802464 340735108 /nfs/dbraw/zinc/73/51/08/340735108.db2.gz SZDXPOMQBZMWTF-ZBFHGGJFSA-N 1 2 315.461 4.786 20 0 DJADLO CC(C)[C@@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccc(F)cc1F ZINC000538227200 340814078 /nfs/dbraw/zinc/81/40/78/340814078.db2.gz IATFJEOZYBFINT-QGZVFWFLSA-N 1 2 322.399 4.737 20 0 DJADLO CC(C)(C)c1ccc(C[NH2+][C@@H](c2ncc[nH]2)c2ccccc2)cc1 ZINC000126417965 340826953 /nfs/dbraw/zinc/82/69/53/340826953.db2.gz NDSIKTRKYGIQFW-LJQANCHMSA-N 1 2 319.452 4.586 20 0 DJADLO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ncc(C(C)(C)C)o2)cc1F ZINC000126668714 340830198 /nfs/dbraw/zinc/83/01/98/340830198.db2.gz FBDNCJJRYNFQTE-CHWSQXEVSA-N 1 2 304.409 4.831 20 0 DJADLO Clc1ccc([C@H]([NH2+]Cc2ccco2)c2ccsc2)cc1 ZINC000067253670 340856163 /nfs/dbraw/zinc/85/61/63/340856163.db2.gz SETDICNJGBHWSO-INIZCTEOSA-N 1 2 303.814 4.874 20 0 DJADLO C[C@H]([NH2+][C@H](COc1ccccc1)c1ccccc1)c1nccs1 ZINC000539069119 340870170 /nfs/dbraw/zinc/87/01/70/340870170.db2.gz OKWDNQZLKSOAJG-MAUKXSAKSA-N 1 2 324.449 4.614 20 0 DJADLO CC(C)(C)C[C@@H]([NH2+]Cc1noc(C(C)(C)C)n1)c1ccccc1 ZINC000539281728 340879285 /nfs/dbraw/zinc/87/92/85/340879285.db2.gz VBLBXRFEGXKRDU-OAHLLOKOSA-N 1 2 315.461 4.634 20 0 DJADLO C[C@H](Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)c1ccco1 ZINC000539741651 340898461 /nfs/dbraw/zinc/89/84/61/340898461.db2.gz RRUQGIIGTIOAOW-AWEZNQCLSA-N 1 2 307.397 4.653 20 0 DJADLO CCC(C)(C)OCc1cccc(N[C@@H](C)c2[nH+]ccn2C)c1C ZINC000540729045 340943598 /nfs/dbraw/zinc/94/35/98/340943598.db2.gz TUSGVAUSKYCKIW-HNNXBMFYSA-N 1 2 315.461 4.607 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1nc2ccccc2o1 ZINC000540854716 340948750 /nfs/dbraw/zinc/94/87/50/340948750.db2.gz RUTWREKMEFNQSJ-QWRGUYRKSA-N 1 2 302.324 4.518 20 0 DJADLO COc1cc(C)[nH+]c(CS[C@@H](C)c2nc3ccccc3o2)c1 ZINC000540901732 340950771 /nfs/dbraw/zinc/95/07/71/340950771.db2.gz MOHMHFKQORWISR-LBPRGKRZSA-N 1 2 314.410 4.534 20 0 DJADLO Cc1nc(C[N@@H+](C)C2c3ccccc3-c3ccccc32)cs1 ZINC000130150066 341002907 /nfs/dbraw/zinc/00/29/07/341002907.db2.gz QIAUINFUDGPHIU-UHFFFAOYSA-N 1 2 306.434 4.653 20 0 DJADLO Cc1nc(C[N@H+](C)C2c3ccccc3-c3ccccc32)cs1 ZINC000130150066 341002908 /nfs/dbraw/zinc/00/29/08/341002908.db2.gz QIAUINFUDGPHIU-UHFFFAOYSA-N 1 2 306.434 4.653 20 0 DJADLO CC(C)c1cnc(C[N@@H+]2CC[C@@H](C)C[C@@H]2c2ccco2)s1 ZINC000542465831 341008581 /nfs/dbraw/zinc/00/85/81/341008581.db2.gz MIAZHDLGRSYDDX-ZIAGYGMSSA-N 1 2 304.459 4.833 20 0 DJADLO CC(C)c1cnc(C[N@H+]2CC[C@@H](C)C[C@@H]2c2ccco2)s1 ZINC000542465831 341008582 /nfs/dbraw/zinc/00/85/82/341008582.db2.gz MIAZHDLGRSYDDX-ZIAGYGMSSA-N 1 2 304.459 4.833 20 0 DJADLO CC(C)n1cc([C@H](C)[NH2+][C@@H](C)c2ncc(-c3ccccc3)o2)cn1 ZINC000542574400 341014194 /nfs/dbraw/zinc/01/41/94/341014194.db2.gz PDDYJGOSRNBJRR-GJZGRUSLSA-N 1 2 324.428 4.531 20 0 DJADLO C[N@H+](Cc1cccnc1)Cc1ccc(-c2ccccc2)cc1F ZINC000542692167 341017344 /nfs/dbraw/zinc/01/73/44/341017344.db2.gz UZJLGVRCACABGQ-UHFFFAOYSA-N 1 2 306.384 4.520 20 0 DJADLO C[N@@H+](Cc1cccnc1)Cc1ccc(-c2ccccc2)cc1F ZINC000542692167 341017345 /nfs/dbraw/zinc/01/73/45/341017345.db2.gz UZJLGVRCACABGQ-UHFFFAOYSA-N 1 2 306.384 4.520 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1cc(F)c(Cl)cc1Cl)c1ccon1 ZINC000542699558 341017814 /nfs/dbraw/zinc/01/78/14/341017814.db2.gz JHIHQUCFSWAXII-HTQZYQBOSA-N 1 2 303.164 4.532 20 0 DJADLO CCc1cccnc1[C@H](C)[NH2+]Cc1c(Cl)cccc1Cl ZINC000542811823 341021723 /nfs/dbraw/zinc/02/17/23/341021723.db2.gz HZBVLJONEJLAPI-NSHDSACASA-N 1 2 309.240 4.802 20 0 DJADLO CC(C)c1ccccc1NC(=O)[C@@H](C)[N@@H+]1Cc2ccccc2[C@H]1C ZINC000543059710 341029611 /nfs/dbraw/zinc/02/96/11/341029611.db2.gz CIBMUMPVTFLQPA-HZPDHXFCSA-N 1 2 322.452 4.714 20 0 DJADLO CC(C)c1ccccc1NC(=O)[C@@H](C)[N@H+]1Cc2ccccc2[C@H]1C ZINC000543059710 341029612 /nfs/dbraw/zinc/02/96/12/341029612.db2.gz CIBMUMPVTFLQPA-HZPDHXFCSA-N 1 2 322.452 4.714 20 0 DJADLO Cc1ccc(-c2ccc(C[NH2+]Cc3nc(C4CC4)cs3)o2)cc1 ZINC000131139253 341062632 /nfs/dbraw/zinc/06/26/32/341062632.db2.gz QKFHNXKTRUAJFE-UHFFFAOYSA-N 1 2 324.449 4.879 20 0 DJADLO Cc1ccc(-c2cnc(C[N@@H+]3Cc4ccccc4[C@H]3C)o2)cc1 ZINC000543988094 341065213 /nfs/dbraw/zinc/06/52/13/341065213.db2.gz YUCHKIJKZRMQEO-OAHLLOKOSA-N 1 2 304.393 4.727 20 0 DJADLO Cc1ccc(-c2cnc(C[N@H+]3Cc4ccccc4[C@H]3C)o2)cc1 ZINC000543988094 341065214 /nfs/dbraw/zinc/06/52/14/341065214.db2.gz YUCHKIJKZRMQEO-OAHLLOKOSA-N 1 2 304.393 4.727 20 0 DJADLO CC(C)(C)c1ccc(CNc2ccc(-c3cncnc3)c[nH+]2)s1 ZINC000543997118 341065678 /nfs/dbraw/zinc/06/56/78/341065678.db2.gz VLOTXTJKGFBFEK-UHFFFAOYSA-N 1 2 324.453 4.510 20 0 DJADLO C(=C\c1ccc2ccccc2n1)\c1cc(-n2cc[nH+]c2)cs1 ZINC000544046201 341067787 /nfs/dbraw/zinc/06/77/87/341067787.db2.gz PBQQQJQGSUKMDS-FPLPWBNLSA-N 1 2 303.390 4.652 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1ccon1)c1ccccc1OCc1ccccc1 ZINC000544607217 341088558 /nfs/dbraw/zinc/08/85/58/341088558.db2.gz RPZMSXNRKSKPFI-CVEARBPZSA-N 1 2 322.408 4.665 20 0 DJADLO CC[N@H+](Cc1ncc(C)o1)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000072610811 341093685 /nfs/dbraw/zinc/09/36/85/341093685.db2.gz CWIYVCRGDRGKKK-FQEVSTJZSA-N 1 2 324.399 4.734 20 0 DJADLO CC[N@@H+](Cc1ncc(C)o1)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000072610811 341093686 /nfs/dbraw/zinc/09/36/86/341093686.db2.gz CWIYVCRGDRGKKK-FQEVSTJZSA-N 1 2 324.399 4.734 20 0 DJADLO CCc1cnc(C[NH2+]C(c2ccccc2C)c2ccccc2C)o1 ZINC000544896322 341098119 /nfs/dbraw/zinc/09/81/19/341098119.db2.gz APQWMVRTGBEJGQ-UHFFFAOYSA-N 1 2 320.436 4.733 20 0 DJADLO Cc1nc(C[NH2+]C2(c3ccc(Cl)c(Cl)c3)CC2)cs1 ZINC000545959220 341148447 /nfs/dbraw/zinc/14/84/47/341148447.db2.gz MDOSQZHKHOCZHY-UHFFFAOYSA-N 1 2 313.253 4.537 20 0 DJADLO Cc1cccc(C)c1C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000074950719 341157108 /nfs/dbraw/zinc/15/71/08/341157108.db2.gz GTADPOBDVNPENT-UHFFFAOYSA-N 1 2 318.376 4.743 20 0 DJADLO Cc1cnc(C[N@@H+]([C@H](C)c2cccc(C(F)(F)F)c2)C2CC2)o1 ZINC000075684608 341180930 /nfs/dbraw/zinc/18/09/30/341180930.db2.gz UPOTUFYMGCTUJB-GFCCVEGCSA-N 1 2 324.346 4.727 20 0 DJADLO Cc1cnc(C[N@H+]([C@H](C)c2cccc(C(F)(F)F)c2)C2CC2)o1 ZINC000075684608 341180931 /nfs/dbraw/zinc/18/09/31/341180931.db2.gz UPOTUFYMGCTUJB-GFCCVEGCSA-N 1 2 324.346 4.727 20 0 DJADLO CCOc1cc(C)ccc1C[NH2+][C@H](C)c1c(F)cccc1F ZINC000237045511 341206373 /nfs/dbraw/zinc/20/63/73/341206373.db2.gz ANTFZORWBXLNCH-CYBMUJFWSA-N 1 2 305.368 4.523 20 0 DJADLO CCO[C@H](C)c1nc(C[NH2+][C@H](C)c2ccccc2Cl)cs1 ZINC000076716234 341212954 /nfs/dbraw/zinc/21/29/54/341212954.db2.gz GCGNVUSNKIFDGG-VXGBXAGGSA-N 1 2 324.877 4.745 20 0 DJADLO Cc1nc(C[N@@H+]2CCCC[C@H]2c2cc3ccccc3[nH]2)cs1 ZINC000076728856 341213154 /nfs/dbraw/zinc/21/31/54/341213154.db2.gz JWSUPBUPQOQHOL-SFHVURJKSA-N 1 2 311.454 4.660 20 0 DJADLO Cc1nc(C[N@H+]2CCCC[C@H]2c2cc3ccccc3[nH]2)cs1 ZINC000076728856 341213155 /nfs/dbraw/zinc/21/31/55/341213155.db2.gz JWSUPBUPQOQHOL-SFHVURJKSA-N 1 2 311.454 4.660 20 0 DJADLO O=C(CC1CCCCC1)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000078651387 341245640 /nfs/dbraw/zinc/24/56/40/341245640.db2.gz IMOZAJQZPPTCFU-UHFFFAOYSA-N 1 2 310.397 4.783 20 0 DJADLO C[C@H]([NH2+][C@H](c1ccco1)c1ccccc1)c1c(F)cccc1F ZINC000078991468 341251412 /nfs/dbraw/zinc/25/14/12/341251412.db2.gz WMVGVMSXTGEPLG-DJJJIMSYSA-N 1 2 313.347 4.998 20 0 DJADLO CCc1ccc(C[N@@H+]2CCCC[C@@H]2c2nc3ccccc3o2)nc1 ZINC000549525514 341296340 /nfs/dbraw/zinc/29/63/40/341296340.db2.gz CTOVCGXZQAKTRH-GOSISDBHSA-N 1 2 321.424 4.512 20 0 DJADLO CCc1ccc(C[N@H+]2CCCC[C@@H]2c2nc3ccccc3o2)nc1 ZINC000549525514 341296341 /nfs/dbraw/zinc/29/63/41/341296341.db2.gz CTOVCGXZQAKTRH-GOSISDBHSA-N 1 2 321.424 4.512 20 0 DJADLO Cc1nc(C[N@H+](Cc2ccco2)Cc2cccs2)sc1C ZINC000081645939 341300554 /nfs/dbraw/zinc/30/05/54/341300554.db2.gz WHMNCOROCKTPJE-UHFFFAOYSA-N 1 2 318.467 4.617 20 0 DJADLO Cc1nc(C[N@@H+](Cc2ccco2)Cc2cccs2)sc1C ZINC000081645939 341300555 /nfs/dbraw/zinc/30/05/55/341300555.db2.gz WHMNCOROCKTPJE-UHFFFAOYSA-N 1 2 318.467 4.617 20 0 DJADLO Fc1cccc(C[N@H+](Cc2nc3ccccc3s2)C2CC2)c1 ZINC000549733300 341301791 /nfs/dbraw/zinc/30/17/91/341301791.db2.gz ACHSXTSKZXHSDY-UHFFFAOYSA-N 1 2 312.413 4.600 20 0 DJADLO Fc1cccc(C[N@@H+](Cc2nc3ccccc3s2)C2CC2)c1 ZINC000549733300 341301792 /nfs/dbraw/zinc/30/17/92/341301792.db2.gz ACHSXTSKZXHSDY-UHFFFAOYSA-N 1 2 312.413 4.600 20 0 DJADLO Clc1cc(Cl)cc(CNc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000550672973 341321193 /nfs/dbraw/zinc/32/11/93/341321193.db2.gz VWYLSNMKXWYRHZ-UHFFFAOYSA-N 1 2 318.207 4.791 20 0 DJADLO CCO[C@H](C)c1nc(C[N@H+](C)[C@H](C)c2ccc(C)cc2)cs1 ZINC000246825032 341357443 /nfs/dbraw/zinc/35/74/43/341357443.db2.gz SXVLWCPTSCUOSI-HUUCEWRRSA-N 1 2 318.486 4.742 20 0 DJADLO CCO[C@H](C)c1nc(C[N@@H+](C)[C@H](C)c2ccc(C)cc2)cs1 ZINC000246825032 341357444 /nfs/dbraw/zinc/35/74/44/341357444.db2.gz SXVLWCPTSCUOSI-HUUCEWRRSA-N 1 2 318.486 4.742 20 0 DJADLO C[N@@H+](Cc1coc(-c2cccs2)n1)Cc1ccc(Cl)s1 ZINC000248141352 341373861 /nfs/dbraw/zinc/37/38/61/341373861.db2.gz UENJWOIGTFSHSG-UHFFFAOYSA-N 1 2 324.858 4.750 20 0 DJADLO C[N@H+](Cc1coc(-c2cccs2)n1)Cc1ccc(Cl)s1 ZINC000248141352 341373862 /nfs/dbraw/zinc/37/38/62/341373862.db2.gz UENJWOIGTFSHSG-UHFFFAOYSA-N 1 2 324.858 4.750 20 0 DJADLO COCc1ccc([C@@H]2CCC[N@@H+]2[C@@H](C)c2c(F)cccc2F)o1 ZINC000248630233 341382164 /nfs/dbraw/zinc/38/21/64/341382164.db2.gz RLCHTGYFKZBIIF-LRDDRELGSA-N 1 2 321.367 4.602 20 0 DJADLO COCc1ccc([C@@H]2CCC[N@H+]2[C@@H](C)c2c(F)cccc2F)o1 ZINC000248630233 341382165 /nfs/dbraw/zinc/38/21/65/341382165.db2.gz RLCHTGYFKZBIIF-LRDDRELGSA-N 1 2 321.367 4.602 20 0 DJADLO C[C@@H](Nc1cccc(CCCc2ccccc2)c1)c1[nH]cc[nH+]1 ZINC000552283143 341384012 /nfs/dbraw/zinc/38/40/12/341384012.db2.gz ZMEZAENWESOBGI-MRXNPFEDSA-N 1 2 305.425 4.758 20 0 DJADLO C[C@H](Nc1cccc(CCCc2ccccc2)c1)c1[nH]cc[nH+]1 ZINC000552283142 341384050 /nfs/dbraw/zinc/38/40/50/341384050.db2.gz ZMEZAENWESOBGI-INIZCTEOSA-N 1 2 305.425 4.758 20 0 DJADLO COc1ccccc1[C@H]([NH2+][C@@H]1CCc2ccccc21)c1ccco1 ZINC000090534399 341416625 /nfs/dbraw/zinc/41/66/25/341416625.db2.gz XIYRMZIPESNPMY-NQIIRXRSSA-N 1 2 319.404 4.655 20 0 DJADLO CC[C@H](Nc1cc[nH+]c2c(Cl)cccc12)C1CCOCC1 ZINC000553152218 341417906 /nfs/dbraw/zinc/41/79/06/341417906.db2.gz GMEHUKDDPYLASK-HNNXBMFYSA-N 1 2 304.821 4.505 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1ccccc1)c1cccc(F)c1)c1nccs1 ZINC000091735808 341427940 /nfs/dbraw/zinc/42/79/40/341427940.db2.gz NYMFPYMPGGMZOD-DYVFJYSZSA-N 1 2 312.413 4.722 20 0 DJADLO FC(F)(F)Oc1cccc([C@H](Nc2cccc[nH+]2)C2CC2)c1 ZINC000567187999 341585173 /nfs/dbraw/zinc/58/51/73/341585173.db2.gz FZHOUEIBEFFRNX-OAHLLOKOSA-N 1 2 308.303 4.543 20 0 DJADLO COC[C@@H]([NH2+][C@H](C)c1cc(Cl)ccc1Cl)c1ccco1 ZINC000156713942 341625609 /nfs/dbraw/zinc/62/56/09/341625609.db2.gz RDABRRRVPCKLRI-QMTHXVAHSA-N 1 2 314.212 4.625 20 0 DJADLO Cc1nc([C@@H](C)[NH2+]Cc2cc(Cl)sc2Cl)cs1 ZINC000312757038 341628529 /nfs/dbraw/zinc/62/85/29/341628529.db2.gz IMVFJYBNLKZNBN-ZCFIWIBFSA-N 1 2 307.271 4.671 20 0 DJADLO C[C@H]([NH2+]CC(F)(F)c1ccccc1)c1nccc2ccccc21 ZINC000574848122 341770721 /nfs/dbraw/zinc/77/07/21/341770721.db2.gz RCKVYUNRPXCIAZ-AWEZNQCLSA-N 1 2 312.363 4.677 20 0 DJADLO CC[C@H]([NH2+]Cc1nc(CCC(C)C)no1)c1ccc(Cl)cc1 ZINC000175528512 341839499 /nfs/dbraw/zinc/83/94/99/341839499.db2.gz AIRQVDYQZSPGHH-HNNXBMFYSA-N 1 2 321.852 4.553 20 0 DJADLO CC(C)[C@@H]([NH2+]Cc1nccn1C(C)C)c1ccc(Cl)cc1F ZINC000180266285 519799297 /nfs/dbraw/zinc/79/92/97/519799297.db2.gz QWTFHTGRNOQHBA-QGZVFWFLSA-N 1 2 323.843 4.743 20 0 DJADLO CC(C)n1cc[nH+]c1CNc1cc(F)c(OC(C)(C)C)c(F)c1 ZINC000180933823 520033440 /nfs/dbraw/zinc/03/34/40/520033440.db2.gz OVQSWSXHELYHTR-UHFFFAOYSA-N 1 2 323.387 4.532 20 0 DJADLO CCCCC[C@@H]([NH2+]Cc1nnc(C(C)C)o1)c1ccccc1 ZINC000181748549 520294112 /nfs/dbraw/zinc/29/41/12/520294112.db2.gz HWSAAGOZPDHZFA-MRXNPFEDSA-N 1 2 301.434 4.604 20 0 DJADLO CCCCC[C@H]([NH2+]Cc1nnc(C(C)C)o1)c1ccccc1 ZINC000181748531 520312723 /nfs/dbraw/zinc/31/27/23/520312723.db2.gz HWSAAGOZPDHZFA-INIZCTEOSA-N 1 2 301.434 4.604 20 0 DJADLO CC[N@H+](Cc1ccc2ccccc2c1)[C@@H](C)c1nnc(C)s1 ZINC000338238130 521334623 /nfs/dbraw/zinc/33/46/23/521334623.db2.gz ZALGPDIQYVXLCU-ZDUSSCGKSA-N 1 2 311.454 4.583 20 0 DJADLO CC[N@@H+](Cc1ccc2ccccc2c1)[C@@H](C)c1nnc(C)s1 ZINC000338238130 521334630 /nfs/dbraw/zinc/33/46/30/521334630.db2.gz ZALGPDIQYVXLCU-ZDUSSCGKSA-N 1 2 311.454 4.583 20 0 DJADLO CCCCc1noc([C@H](C)[NH2+][C@H](C)c2cc3ccccc3o2)n1 ZINC000182631927 521352410 /nfs/dbraw/zinc/35/24/10/521352410.db2.gz QHQGPTNASBSQFC-OLZOCXBDSA-N 1 2 313.401 4.570 20 0 DJADLO CCCc1cccc(C(C)C)c1NC(=O)c1ccc2[nH+]ccn2c1 ZINC000191543525 521424434 /nfs/dbraw/zinc/42/44/34/521424434.db2.gz QOEHILGEIQQGHR-UHFFFAOYSA-N 1 2 321.424 4.663 20 0 DJADLO CCOc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1nc(C)c(C)o1 ZINC000181266418 521575632 /nfs/dbraw/zinc/57/56/32/521575632.db2.gz LPDYIPTUQDRFFV-QGZVFWFLSA-N 1 2 316.445 4.567 20 0 DJADLO CCc1nc([C@@H](C)[NH2+][C@@H](CC)c2cc(F)ccc2F)cs1 ZINC000162316654 522422986 /nfs/dbraw/zinc/42/29/86/522422986.db2.gz DQRNGBCJWIOQCS-YGRLFVJLSA-N 1 2 310.413 4.786 20 0 DJADLO CC[C@H]([NH2+][C@@H](C)c1noc(-c2ccccc2)n1)c1ccccc1 ZINC000124299702 522701979 /nfs/dbraw/zinc/70/19/79/522701979.db2.gz DIEZWMGCOXCMPE-YOEHRIQHSA-N 1 2 307.397 4.539 20 0 DJADLO CO[C@@H](C)c1nc(C[N@H+](C)[C@H](C)c2ccc(C)cc2C)cs1 ZINC000267071710 523466376 /nfs/dbraw/zinc/46/63/76/523466376.db2.gz VVUOVNWALJDBNX-CABCVRRESA-N 1 2 318.486 4.660 20 0 DJADLO CO[C@@H](C)c1nc(C[N@@H+](C)[C@H](C)c2ccc(C)cc2C)cs1 ZINC000267071710 523466382 /nfs/dbraw/zinc/46/63/82/523466382.db2.gz VVUOVNWALJDBNX-CABCVRRESA-N 1 2 318.486 4.660 20 0 DJADLO CO[C@@H](C)c1nc(C[N@H+]([C@@H](C)c2ccccc2)C2CC2)cs1 ZINC000267007537 523469654 /nfs/dbraw/zinc/46/96/54/523469654.db2.gz KONNLAKKGRZJAA-KBPBESRZSA-N 1 2 316.470 4.576 20 0 DJADLO CO[C@@H](C)c1nc(C[N@@H+]([C@@H](C)c2ccccc2)C2CC2)cs1 ZINC000267007537 523469664 /nfs/dbraw/zinc/46/96/64/523469664.db2.gz KONNLAKKGRZJAA-KBPBESRZSA-N 1 2 316.470 4.576 20 0 DJADLO CCc1ccc([C@@H](C)[NH2+][C@H](c2ccccc2)c2ccccn2)o1 ZINC000154657727 524027352 /nfs/dbraw/zinc/02/73/52/524027352.db2.gz KJZKGRZZZUBTQN-FOIQADDNSA-N 1 2 306.409 4.677 20 0 DJADLO COc1ccccc1-c1ccc([C@@H](C)[N@H+](C)Cc2ccon2)cc1 ZINC000265979093 524270622 /nfs/dbraw/zinc/27/06/22/524270622.db2.gz AYFCZXCQRNDVMY-OAHLLOKOSA-N 1 2 322.408 4.543 20 0 DJADLO COc1ccccc1-c1ccc([C@@H](C)[N@@H+](C)Cc2ccon2)cc1 ZINC000265979093 524270632 /nfs/dbraw/zinc/27/06/32/524270632.db2.gz AYFCZXCQRNDVMY-OAHLLOKOSA-N 1 2 322.408 4.543 20 0 DJADLO COc1ccccc1[C@H](C)[NH2+][C@H](C)c1ncc(-c2ccccc2)o1 ZINC000266519933 524783641 /nfs/dbraw/zinc/78/36/41/524783641.db2.gz ZJFZPBMEMPKYKS-LSDHHAIUSA-N 1 2 322.408 4.762 20 0 DJADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+][C@@H](c2nccs2)c2ccccc2)o1 ZINC000237470353 525510079 /nfs/dbraw/zinc/51/00/79/525510079.db2.gz CIBLRFWJVIUFDM-MZMPZRCHSA-N 1 2 324.449 4.739 20 0 DJADLO Cc1ccc(-c2nc(C[N@@H+](C)[C@H](C)c3cccnc3)cs2)cc1 ZINC000180808737 525808486 /nfs/dbraw/zinc/80/84/86/525808486.db2.gz NBSDPWVVIHUFOU-OAHLLOKOSA-N 1 2 323.465 4.707 20 0 DJADLO Cc1ccc(-c2nc(C[N@H+](C)[C@H](C)c3cccnc3)cs2)cc1 ZINC000180808737 525808494 /nfs/dbraw/zinc/80/84/94/525808494.db2.gz NBSDPWVVIHUFOU-OAHLLOKOSA-N 1 2 323.465 4.707 20 0 DJADLO Cc1ccc([C@H](C)[NH2+][C@H](C)c2noc(-c3ccccc3)n2)s1 ZINC000124252334 525943846 /nfs/dbraw/zinc/94/38/46/525943846.db2.gz ITNXOFSCTSYHNM-QWHCGFSZSA-N 1 2 313.426 4.518 20 0 DJADLO Cc1csc(C2([NH2+]Cc3csc(C(C)C)n3)CCCC2)n1 ZINC000112711097 526326659 /nfs/dbraw/zinc/32/66/59/526326659.db2.gz HUQMIABQUPJELQ-UHFFFAOYSA-N 1 2 321.515 4.591 20 0 DJADLO C[C@H]([NH2+]Cc1csc(C2CC2)n1)c1ccc(F)cc1Cl ZINC000076761740 185039628 /nfs/dbraw/zinc/03/96/28/185039628.db2.gz RMLNOEVBASTNCN-VIFPVBQESA-N 1 2 310.825 4.664 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1Cl)c1cccnc1Cl ZINC000090180395 185285254 /nfs/dbraw/zinc/28/52/54/185285254.db2.gz YGTREMOLNCKCLD-NXEZZACHSA-N 1 2 313.203 4.939 20 0 DJADLO Cc1cc(C)c(NC(=O)c2cc(Cl)sc2Cl)c(C)[nH+]1 ZINC000097040284 185401719 /nfs/dbraw/zinc/40/17/19/185401719.db2.gz YTEJYHGGOUFHFU-UHFFFAOYSA-N 1 2 315.225 4.627 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1nccs1)c1cc(Cl)ccc1Cl ZINC000080266451 192018997 /nfs/dbraw/zinc/01/89/97/192018997.db2.gz QHFULOKPYVRMLD-BDAKNGLRSA-N 1 2 301.242 4.862 20 0 DJADLO Cc1nc(C[NH2+][C@H](C)c2ccc(Cl)cc2Cl)cs1 ZINC000021024454 182261565 /nfs/dbraw/zinc/26/15/65/182261565.db2.gz SHQTYPZDDUNRJK-MRVPVSSYSA-N 1 2 301.242 4.609 20 0 DJADLO Fc1cc2[nH+]cn(Cc3ccc(Cl)c(Cl)c3)c2cc1F ZINC000024426386 182380208 /nfs/dbraw/zinc/38/02/08/182380208.db2.gz RWKWJWRLPNHNRS-UHFFFAOYSA-N 1 2 313.134 4.670 20 0 DJADLO CCc1c2ccccc2oc1[C@@H](C)[NH2+][C@@H](C)c1cscn1 ZINC000563827399 335033578 /nfs/dbraw/zinc/03/35/78/335033578.db2.gz WKQRMACPWGQRLW-NWDGAFQWSA-N 1 2 300.427 4.864 20 0 DJADLO Cc1ccc(N[C@H](Cc2cccnc2)c2cccc(Cl)c2)c[nH+]1 ZINC000426039804 335043807 /nfs/dbraw/zinc/04/38/07/335043807.db2.gz PUAQPGOGANHMCY-LJQANCHMSA-N 1 2 323.827 4.834 20 0 DJADLO COc1ccc(C)cc1[C@H](C)[NH2+][C@H](C)c1nc2ccccc2o1 ZINC000272139606 130002644 /nfs/dbraw/zinc/00/26/44/130002644.db2.gz ZLERYLLDUNWNBM-UONOGXRCSA-N 1 2 310.397 4.557 20 0 DJADLO C[C@@H](Nc1ccc(-c2[nH+]cc3n2CCCC3)cc1)c1cscn1 ZINC000272320819 130021230 /nfs/dbraw/zinc/02/12/30/130021230.db2.gz BJMSPLUPUFKVPU-CYBMUJFWSA-N 1 2 324.453 4.516 20 0 DJADLO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(SC(C)C)cc2)s1 ZINC000274133958 130209970 /nfs/dbraw/zinc/20/99/70/130209970.db2.gz CFGPJLVZMAVRLZ-RYUDHWBXSA-N 1 2 321.515 4.759 20 0 DJADLO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2cc3cc(C)c(C)cc3o2)s1 ZINC000274218158 130219818 /nfs/dbraw/zinc/21/98/18/130219818.db2.gz NSUUYYVEBPSLTP-VXGBXAGGSA-N 1 2 315.442 4.621 20 0 DJADLO Cc1ccnc([C@H](C)[NH2+]Cc2nc3cc(Cl)ccc3s2)c1 ZINC000285992971 131214193 /nfs/dbraw/zinc/21/41/93/131214193.db2.gz IDWFYMXCGISREI-NSHDSACASA-N 1 2 317.845 4.504 20 0 DJADLO Cc1ccnc([C@@H](C)[NH2+]Cc2nc3cc(Cl)ccc3s2)c1 ZINC000285992965 131214526 /nfs/dbraw/zinc/21/45/26/131214526.db2.gz IDWFYMXCGISREI-LLVKDONJSA-N 1 2 317.845 4.504 20 0 DJADLO CC[C@@H](C)N(Cc1ccccc1)C(=O)Nc1c(C)cc[nH+]c1C ZINC000287596183 131289417 /nfs/dbraw/zinc/28/94/17/131289417.db2.gz RTGNDGNWNCKCBB-OAHLLOKOSA-N 1 2 311.429 4.531 20 0 DJADLO CC[C@@H](c1ccccc1)N(CC)C(=O)Nc1c(C)cc[nH+]c1C ZINC000287672298 131294746 /nfs/dbraw/zinc/29/47/46/131294746.db2.gz XTISEEXDINMDFL-KRWDZBQOSA-N 1 2 311.429 4.704 20 0 DJADLO Cc1nc([C@H](C)[NH2+][C@@H](C)c2ccc(Oc3ccccc3)cc2)no1 ZINC000289372568 131380177 /nfs/dbraw/zinc/38/01/77/131380177.db2.gz OPZMMPOZLHLXQH-KBPBESRZSA-N 1 2 323.396 4.582 20 0 DJADLO CSc1ccc([C@H](C)[NH2+]Cc2cc(C(C)(C)C)on2)cc1 ZINC000289430310 131385444 /nfs/dbraw/zinc/38/54/44/131385444.db2.gz RUUZXWXRULHNSP-LBPRGKRZSA-N 1 2 304.459 4.545 20 0 DJADLO Cc1nc(C(=O)Nc2c3ccccc3[nH+]c(C)c2C(C)C)c(C)o1 ZINC000298002380 132044445 /nfs/dbraw/zinc/04/44/45/132044445.db2.gz KFZVGPWLAZUJRQ-UHFFFAOYSA-N 1 2 323.396 4.524 20 0 DJADLO c1cc(-c2nc3ccccc3s2)oc1CNc1cccc[nH+]1 ZINC000042677741 132151357 /nfs/dbraw/zinc/15/13/57/132151357.db2.gz YSVFCVZDGZKAKQ-UHFFFAOYSA-N 1 2 307.378 4.563 20 0 DJADLO CC[C@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1ccccc1F ZINC000180390311 331568106 /nfs/dbraw/zinc/56/81/06/331568106.db2.gz PWNHZDTULUBPEK-SFHVURJKSA-N 1 2 310.372 4.722 20 0 DJADLO Clc1sccc1C[NH2+][C@H](c1ccccc1)c1ccncc1 ZINC000312748191 331726520 /nfs/dbraw/zinc/72/65/20/331726520.db2.gz CRGFDEOSKVQYFJ-MRXNPFEDSA-N 1 2 314.841 4.676 20 0 DJADLO FC(F)(F)C[C@@H]1CCN(c2cc[nH+]c3c(Cl)cccc23)C1 ZINC000557683970 331808271 /nfs/dbraw/zinc/80/82/71/331808271.db2.gz PAPNXIPTKOBGNF-JTQLQIEISA-N 1 2 314.738 4.667 20 0 DJADLO Clc1cccc2c(N[C@@H]3CCCC34CCOCC4)cc[nH+]c12 ZINC000557685807 331808532 /nfs/dbraw/zinc/80/85/32/331808532.db2.gz FNDQPVWRIWOSKS-MRXNPFEDSA-N 1 2 316.832 4.649 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1cscn1)c1cc2cc(Cl)ccc2o1 ZINC000569338540 331889160 /nfs/dbraw/zinc/88/91/60/331889160.db2.gz DNJDJVRXXNLOGX-VHSXEESVSA-N 1 2 306.818 4.955 20 0 DJADLO CC(C)([NH2+]Cc1ccc(Oc2ccccc2)o1)c1nccs1 ZINC000180959383 332169166 /nfs/dbraw/zinc/16/91/66/332169166.db2.gz JCFRBGSEBLONBC-UHFFFAOYSA-N 1 2 314.410 4.553 20 0 DJADLO CC[C@@H]([NH2+]Cc1ccc(Oc2ccccc2)o1)c1nccs1 ZINC000180966454 332170330 /nfs/dbraw/zinc/17/03/30/332170330.db2.gz QPYYJHDIHFKRFW-OAHLLOKOSA-N 1 2 314.410 4.769 20 0 DJADLO Cc1c[nH]c(-c2ccccc2NC(=O)CCCC2CCCC2)[nH+]1 ZINC000427189249 332182639 /nfs/dbraw/zinc/18/26/39/332182639.db2.gz KFSTVNPZGUYTLZ-UHFFFAOYSA-N 1 2 311.429 4.684 20 0 DJADLO Clc1ccc(Cl)c(C[N@H+](Cc2ccncc2)C2CC2)c1 ZINC000536452782 332248399 /nfs/dbraw/zinc/24/83/99/332248399.db2.gz HPTGPUZFAWSNRI-UHFFFAOYSA-N 1 2 307.224 4.553 20 0 DJADLO Clc1ccc(Cl)c(C[N@@H+](Cc2ccncc2)C2CC2)c1 ZINC000536452782 332248400 /nfs/dbraw/zinc/24/84/00/332248400.db2.gz HPTGPUZFAWSNRI-UHFFFAOYSA-N 1 2 307.224 4.553 20 0 DJADLO Cn1cccc1[C@H]1CCCC[N@@H+]1Cc1csc(C(C)(C)C)n1 ZINC000531104764 332263831 /nfs/dbraw/zinc/26/38/31/332263831.db2.gz YADIZMDCDCALAQ-MRXNPFEDSA-N 1 2 317.502 4.506 20 0 DJADLO Cn1cccc1[C@H]1CCCC[N@H+]1Cc1csc(C(C)(C)C)n1 ZINC000531104764 332263833 /nfs/dbraw/zinc/26/38/33/332263833.db2.gz YADIZMDCDCALAQ-MRXNPFEDSA-N 1 2 317.502 4.506 20 0 DJADLO COC[C@@H]([NH2+][C@@H](C)c1cc2ccc(C)cc2o1)c1ccc(C)o1 ZINC000426071659 335098598 /nfs/dbraw/zinc/09/85/98/335098598.db2.gz UGOPUBGDRICJGE-GOEBONIOSA-N 1 2 313.397 4.681 20 0 DJADLO CCCc1ccc([C@@H]([NH2+]Cc2nnsc2Cl)C(C)C)cc1 ZINC000096982054 332299673 /nfs/dbraw/zinc/29/96/73/332299673.db2.gz JTVUVGOQDGHJRU-HNNXBMFYSA-N 1 2 323.893 4.631 20 0 DJADLO CC(C)c1cnc(C[N@@H+]2CC3(CCC3)[C@H]2c2ccccc2)s1 ZINC000560569181 332360832 /nfs/dbraw/zinc/36/08/32/332360832.db2.gz SXQLSQCMKVBCIM-GOSISDBHSA-N 1 2 312.482 4.994 20 0 DJADLO CC(C)c1cnc(C[N@H+]2CC3(CCC3)[C@H]2c2ccccc2)s1 ZINC000560569181 332360834 /nfs/dbraw/zinc/36/08/34/332360834.db2.gz SXQLSQCMKVBCIM-GOSISDBHSA-N 1 2 312.482 4.994 20 0 DJADLO CC(C)c1nc(N2CCC[C@@H]2c2ccccn2)cc(C(C)(C)C)[nH+]1 ZINC000562422406 332592114 /nfs/dbraw/zinc/59/21/14/332592114.db2.gz VVYWKRPLDGKHKA-MRXNPFEDSA-N 1 2 324.472 4.634 20 0 DJADLO Cc1nc([C@@H](C)[N@@H+]2CCC[C@@H]2CF)oc1-c1ccc(Cl)cc1 ZINC000580219565 333020132 /nfs/dbraw/zinc/02/01/32/333020132.db2.gz RBYNPJNVJOKXER-IUODEOHRSA-N 1 2 322.811 4.798 20 0 DJADLO Cc1nc([C@@H](C)[N@H+]2CCC[C@@H]2CF)oc1-c1ccc(Cl)cc1 ZINC000580219565 333020133 /nfs/dbraw/zinc/02/01/33/333020133.db2.gz RBYNPJNVJOKXER-IUODEOHRSA-N 1 2 322.811 4.798 20 0 DJADLO CCO[C@H](C)c1nc(C[NH2+][C@H](C)c2ccc(C)c(F)c2)cs1 ZINC000181368451 333029409 /nfs/dbraw/zinc/02/94/09/333029409.db2.gz SFZHYQKSRFKKPR-CHWSQXEVSA-N 1 2 322.449 4.539 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)no1)c1cc2ccccc2o1 ZINC000182628320 333043565 /nfs/dbraw/zinc/04/35/65/333043565.db2.gz PVAAPGZQFLWHLG-NEPJUHHUSA-N 1 2 313.401 4.525 20 0 DJADLO CC[C@@H](C)Oc1cccc(NCc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000378910934 333063097 /nfs/dbraw/zinc/06/30/97/333063097.db2.gz SJGGCGOFIONADP-MRXNPFEDSA-N 1 2 321.424 4.662 20 0 DJADLO Cc1nc(C(C)(C)[NH2+]Cc2cc(F)ccc2Cl)sc1C ZINC000189200774 333065986 /nfs/dbraw/zinc/06/59/86/333065986.db2.gz XPMLHHJGUASQHS-UHFFFAOYSA-N 1 2 312.841 4.577 20 0 DJADLO FC(F)(F)c1cccc(CNc2ccc3ccccc3[nH+]2)c1 ZINC000314160087 333089852 /nfs/dbraw/zinc/08/98/52/333089852.db2.gz XKYFSICWEKZERD-UHFFFAOYSA-N 1 2 302.299 4.866 20 0 DJADLO CCOc1cc(C)ccc1N[C@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC000391833491 335120472 /nfs/dbraw/zinc/12/04/72/335120472.db2.gz PPCYTHAKKIVXDP-MRXNPFEDSA-N 1 2 321.424 4.753 20 0 DJADLO CCOc1cc(C)ccc1N[C@@H](C)c1ccc(-n2cc[nH+]c2)cc1 ZINC000391833489 335120496 /nfs/dbraw/zinc/12/04/96/335120496.db2.gz PPCYTHAKKIVXDP-INIZCTEOSA-N 1 2 321.424 4.753 20 0 DJADLO Cc1ccc(N[C@H](C)c2csc(-c3ccccc3F)n2)c[nH+]1 ZINC000462820803 333118998 /nfs/dbraw/zinc/11/89/98/333118998.db2.gz ZFWVAHVUOGLRQJ-GFCCVEGCSA-N 1 2 313.401 4.826 20 0 DJADLO Clc1ccccc1SCc1[nH+]ccn1Cc1ccccc1 ZINC000497322720 333236121 /nfs/dbraw/zinc/23/61/21/333236121.db2.gz SKPGNUOJVXPIDK-UHFFFAOYSA-N 1 2 314.841 4.877 20 0 DJADLO C[N@H+](Cc1ccoc1)Cc1csc(-c2ccc(Cl)cc2)n1 ZINC000497474478 333254665 /nfs/dbraw/zinc/25/46/65/333254665.db2.gz NIGDDVHLKBGVFN-UHFFFAOYSA-N 1 2 318.829 4.689 20 0 DJADLO C[N@@H+](Cc1ccoc1)Cc1csc(-c2ccc(Cl)cc2)n1 ZINC000497474478 333254666 /nfs/dbraw/zinc/25/46/66/333254666.db2.gz NIGDDVHLKBGVFN-UHFFFAOYSA-N 1 2 318.829 4.689 20 0 DJADLO C[C@H](c1ccc(F)c(Cl)c1)[N@@H+]1CCO[C@H](c2ccccc2)C1 ZINC000497590088 333266360 /nfs/dbraw/zinc/26/63/60/333266360.db2.gz AABFTXYIFCXJNA-ACJLOTCBSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@H](c1ccc(F)c(Cl)c1)[N@H+]1CCO[C@H](c2ccccc2)C1 ZINC000497590088 333266361 /nfs/dbraw/zinc/26/63/61/333266361.db2.gz AABFTXYIFCXJNA-ACJLOTCBSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@@H](c1ccc(Cl)cc1)[N@@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000497590737 333266511 /nfs/dbraw/zinc/26/65/11/333266511.db2.gz MVCGJMCUVSLJQW-SCLBCKFNSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@@H](c1ccc(Cl)cc1)[N@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000497590737 333266513 /nfs/dbraw/zinc/26/65/13/333266513.db2.gz MVCGJMCUVSLJQW-SCLBCKFNSA-N 1 2 319.807 4.614 20 0 DJADLO Cc1nnc([C@H](C)[NH2+]Cc2sc3ccccc3c2Cl)s1 ZINC000273571925 333388483 /nfs/dbraw/zinc/38/84/83/333388483.db2.gz GPJXGPMMTFRPIU-QMMMGPOBSA-N 1 2 323.874 4.565 20 0 DJADLO C[C@@H](Nc1ccc(N2CCCC2)[nH+]c1)c1cc2ccccc2o1 ZINC000319742254 333401803 /nfs/dbraw/zinc/40/18/03/333401803.db2.gz SQNWOUOIQMHBGR-CQSZACIVSA-N 1 2 307.397 4.601 20 0 DJADLO C[C@H](Nc1cccc(-n2cc[nH+]c2)c1)c1cc2ccccc2o1 ZINC000319929648 333418457 /nfs/dbraw/zinc/41/84/57/333418457.db2.gz ALDFCOAFMDBYGL-AWEZNQCLSA-N 1 2 303.365 4.792 20 0 DJADLO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2Cl)s1 ZINC000274262771 333485828 /nfs/dbraw/zinc/48/58/28/333485828.db2.gz VDPYUJPANUPRKC-YUMQZZPRSA-N 1 2 316.257 4.565 20 0 DJADLO Cc1[nH]c(CN[C@@H](c2c(Cl)cccc2Cl)C2CC2)[nH+]c1C ZINC000563442093 333607406 /nfs/dbraw/zinc/60/74/06/333607406.db2.gz WJYLPHDPWKXFHH-MRXNPFEDSA-N 1 2 324.255 4.574 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1ccc(-c2cccs2)cc1)c1csnn1 ZINC000414294083 333935036 /nfs/dbraw/zinc/93/50/36/333935036.db2.gz DEFDGYWLLSPAEF-VXGBXAGGSA-N 1 2 315.467 4.678 20 0 DJADLO Cc1nc2ccc(CNc3ccc4c(c3)CCC[NH2+]4)cc2s1 ZINC000414855503 334128502 /nfs/dbraw/zinc/12/85/02/334128502.db2.gz WUTWTKGWXMIUPQ-UHFFFAOYSA-N 1 2 309.438 4.575 20 0 DJADLO Cc1ccc([C@H]2CCCC[N@@H+]2Cc2nc(C3CC3)cs2)o1 ZINC000343563501 335178109 /nfs/dbraw/zinc/17/81/09/335178109.db2.gz ZKMSWHNTOLGJJZ-OAHLLOKOSA-N 1 2 302.443 4.649 20 0 DJADLO Cc1ccc([C@H]2CCCC[N@H+]2Cc2nc(C3CC3)cs2)o1 ZINC000343563501 335178110 /nfs/dbraw/zinc/17/81/10/335178110.db2.gz ZKMSWHNTOLGJJZ-OAHLLOKOSA-N 1 2 302.443 4.649 20 0 DJADLO CCn1cc[nH+]c1[C@@H](C)Nc1ccc(OC(C)C)c(Cl)c1 ZINC000297066684 334239193 /nfs/dbraw/zinc/23/91/93/334239193.db2.gz WDKHUYJDCFTNMM-GFCCVEGCSA-N 1 2 307.825 4.517 20 0 DJADLO CSc1cccc(C)c1NCc1cn2cc(Cl)ccc2[nH+]1 ZINC000471957840 334343407 /nfs/dbraw/zinc/34/34/07/334343407.db2.gz KYZJNQFOJUPNFY-UHFFFAOYSA-N 1 2 317.845 4.630 20 0 DJADLO c1sc(-c2ccccc2)nc1C[N@@H+]1CCC[C@H]1c1ccccn1 ZINC000535067616 334363007 /nfs/dbraw/zinc/36/30/07/334363007.db2.gz RSXLRJYEOZFMIY-SFHVURJKSA-N 1 2 321.449 4.542 20 0 DJADLO c1sc(-c2ccccc2)nc1C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000535067616 334363008 /nfs/dbraw/zinc/36/30/08/334363008.db2.gz RSXLRJYEOZFMIY-SFHVURJKSA-N 1 2 321.449 4.542 20 0 DJADLO CC[C@@H](C)[C@@H]([NH2+]Cc1nnc(C(C)C)o1)c1ccc(Cl)cc1 ZINC000341916413 334492044 /nfs/dbraw/zinc/49/20/44/334492044.db2.gz YGCYHWRHJDEKTH-MLGOLLRUSA-N 1 2 321.852 4.723 20 0 DJADLO CC(C)c1ccc(N[C@H](c2[nH]cc[nH+]2)c2ccc(F)cc2)cc1 ZINC000188313229 334684777 /nfs/dbraw/zinc/68/47/77/334684777.db2.gz FYAAOUJOUIYLPI-SFHVURJKSA-N 1 2 309.388 4.874 20 0 DJADLO Cc1ccc(F)c(NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)c1 ZINC000112627396 334720088 /nfs/dbraw/zinc/72/00/88/334720088.db2.gz IBGIWOUEMWNXIJ-UHFFFAOYSA-N 1 2 322.339 4.574 20 0 DJADLO c1ccc(-c2noc(-c3cccc(Oc4cc[nH+]cc4)c3)n2)cc1 ZINC000535387175 334726437 /nfs/dbraw/zinc/72/64/37/334726437.db2.gz DYASEFDREQINSQ-UHFFFAOYSA-N 1 2 315.332 4.591 20 0 DJADLO C[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1c(F)cccc1Cl ZINC000343688053 335188397 /nfs/dbraw/zinc/18/83/97/335188397.db2.gz KGLBHMZSPDRVEI-VIFPVBQESA-N 1 2 310.825 4.664 20 0 DJADLO C[C@@H]1c2ccc(F)cc2C[C@H](C)[N@H+]1Cc1nc(C2CC2)cs1 ZINC000343744974 335190287 /nfs/dbraw/zinc/19/02/87/335190287.db2.gz VWIBRRIUFARYHI-NWDGAFQWSA-N 1 2 316.445 4.667 20 0 DJADLO C[C@@H]1c2ccc(F)cc2C[C@H](C)[N@@H+]1Cc1nc(C2CC2)cs1 ZINC000343744974 335190289 /nfs/dbraw/zinc/19/02/89/335190289.db2.gz VWIBRRIUFARYHI-NWDGAFQWSA-N 1 2 316.445 4.667 20 0 DJADLO Cc1cc2cc(CNc3[nH+]ccc4ccc(F)cc43)ccc2[nH]1 ZINC000343878779 335199513 /nfs/dbraw/zinc/19/95/13/335199513.db2.gz XJHNGDNDJULHQA-UHFFFAOYSA-N 1 2 305.356 4.776 20 0 DJADLO Cc1[nH]ncc1C[NH2+][C@@H](CC(C)(C)C)c1ccc(Cl)cc1 ZINC000344302869 335238749 /nfs/dbraw/zinc/23/87/49/335238749.db2.gz LIHLYSAAJAAKBX-INIZCTEOSA-N 1 2 305.853 4.639 20 0 DJADLO COCC[C@@H]([NH2+][C@H](C)c1csc(C(C)C)n1)c1ccc(C)o1 ZINC000346543398 335420003 /nfs/dbraw/zinc/42/00/03/335420003.db2.gz OKOUAHTZGGWPDI-ZIAGYGMSSA-N 1 2 322.474 4.596 20 0 DJADLO C[C@@H](Sc1ccccc1)c1ccc(NCc2c[nH+]cn2C)cc1 ZINC000347768803 335523811 /nfs/dbraw/zinc/52/38/11/335523811.db2.gz RVEWTOMGFFGUNS-OAHLLOKOSA-N 1 2 323.465 4.886 20 0 DJADLO Fc1ccc([C@@H](SCCn2cc[nH+]c2)c2ccccc2)cc1 ZINC000535580103 335655624 /nfs/dbraw/zinc/65/56/24/335655624.db2.gz OJYFVYUKGQRQAK-SFHVURJKSA-N 1 2 312.413 4.545 20 0 DJADLO CC(C)COc1ccccc1[C@H](CC(C)C)[NH2+]Cc1cocn1 ZINC000192321619 336031250 /nfs/dbraw/zinc/03/12/50/336031250.db2.gz LXUHZJIEYRPARS-SFHVURJKSA-N 1 2 316.445 4.586 20 0 DJADLO C[C@H]([NH2+]Cc1sccc1Cl)c1ncc(-c2ccccc2)o1 ZINC000367126541 336049358 /nfs/dbraw/zinc/04/93/58/336049358.db2.gz NCAXIHXHRFCCLX-NSHDSACASA-N 1 2 318.829 4.907 20 0 DJADLO CSCc1cnc(C[N@@H+]2CC[C@H](C)C[C@H]2c2ccco2)s1 ZINC000351699885 336059614 /nfs/dbraw/zinc/05/96/14/336059614.db2.gz HECXGNNXYISNST-JSGCOSHPSA-N 1 2 322.499 4.572 20 0 DJADLO CSCc1cnc(C[N@H+]2CC[C@H](C)C[C@H]2c2ccco2)s1 ZINC000351699885 336059616 /nfs/dbraw/zinc/05/96/16/336059616.db2.gz HECXGNNXYISNST-JSGCOSHPSA-N 1 2 322.499 4.572 20 0 DJADLO Cc1c[nH]c(-c2ccccc2NC(=O)[C@@H]2CCCC(C)(C)C2)[nH+]1 ZINC000332061255 336157026 /nfs/dbraw/zinc/15/70/26/336157026.db2.gz QRVMUMYEOUDIDH-CQSZACIVSA-N 1 2 311.429 4.540 20 0 DJADLO CC[C@@H](NC(=O)Nc1c(C)cc[nH+]c1C)c1ccc(Cl)cc1 ZINC000351931716 336180679 /nfs/dbraw/zinc/18/06/79/336180679.db2.gz UANLYCHFVONMPG-OAHLLOKOSA-N 1 2 317.820 4.625 20 0 DJADLO Cc1cnc([C@H](C)[NH2+][C@@H](C)c2ccc(Oc3cccnc3)cc2)o1 ZINC000352250478 336206781 /nfs/dbraw/zinc/20/67/81/336206781.db2.gz OADHVIRNXLORPK-GJZGRUSLSA-N 1 2 323.396 4.582 20 0 DJADLO CC(C)CCCNc1cccc(C[N@H+](C)Cc2cscn2)c1 ZINC000526123704 336219153 /nfs/dbraw/zinc/21/91/53/336219153.db2.gz UYLLEUQYSZESDL-UHFFFAOYSA-N 1 2 317.502 4.623 20 0 DJADLO CC(C)CCCNc1cccc(C[N@@H+](C)Cc2cscn2)c1 ZINC000526123704 336219154 /nfs/dbraw/zinc/21/91/54/336219154.db2.gz UYLLEUQYSZESDL-UHFFFAOYSA-N 1 2 317.502 4.623 20 0 DJADLO c1coc(C2=CCC[N@@H+](Cc3csc(C4CCCC4)n3)C2)c1 ZINC000352551043 336224217 /nfs/dbraw/zinc/22/42/17/336224217.db2.gz UAAANTGFYHFTQM-UHFFFAOYSA-N 1 2 314.454 4.683 20 0 DJADLO c1coc(C2=CCC[N@H+](Cc3csc(C4CCCC4)n3)C2)c1 ZINC000352551043 336224218 /nfs/dbraw/zinc/22/42/18/336224218.db2.gz UAAANTGFYHFTQM-UHFFFAOYSA-N 1 2 314.454 4.683 20 0 DJADLO Fc1cccc2c1CC[C@@H]2[NH2+][C@@H](c1nccs1)c1ccccc1 ZINC000532463789 336249127 /nfs/dbraw/zinc/24/91/27/336249127.db2.gz DUIBFRZXXSMMTN-ZWKOTPCHSA-N 1 2 324.424 4.649 20 0 DJADLO CCc1ccc([C@H](C)[NH2+]Cc2nc3cc(Cl)ccc3s2)o1 ZINC000532465929 336249329 /nfs/dbraw/zinc/24/93/29/336249329.db2.gz XHPILZNFJMUYCR-JTQLQIEISA-N 1 2 320.845 4.956 20 0 DJADLO CCc1nc(C[N@H+](C)[C@H](C)c2ccc(F)c(Cl)c2)cs1 ZINC000532487996 336251800 /nfs/dbraw/zinc/25/18/00/336251800.db2.gz WDVJRHORAHEYKG-SNVBAGLBSA-N 1 2 312.841 4.691 20 0 DJADLO CCc1nc(C[N@@H+](C)[C@H](C)c2ccc(F)c(Cl)c2)cs1 ZINC000532487996 336251801 /nfs/dbraw/zinc/25/18/01/336251801.db2.gz WDVJRHORAHEYKG-SNVBAGLBSA-N 1 2 312.841 4.691 20 0 DJADLO C[C@@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1cc(F)ccc1F ZINC000324827664 336260946 /nfs/dbraw/zinc/26/09/46/336260946.db2.gz HJVISYRUAXTEHI-JLTOFOAXSA-N 1 2 324.374 4.800 20 0 DJADLO Cc1nc(C[N@H+](Cc2ccc(F)cc2F)C2CCCC2)oc1C ZINC000532652620 336265877 /nfs/dbraw/zinc/26/58/77/336265877.db2.gz IKHJFQZYOXYGPB-UHFFFAOYSA-N 1 2 320.383 4.514 20 0 DJADLO Cc1nc(C[N@@H+](Cc2ccc(F)cc2F)C2CCCC2)oc1C ZINC000532652620 336265878 /nfs/dbraw/zinc/26/58/78/336265878.db2.gz IKHJFQZYOXYGPB-UHFFFAOYSA-N 1 2 320.383 4.514 20 0 DJADLO Cc1cc(N[C@H](c2ccccc2)c2ccccn2)nc(C(C)C)[nH+]1 ZINC000301080778 336288927 /nfs/dbraw/zinc/28/89/27/336288927.db2.gz NNRWIDHZAOUYNQ-LJQANCHMSA-N 1 2 318.424 4.505 20 0 DJADLO Cc1cc(N[C@H](C)c2ccc(Cl)cc2)nc(-c2cccnc2)[nH+]1 ZINC000301114889 336290684 /nfs/dbraw/zinc/29/06/84/336290684.db2.gz PGIWMOKPASXYPR-CYBMUJFWSA-N 1 2 324.815 4.674 20 0 DJADLO CCc1cccc2c(C3CCN(c4cccc[nH+]4)CC3)c[nH]c21 ZINC000301116286 336290750 /nfs/dbraw/zinc/29/07/50/336290750.db2.gz PRYHLFNQDYANRV-UHFFFAOYSA-N 1 2 305.425 4.509 20 0 DJADLO COc1ccc2oc([C@H](C)Nc3cc[nH+]c(C4CC4)n3)c(C)c2c1 ZINC000301223191 336295495 /nfs/dbraw/zinc/29/54/95/336295495.db2.gz ACHKMADYHHIEFO-LBPRGKRZSA-N 1 2 323.396 4.590 20 0 DJADLO Cc1cc(N[C@@H](c2ccsc2)c2ccc(Cl)cc2)nc[nH+]1 ZINC000301232915 336295987 /nfs/dbraw/zinc/29/59/87/336295987.db2.gz BPRBBXYZDOOKOM-MRXNPFEDSA-N 1 2 315.829 4.701 20 0 DJADLO Cc1ccsc1[C@@H](Cc1ccccc1)Nc1cc(C)[nH+]cn1 ZINC000301350152 336301909 /nfs/dbraw/zinc/30/19/09/336301909.db2.gz VNLXAUGDZZYASA-MRXNPFEDSA-N 1 2 309.438 4.551 20 0 DJADLO C[C@@H](Nc1cc[nH+]c(C2CC2)n1)c1ccc(-c2ccncc2)cc1 ZINC000301420093 336305551 /nfs/dbraw/zinc/30/55/51/336305551.db2.gz DUMYTWPMYZEIFA-CQSZACIVSA-N 1 2 316.408 4.589 20 0 DJADLO C[C@H](Nc1ccc2ccccc2[nH+]1)c1ccc(-n2cccn2)cc1 ZINC000301432200 336306513 /nfs/dbraw/zinc/30/65/13/336306513.db2.gz JBEAAQCCVWIXRZ-HNNXBMFYSA-N 1 2 314.392 4.594 20 0 DJADLO C[C@H](Nc1cc[nH+]c(C(C)(C)C)n1)c1cccc(OC(F)F)c1 ZINC000301536964 336313281 /nfs/dbraw/zinc/31/32/81/336313281.db2.gz RCGKCGFQDACTPA-NSHDSACASA-N 1 2 321.371 4.549 20 0 DJADLO Cc1cc(N[C@@H]2CCOC3(CCCC3)C2)c2cccc(F)c2[nH+]1 ZINC000301694302 336323843 /nfs/dbraw/zinc/32/38/43/336323843.db2.gz MAVXTXIUNKGHOZ-CQSZACIVSA-N 1 2 314.404 4.586 20 0 DJADLO Cc1nc(C[N@H+](Cc2ccc3ccccc3c2)C2CC2)oc1C ZINC000514100176 336327471 /nfs/dbraw/zinc/32/74/71/336327471.db2.gz TYERGHOVILMFIR-UHFFFAOYSA-N 1 2 306.409 4.609 20 0 DJADLO Cc1nc(C[N@@H+](Cc2ccc3ccccc3c2)C2CC2)oc1C ZINC000514100176 336327472 /nfs/dbraw/zinc/32/74/72/336327472.db2.gz TYERGHOVILMFIR-UHFFFAOYSA-N 1 2 306.409 4.609 20 0 DJADLO Cc1cc(NCc2cccc(-c3ccccn3)c2)nc(C(C)C)[nH+]1 ZINC000301797385 336330660 /nfs/dbraw/zinc/33/06/60/336330660.db2.gz QYSMBUNCMOBLNE-UHFFFAOYSA-N 1 2 318.424 4.583 20 0 DJADLO Cc1noc(C)c1[C@@H](C)CNc1cc(C(C)C)[nH+]c(C(C)C)n1 ZINC000301847339 336333864 /nfs/dbraw/zinc/33/38/64/336333864.db2.gz BLLJCOKQXOFAPS-LBPRGKRZSA-N 1 2 316.449 4.544 20 0 DJADLO Cc1cc(N2C[C@@H](C)C[C@@H]2c2cccnc2)c2cccc(F)c2[nH+]1 ZINC000302134664 336350199 /nfs/dbraw/zinc/35/01/99/336350199.db2.gz LWYGQEMETXNMJB-SCLBCKFNSA-N 1 2 321.399 4.665 20 0 DJADLO COc1cccc2c(N3CCC[C@@H]3c3cccs3)cc[nH+]c12 ZINC000302483499 336359717 /nfs/dbraw/zinc/35/97/17/336359717.db2.gz XACRBOKWWYUAOB-OAHLLOKOSA-N 1 2 310.422 4.646 20 0 DJADLO CC(C)c1noc(C[N@H+](Cc2ccc3ccccc3c2)C2CC2)n1 ZINC000514106566 336361253 /nfs/dbraw/zinc/36/12/53/336361253.db2.gz ZKDDWTDNIXMWHV-UHFFFAOYSA-N 1 2 321.424 4.511 20 0 DJADLO CC(C)c1noc(C[N@@H+](Cc2ccc3ccccc3c2)C2CC2)n1 ZINC000514106566 336361254 /nfs/dbraw/zinc/36/12/54/336361254.db2.gz ZKDDWTDNIXMWHV-UHFFFAOYSA-N 1 2 321.424 4.511 20 0 DJADLO Cc1cnc([C@H](C)Nc2cc(C(C)(C)C)[nH+]c(C(C)C)n2)s1 ZINC000302879492 336372980 /nfs/dbraw/zinc/37/29/80/336372980.db2.gz GWTHBIOCSHIISZ-LBPRGKRZSA-N 1 2 318.490 4.836 20 0 DJADLO Cc1ccc(CSc2nc(-c3ccc(F)cc3)c[nH]2)c(C)[nH+]1 ZINC000358607296 336636611 /nfs/dbraw/zinc/63/66/11/336636611.db2.gz JZLRDUNACXLONO-UHFFFAOYSA-N 1 2 313.401 4.520 20 0 DJADLO Cc1cc([C@H](C)[NH2+][C@H](c2ccccc2)c2ccccn2)oc1C ZINC000374317015 336987043 /nfs/dbraw/zinc/98/70/43/336987043.db2.gz QETVTFULECHVLN-MGPUTAFESA-N 1 2 306.409 4.732 20 0 DJADLO Cc1cc([C@@H](C)[NH2+][C@@H](c2ccccc2)c2ccccn2)oc1C ZINC000374317016 336987048 /nfs/dbraw/zinc/98/70/48/336987048.db2.gz QETVTFULECHVLN-QRWLVFNGSA-N 1 2 306.409 4.732 20 0 DJADLO Fc1ccc2c(c1)CC[C@H]2[NH2+][C@@H](c1nccs1)c1ccccc1 ZINC000123072534 337035195 /nfs/dbraw/zinc/03/51/95/337035195.db2.gz OORZQLDIAOBXFI-QZTJIDSGSA-N 1 2 324.424 4.649 20 0 DJADLO Cc1ccc([C@H]2CCCN2C(=O)Nc2c(C)cc[nH+]c2C)cc1C ZINC000376644564 337038896 /nfs/dbraw/zinc/03/88/96/337038896.db2.gz IDJQJNQXCFNABK-GOSISDBHSA-N 1 2 323.440 4.684 20 0 DJADLO Cc1cccc([C@H](C)[NH2+][C@H](c2nccs2)c2ccccc2)c1 ZINC000173266765 337133986 /nfs/dbraw/zinc/13/39/86/337133986.db2.gz IHHWJVZYZSFFRV-YJBOKZPZSA-N 1 2 308.450 4.892 20 0 DJADLO COc1cccc([C@H](C)[NH2+][C@@H](c2nccs2)c2ccccc2)c1 ZINC000177270499 337155074 /nfs/dbraw/zinc/15/50/74/337155074.db2.gz WALIIQCTABUPKQ-KBXCAEBGSA-N 1 2 324.449 4.592 20 0 DJADLO COc1cccc([C@H](C)[NH2+][C@H](c2nccs2)c2ccccc2)c1 ZINC000177270469 337155096 /nfs/dbraw/zinc/15/50/96/337155096.db2.gz WALIIQCTABUPKQ-KSSFIOAISA-N 1 2 324.449 4.592 20 0 DJADLO COc1cccc([C@@H](C)[NH2+][C@H](c2nccs2)c2ccccc2)c1 ZINC000177270486 337155133 /nfs/dbraw/zinc/15/51/33/337155133.db2.gz WALIIQCTABUPKQ-KDOFPFPSSA-N 1 2 324.449 4.592 20 0 DJADLO C[C@H]([NH2+][C@H](c1cccc(Cl)c1)c1ccccn1)c1ccoc1 ZINC000178488597 337163139 /nfs/dbraw/zinc/16/31/39/337163139.db2.gz DAAPYCDIFAXSAU-SCLBCKFNSA-N 1 2 312.800 4.768 20 0 DJADLO CC[C@H]([NH2+]Cc1coc(-c2cccs2)n1)c1ccccc1F ZINC000180242894 337175600 /nfs/dbraw/zinc/17/56/00/337175600.db2.gz MWDXMKCRQKMMSZ-HNNXBMFYSA-N 1 2 316.401 4.783 20 0 DJADLO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1ncc(C(C)C)s1)CCC2 ZINC000183070340 337191175 /nfs/dbraw/zinc/19/11/75/337191175.db2.gz VVVIOVOBJNUXJV-CYBMUJFWSA-N 1 2 321.515 4.541 20 0 DJADLO Cc1nc2c(s1)[C@H]([N@H+](C)Cc1ncc(C(C)C)s1)CCC2 ZINC000183070340 337191176 /nfs/dbraw/zinc/19/11/76/337191176.db2.gz VVVIOVOBJNUXJV-CYBMUJFWSA-N 1 2 321.515 4.541 20 0 DJADLO CC(C)c1cnc(C[NH2+][C@H](c2ccco2)c2ccccc2)s1 ZINC000183406052 337191597 /nfs/dbraw/zinc/19/15/97/337191597.db2.gz SHBJCNFCDOMVPF-SFHVURJKSA-N 1 2 312.438 4.739 20 0 DJADLO CCO[C@@H](C)c1nc(CSCc2ccc(C)[nH+]c2C)cs1 ZINC000184824667 337200380 /nfs/dbraw/zinc/20/03/80/337200380.db2.gz QQIVFKUTIOUXHP-ZDUSSCGKSA-N 1 2 322.499 4.686 20 0 DJADLO Cc1ccc(CSCc2csc(-c3ccoc3)n2)c(C)[nH+]1 ZINC000184822760 337200481 /nfs/dbraw/zinc/20/04/81/337200481.db2.gz RLRKNQDHBGWPLE-UHFFFAOYSA-N 1 2 316.451 4.848 20 0 DJADLO COc1ccsc1[C@@H](C)[NH2+][C@@H](c1ccco1)c1ccccc1 ZINC000186088930 337253447 /nfs/dbraw/zinc/25/34/47/337253447.db2.gz ZWAGBJXQEAKBIJ-CXAGYDPISA-N 1 2 313.422 4.790 20 0 DJADLO COc1ccsc1[C@@H](C)[NH2+][C@H](c1ccco1)c1ccccc1 ZINC000186088892 337253491 /nfs/dbraw/zinc/25/34/91/337253491.db2.gz ZWAGBJXQEAKBIJ-DYVFJYSZSA-N 1 2 313.422 4.790 20 0 DJADLO COc1ccsc1[C@H](C)[NH2+][C@H](c1ccco1)c1ccccc1 ZINC000186088871 337253506 /nfs/dbraw/zinc/25/35/06/337253506.db2.gz ZWAGBJXQEAKBIJ-GUYCJALGSA-N 1 2 313.422 4.790 20 0 DJADLO Cc1cc(N)nc(SCc2sc3ccccc3c2Cl)[nH+]1 ZINC000025040654 337294747 /nfs/dbraw/zinc/29/47/47/337294747.db2.gz ICERHTSWNPKHGD-UHFFFAOYSA-N 1 2 321.858 4.528 20 0 DJADLO COc1ccccc1[C@@H]([NH2+][C@@H](C)c1ccccc1)c1ccco1 ZINC000130804798 337434459 /nfs/dbraw/zinc/43/44/59/337434459.db2.gz LNQLEKBHSBOVKS-MGPUTAFESA-N 1 2 307.393 4.728 20 0 DJADLO CC(C)(C)c1nc(C[NH2+][C@@H](CC(F)F)c2ccccc2)cs1 ZINC000420983784 337517458 /nfs/dbraw/zinc/51/74/58/337517458.db2.gz CVSAEIQJLSVHTE-AWEZNQCLSA-N 1 2 324.440 4.927 20 0 DJADLO COc1ccccc1[C@@H]([NH2+][C@H](C)c1cscn1)c1ccccc1 ZINC000536853770 337745675 /nfs/dbraw/zinc/74/56/75/337745675.db2.gz UYJRWFKZJVPNBP-KUHUBIRLSA-N 1 2 324.449 4.592 20 0 DJADLO CC(C)CCOc1cccc(NCc2c[nH+]cn2C(C)C)c1 ZINC000424142215 337765249 /nfs/dbraw/zinc/76/52/49/337765249.db2.gz DPLHHCUGUVRXEN-UHFFFAOYSA-N 1 2 301.434 4.501 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1ncccc1F)c1cc(Cl)ccc1Cl ZINC000528036908 337782558 /nfs/dbraw/zinc/78/25/58/337782558.db2.gz WZLYTWVGXCEZAT-ZJUUUORDSA-N 1 2 313.203 4.939 20 0 DJADLO COc1ccccc1[C@H]([NH2+]Cc1cc(C)cc(C)c1)c1ccco1 ZINC000533187525 337833813 /nfs/dbraw/zinc/83/38/13/337833813.db2.gz KDSSTGIFMOJQAE-NRFANRHFSA-N 1 2 321.420 4.784 20 0 DJADLO COc1ccccc1[C@H]([NH2+][C@H](C)c1cccs1)c1ccccn1 ZINC000090913493 337887124 /nfs/dbraw/zinc/88/71/24/337887124.db2.gz FGJNPBCUXXRPAU-KUHUBIRLSA-N 1 2 324.449 4.592 20 0 DJADLO CCCc1nc(C[NH2+][C@@H](c2ccc(F)cc2F)C(C)C)cs1 ZINC000537123821 337893421 /nfs/dbraw/zinc/89/34/21/337893421.db2.gz KHZONTAWBLSPEL-QGZVFWFLSA-N 1 2 324.440 4.861 20 0 DJADLO COc1ccc(F)cc1[C@H](C)[NH2+][C@H](C)c1c(F)cccc1F ZINC000122335507 337914279 /nfs/dbraw/zinc/91/42/79/337914279.db2.gz WJAIWJUVRCEMSA-WDEREUQCSA-N 1 2 309.331 4.524 20 0 DJADLO Cc1ccsc1[C@H](C)Nc1ccc(N2CCCCC2)c[nH+]1 ZINC000537425318 337935862 /nfs/dbraw/zinc/93/58/62/337935862.db2.gz MVBUKFUURKOITB-AWEZNQCLSA-N 1 2 301.459 4.615 20 0 DJADLO Cc1ccncc1[C@@H](C)Nc1cccc([NH+]2CCCCCC2)c1 ZINC000537533620 337941062 /nfs/dbraw/zinc/94/10/62/337941062.db2.gz PPSSBNJMBAIXEP-QGZVFWFLSA-N 1 2 309.457 4.944 20 0 DJADLO Cc1cccc(CCSCc2coc(-c3cccs3)n2)[nH+]1 ZINC000516468571 338013039 /nfs/dbraw/zinc/01/30/39/338013039.db2.gz YVHIPGHJEVRJSH-UHFFFAOYSA-N 1 2 316.451 4.582 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)c1cccc2c1ccn2CC(C)C ZINC000425595982 338015760 /nfs/dbraw/zinc/01/57/60/338015760.db2.gz KYPFPDOFVWQSQA-UHFFFAOYSA-N 1 2 321.424 4.561 20 0 DJADLO CCC(CC)Oc1ccc(C(=O)Nc2c(C)cc[nH+]c2C)cc1 ZINC000425596790 338015792 /nfs/dbraw/zinc/01/57/92/338015792.db2.gz PGGLTYDSLGLRFS-UHFFFAOYSA-N 1 2 312.413 4.518 20 0 DJADLO Cc1nc(C(C)C)oc1C[N@H+](C)[C@H](C)c1ccccc1Cl ZINC000428458873 338052964 /nfs/dbraw/zinc/05/29/64/338052964.db2.gz LNJBQFHHFWTWTP-CYBMUJFWSA-N 1 2 306.837 4.953 20 0 DJADLO Cc1nc(C(C)C)oc1C[N@@H+](C)[C@H](C)c1ccccc1Cl ZINC000428458873 338052965 /nfs/dbraw/zinc/05/29/65/338052965.db2.gz LNJBQFHHFWTWTP-CYBMUJFWSA-N 1 2 306.837 4.953 20 0 DJADLO C[C@@H]([NH2+]Cc1nc2ccc(F)cc2s1)c1c(F)cccc1F ZINC000428869543 338063625 /nfs/dbraw/zinc/06/36/25/338063625.db2.gz BQZFXCPTJBZYGC-SECBINFHSA-N 1 2 322.355 4.564 20 0 DJADLO CC(C)([NH2+]Cc1cc(-c2ccccc2)on1)c1ccccc1F ZINC000429228282 338073960 /nfs/dbraw/zinc/07/39/60/338073960.db2.gz SBNWNELYCLSDFS-UHFFFAOYSA-N 1 2 310.372 4.506 20 0 DJADLO Cc1ccoc1C[N@H+](C)Cc1coc(-c2ccc(Cl)cc2)n1 ZINC000429369224 338078801 /nfs/dbraw/zinc/07/88/01/338078801.db2.gz BUUBHRHRSXTHAK-UHFFFAOYSA-N 1 2 316.788 4.528 20 0 DJADLO Cc1ccoc1C[N@@H+](C)Cc1coc(-c2ccc(Cl)cc2)n1 ZINC000429369224 338078802 /nfs/dbraw/zinc/07/88/02/338078802.db2.gz BUUBHRHRSXTHAK-UHFFFAOYSA-N 1 2 316.788 4.528 20 0 DJADLO Fc1ccccc1C1([NH2+]Cc2csc(Cl)c2Cl)CC1 ZINC000432225761 338149061 /nfs/dbraw/zinc/14/90/61/338149061.db2.gz FMZDKSPLRXYLLS-UHFFFAOYSA-N 1 2 316.228 4.973 20 0 DJADLO CC[C@@H]([NH2+]Cc1ccc(F)c(Cl)c1Cl)c1nccs1 ZINC000432238066 338149765 /nfs/dbraw/zinc/14/97/65/338149765.db2.gz MRYSDRVHIMLYQX-SNVBAGLBSA-N 1 2 319.232 4.830 20 0 DJADLO COCC[C@@H]([NH2+]Cc1csc(Cl)c1Cl)c1ccco1 ZINC000432255372 338151396 /nfs/dbraw/zinc/15/13/96/338151396.db2.gz BJPWWUZYAFALMC-SNVBAGLBSA-N 1 2 320.241 4.515 20 0 DJADLO CCCCOC1CC[NH+](Cc2csc(Cl)c2Cl)CC1 ZINC000432728575 338164447 /nfs/dbraw/zinc/16/44/47/338164447.db2.gz MVNGRCFPLVQDDM-UHFFFAOYSA-N 1 2 322.301 4.836 20 0 DJADLO Clc1ccc(-c2ccc(NCc3cscn3)[nH+]c2)s1 ZINC000432725907 338164457 /nfs/dbraw/zinc/16/44/57/338164457.db2.gz BUBKWUBKIBWHBD-UHFFFAOYSA-N 1 2 307.831 4.532 20 0 DJADLO CC(C)COC1CC[NH+](Cc2csc(Cl)c2Cl)CC1 ZINC000432740819 338165407 /nfs/dbraw/zinc/16/54/07/338165407.db2.gz YPEZLOHZJMGINA-UHFFFAOYSA-N 1 2 322.301 4.692 20 0 DJADLO Fc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)c(Cl)c1Cl ZINC000432749946 338166289 /nfs/dbraw/zinc/16/62/89/338166289.db2.gz AVSZFYORYFCRMN-CYBMUJFWSA-N 1 2 313.203 4.798 20 0 DJADLO Fc1ccc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)c(Cl)c1Cl ZINC000432749946 338166290 /nfs/dbraw/zinc/16/62/90/338166290.db2.gz AVSZFYORYFCRMN-CYBMUJFWSA-N 1 2 313.203 4.798 20 0 DJADLO C[C@H]([NH2+]Cc1cc(F)c(Cl)cc1F)c1ccc(Cl)cn1 ZINC000433086841 338181040 /nfs/dbraw/zinc/18/10/40/338181040.db2.gz GEOZWRHOYMZKLJ-QMMMGPOBSA-N 1 2 317.166 4.517 20 0 DJADLO c1cn(-c2ccc(CSc3ccc4ccccc4n3)cc2)c[nH+]1 ZINC000448549512 338216503 /nfs/dbraw/zinc/21/65/03/338216503.db2.gz AELRWJZEYASGFA-UHFFFAOYSA-N 1 2 317.417 4.713 20 0 DJADLO CC(=O)c1cc(Cl)c(Cl)cc1OCc1ccc(C)[nH+]c1C ZINC000434751721 338224771 /nfs/dbraw/zinc/22/47/71/338224771.db2.gz IETQURUWMGHIDL-UHFFFAOYSA-N 1 2 324.207 4.787 20 0 DJADLO Fc1ccc(C(F)(F)F)cc1C[N@@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000435770296 338248375 /nfs/dbraw/zinc/24/83/75/338248375.db2.gz OKTADDFEIUJJDW-HNNXBMFYSA-N 1 2 312.310 4.510 20 0 DJADLO Fc1ccc(C(F)(F)F)cc1C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000435770296 338248376 /nfs/dbraw/zinc/24/83/76/338248376.db2.gz OKTADDFEIUJJDW-HNNXBMFYSA-N 1 2 312.310 4.510 20 0 DJADLO CC(C)N(CC1CCC1)C(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000436305584 338268040 /nfs/dbraw/zinc/26/80/40/338268040.db2.gz HTIHXQWPOHQNPC-UHFFFAOYSA-N 1 2 324.424 4.525 20 0 DJADLO CCSCc1cc[nH+]c(N[C@H]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000437802529 338322200 /nfs/dbraw/zinc/32/22/00/338322200.db2.gz REMAIBGPRFGJSW-OLZOCXBDSA-N 1 2 318.408 4.868 20 0 DJADLO Cc1cc(NCc2c[nH+]cn2Cc2ccccc2)ccc1C1CC1 ZINC000438297250 338338936 /nfs/dbraw/zinc/33/89/36/338338936.db2.gz GYNJZOVNQNPDML-UHFFFAOYSA-N 1 2 317.436 4.729 20 0 DJADLO CC(C)c1ccccc1NCc1c[nH+]cn1Cc1ccccc1 ZINC000438308708 338339287 /nfs/dbraw/zinc/33/92/87/338339287.db2.gz WGOLLZOXMTTWSQ-UHFFFAOYSA-N 1 2 305.425 4.667 20 0 DJADLO Cc1ccc(N[C@H](c2ccc(Br)s2)C2CC2)c[nH+]1 ZINC000439133446 338362058 /nfs/dbraw/zinc/36/20/58/338362058.db2.gz SGANELPSJGJAFT-AWEZNQCLSA-N 1 2 323.259 4.777 20 0 DJADLO CC(C)=CC[N@H+](Cc1ncc(C)o1)Cc1ccc(Cl)cc1 ZINC000439483887 338371387 /nfs/dbraw/zinc/37/13/87/338371387.db2.gz BLUNBJQXFDXVRK-UHFFFAOYSA-N 1 2 304.821 4.605 20 0 DJADLO CC(C)=CC[N@@H+](Cc1ncc(C)o1)Cc1ccc(Cl)cc1 ZINC000439483887 338371388 /nfs/dbraw/zinc/37/13/88/338371388.db2.gz BLUNBJQXFDXVRK-UHFFFAOYSA-N 1 2 304.821 4.605 20 0 DJADLO CCCCc1nc(CSCc2cn3ccccc3[nH+]2)cs1 ZINC000439539742 338372664 /nfs/dbraw/zinc/37/26/64/338372664.db2.gz FKMUEONTKLQLMB-UHFFFAOYSA-N 1 2 317.483 4.567 20 0 DJADLO CSc1ccccc1[C@H](C)[NH2+][C@H](C)c1nc(C(C)(C)C)no1 ZINC000440633853 338393342 /nfs/dbraw/zinc/39/33/42/338393342.db2.gz FRFDIIXEQSWEEO-NWDGAFQWSA-N 1 2 319.474 4.501 20 0 DJADLO Oc1cccc(C[NH2+]C2(c3c(Cl)cccc3Cl)CCC2)c1 ZINC000447054970 338543637 /nfs/dbraw/zinc/54/36/37/338543637.db2.gz CKPLEBIRIIGDSF-UHFFFAOYSA-N 1 2 322.235 4.868 20 0 DJADLO CC(C)(C)c1cnc(C[NH2+]Cc2c(F)cccc2Cl)s1 ZINC000447939772 338572184 /nfs/dbraw/zinc/57/21/84/338572184.db2.gz GSKAOFSENLBUJO-UHFFFAOYSA-N 1 2 312.841 4.523 20 0 DJADLO CCCc1ncc(C[NH2+]Cc2ccc(-c3ccc(CC)cc3)o2)o1 ZINC000449612393 338640900 /nfs/dbraw/zinc/64/09/00/338640900.db2.gz LXETXYQUVBXSMV-UHFFFAOYSA-N 1 2 324.424 4.739 20 0 DJADLO CCCc1ncc(CNc2cc[nH+]c3cc(F)c(Cl)cc23)o1 ZINC000450857971 338708811 /nfs/dbraw/zinc/70/88/11/338708811.db2.gz KODHVDZQROWYPG-UHFFFAOYSA-N 1 2 319.767 4.580 20 0 DJADLO Cc1cccc(C[NH2+]C2(c3c(Cl)cccc3Cl)CCC2)n1 ZINC000450880372 338710299 /nfs/dbraw/zinc/71/02/99/338710299.db2.gz XHQFUFGGCODXIZ-UHFFFAOYSA-N 1 2 321.251 4.866 20 0 DJADLO Cc1ccc(-c2cnc(C[NH2+][C@H](C)c3ccc(C)c(F)c3)o2)cc1 ZINC000451162260 338723786 /nfs/dbraw/zinc/72/37/86/338723786.db2.gz ADCVUHXVHZHUEG-OAHLLOKOSA-N 1 2 324.399 4.948 20 0 DJADLO Cc1c(COC(C)(C)C)cccc1N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000453165568 338801726 /nfs/dbraw/zinc/80/17/26/338801726.db2.gz MZIMOAOUDCSTSQ-DYVFJYSZSA-N 1 2 313.445 4.625 20 0 DJADLO CCc1ncc(C[NH2+][C@@H](C)c2cc(F)c(Cl)cc2Cl)o1 ZINC000453341672 338827797 /nfs/dbraw/zinc/82/77/97/338827797.db2.gz CIAMREQRJZDTSK-QMMMGPOBSA-N 1 2 317.191 4.534 20 0 DJADLO C[C@@H]([NH2+]Cc1cnc(C2CC2)o1)c1cccc(Cl)c1Cl ZINC000453366516 338832443 /nfs/dbraw/zinc/83/24/43/338832443.db2.gz RZPOZZVPLGCZRJ-SECBINFHSA-N 1 2 311.212 4.710 20 0 DJADLO Cc1ccc(C)c([C@@H]([NH2+]Cc2cscn2)c2ccccc2)c1 ZINC000195038617 338844668 /nfs/dbraw/zinc/84/46/68/338844668.db2.gz RMJRDACIUBDVTM-IBGZPJMESA-N 1 2 308.450 4.639 20 0 DJADLO Cc1cc(C)c(NC(=O)N(CC2CCCCC2)C2CC2)c(C)[nH+]1 ZINC000455475090 338895686 /nfs/dbraw/zinc/89/56/86/338895686.db2.gz KQBKRKYANBBNRT-UHFFFAOYSA-N 1 2 315.461 4.583 20 0 DJADLO CC[C@@H]([NH2+]Cc1c(F)cc(C)cc1Cl)c1nc(C)cs1 ZINC000459430786 339028821 /nfs/dbraw/zinc/02/88/21/339028821.db2.gz QVROPCTZKONKFV-CQSZACIVSA-N 1 2 312.841 4.793 20 0 DJADLO CC(C)n1ccnc1C[N@@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC000459583687 339037355 /nfs/dbraw/zinc/03/73/55/339037355.db2.gz TUNQKAKIGPSWSE-IBGZPJMESA-N 1 2 309.457 4.581 20 0 DJADLO CC(C)n1ccnc1C[N@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC000459583687 339037356 /nfs/dbraw/zinc/03/73/56/339037356.db2.gz TUNQKAKIGPSWSE-IBGZPJMESA-N 1 2 309.457 4.581 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1cccc(Cl)c1F)c1nc2c(s1)CCC2 ZINC000459631900 339039459 /nfs/dbraw/zinc/03/94/59/339039459.db2.gz LXXLTSGHUSSJBP-UWVGGRQHSA-N 1 2 324.852 4.836 20 0 DJADLO CCC[C@@H]1C[C@H]1C(=O)Nc1ccc(Oc2cc[nH+]cc2)c(C)c1 ZINC000462334737 339076047 /nfs/dbraw/zinc/07/60/47/339076047.db2.gz VIVYYZYMBOLNAD-RHSMWYFYSA-N 1 2 310.397 4.557 20 0 DJADLO Cc1ccc(C[N@@H+](C)[C@@H](C)c2ccc(Cl)cc2Cl)cn1 ZINC000462790689 339088745 /nfs/dbraw/zinc/08/87/45/339088745.db2.gz PXIOKMYSSWJYRD-LBPRGKRZSA-N 1 2 309.240 4.890 20 0 DJADLO Cc1ccc(C[N@H+](C)[C@@H](C)c2ccc(Cl)cc2Cl)cn1 ZINC000462790689 339088746 /nfs/dbraw/zinc/08/87/46/339088746.db2.gz PXIOKMYSSWJYRD-LBPRGKRZSA-N 1 2 309.240 4.890 20 0 DJADLO Cc1ccc(C[N@@H+](C)[C@H](C)c2ccc(Cl)cc2Cl)cn1 ZINC000462790675 339088785 /nfs/dbraw/zinc/08/87/85/339088785.db2.gz PXIOKMYSSWJYRD-GFCCVEGCSA-N 1 2 309.240 4.890 20 0 DJADLO Cc1ccc(C[N@H+](C)[C@H](C)c2ccc(Cl)cc2Cl)cn1 ZINC000462790675 339088786 /nfs/dbraw/zinc/08/87/86/339088786.db2.gz PXIOKMYSSWJYRD-GFCCVEGCSA-N 1 2 309.240 4.890 20 0 DJADLO Cc1nc(N[C@@H](c2cccc(C(F)(F)F)c2)C(C)C)cc[nH+]1 ZINC000462802946 339089829 /nfs/dbraw/zinc/08/98/29/339089829.db2.gz OOTALGJOQNLKIO-OAHLLOKOSA-N 1 2 309.335 4.613 20 0 DJADLO Cc1nc([C@@H](C)[NH2+][C@@H](C)c2oc3ccccc3c2C)cs1 ZINC000462823579 339092320 /nfs/dbraw/zinc/09/23/20/339092320.db2.gz VZAZVYYKVHYGQY-NEPJUHHUSA-N 1 2 300.427 4.918 20 0 DJADLO COc1ccccc1[C@@H](Nc1cccc[nH+]1)c1ccccc1Cl ZINC000462886002 339096246 /nfs/dbraw/zinc/09/62/46/339096246.db2.gz DECWDNBJZDYRJG-IBGZPJMESA-N 1 2 324.811 4.945 20 0 DJADLO COc1ccccc1[C@@H](C)SCc1[nH+]cc(C)c(OC)c1C ZINC000463195680 339108701 /nfs/dbraw/zinc/10/87/01/339108701.db2.gz DWEMJVJJPKMYCN-CQSZACIVSA-N 1 2 317.454 4.710 20 0 DJADLO C[C@@H]1C[C@H](c2ccccc2F)[N@H+](Cc2ncc(C(C)(C)C)o2)C1 ZINC000464727975 339150185 /nfs/dbraw/zinc/15/01/85/339150185.db2.gz BYWOSWDGOZNPBC-CZUORRHYSA-N 1 2 316.420 4.694 20 0 DJADLO C[C@@H]1C[C@H](c2ccccc2F)[N@@H+](Cc2ncc(C(C)(C)C)o2)C1 ZINC000464727975 339150186 /nfs/dbraw/zinc/15/01/86/339150186.db2.gz BYWOSWDGOZNPBC-CZUORRHYSA-N 1 2 316.420 4.694 20 0 DJADLO Cc1cnc(C[N@@H+](C)[C@H](C)c2ccc(-c3ccccc3)cc2)o1 ZINC000464771913 339152459 /nfs/dbraw/zinc/15/24/59/339152459.db2.gz NJGKNHNWPBSGIC-MRXNPFEDSA-N 1 2 306.409 4.843 20 0 DJADLO Cc1cnc(C[N@H+](C)[C@H](C)c2ccc(-c3ccccc3)cc2)o1 ZINC000464771913 339152460 /nfs/dbraw/zinc/15/24/60/339152460.db2.gz NJGKNHNWPBSGIC-MRXNPFEDSA-N 1 2 306.409 4.843 20 0 DJADLO Cc1cccc([C@H]2CCCC[N@H+]2Cc2noc(C(C)C)n2)c1C ZINC000464777107 339152890 /nfs/dbraw/zinc/15/28/90/339152890.db2.gz MDRFWBMANSYIPX-QGZVFWFLSA-N 1 2 313.445 4.537 20 0 DJADLO Cc1cccc([C@H]2CCCC[N@@H+]2Cc2noc(C(C)C)n2)c1C ZINC000464777107 339152891 /nfs/dbraw/zinc/15/28/91/339152891.db2.gz MDRFWBMANSYIPX-QGZVFWFLSA-N 1 2 313.445 4.537 20 0 DJADLO CC[C@@H]1C[N@H+](Cc2csc(C3CCCCC3)n2)CCS1 ZINC000464791236 339154128 /nfs/dbraw/zinc/15/41/28/339154128.db2.gz LUBKVJLNWRERDN-OAHLLOKOSA-N 1 2 310.532 4.518 20 0 DJADLO CC[C@@H]1C[N@@H+](Cc2csc(C3CCCCC3)n2)CCS1 ZINC000464791236 339154129 /nfs/dbraw/zinc/15/41/29/339154129.db2.gz LUBKVJLNWRERDN-OAHLLOKOSA-N 1 2 310.532 4.518 20 0 DJADLO CCCc1nc(C[N@@H+]2CC[C@@H](C)C[C@H]2c2ccco2)cs1 ZINC000464852992 339157915 /nfs/dbraw/zinc/15/79/15/339157915.db2.gz MXWPRQHEBHXAIM-HIFRSBDPSA-N 1 2 304.459 4.662 20 0 DJADLO CCCc1nc(C[N@H+]2CC[C@@H](C)C[C@H]2c2ccco2)cs1 ZINC000464852992 339157916 /nfs/dbraw/zinc/15/79/16/339157916.db2.gz MXWPRQHEBHXAIM-HIFRSBDPSA-N 1 2 304.459 4.662 20 0 DJADLO Fc1ccccc1CSCc1[nH+]ccn1Cc1ccccc1 ZINC000467228493 339228706 /nfs/dbraw/zinc/22/87/06/339228706.db2.gz YNTLQFMZOOTCEP-UHFFFAOYSA-N 1 2 312.413 4.504 20 0 DJADLO Cc1ccc[nH+]c1[C@@H]1CCC[C@H](Nc2cnn([C@H](C)C3CC3)c2)C1 ZINC000467349373 339233164 /nfs/dbraw/zinc/23/31/64/339233164.db2.gz JALOCYBHBQQZMT-NXHRZFHOSA-N 1 2 324.472 4.696 20 0 DJADLO Fc1ccc(N[C@H](c2[nH]cc[nH+]2)c2ccccc2)cc1C1CC1 ZINC000467439510 339238714 /nfs/dbraw/zinc/23/87/14/339238714.db2.gz VSEOWXBRLQTDIH-SFHVURJKSA-N 1 2 307.372 4.628 20 0 DJADLO FC(F)(F)c1ccc(C[N@H+]2CCC[C@H](C(F)(F)F)C2)s1 ZINC000467554296 339242376 /nfs/dbraw/zinc/24/23/76/339242376.db2.gz OVLHFAMPVJPVTM-QMMMGPOBSA-N 1 2 317.298 4.541 20 0 DJADLO FC(F)(F)c1ccc(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)s1 ZINC000467554296 339242377 /nfs/dbraw/zinc/24/23/77/339242377.db2.gz OVLHFAMPVJPVTM-QMMMGPOBSA-N 1 2 317.298 4.541 20 0 DJADLO C[C@H](c1ccc(Cl)cc1Cl)[N@H+](C)Cc1ccc(F)cn1 ZINC000468920821 339274743 /nfs/dbraw/zinc/27/47/43/339274743.db2.gz JCBXMQMXSNYICM-SNVBAGLBSA-N 1 2 313.203 4.721 20 0 DJADLO C[C@H](c1ccc(Cl)cc1Cl)[N@@H+](C)Cc1ccc(F)cn1 ZINC000468920821 339274744 /nfs/dbraw/zinc/27/47/44/339274744.db2.gz JCBXMQMXSNYICM-SNVBAGLBSA-N 1 2 313.203 4.721 20 0 DJADLO FC(F)Oc1ccc[nH+]c1NCc1csc2ccccc12 ZINC000469471533 339290718 /nfs/dbraw/zinc/29/07/18/339290718.db2.gz ZNDQWHPOXWATIK-UHFFFAOYSA-N 1 2 306.337 4.510 20 0 DJADLO CC(C)c1nc([C@H](C)[NH2+]C2(c3ccc(F)cc3)CC2)cs1 ZINC000469781125 339299479 /nfs/dbraw/zinc/29/94/79/339299479.db2.gz SKCRWTKNWRHZBK-LBPRGKRZSA-N 1 2 304.434 4.746 20 0 DJADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000470191424 339313453 /nfs/dbraw/zinc/31/34/53/339313453.db2.gz WHVRGXWSZYNVTO-PSTGCABASA-N 1 2 323.408 4.549 20 0 DJADLO C[C@H](c1ccc(F)c(F)c1)[N@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000470191424 339313454 /nfs/dbraw/zinc/31/34/54/339313454.db2.gz WHVRGXWSZYNVTO-PSTGCABASA-N 1 2 323.408 4.549 20 0 DJADLO C[C@H](c1ccc(F)cc1F)[N@@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000470194445 339313763 /nfs/dbraw/zinc/31/37/63/339313763.db2.gz KJVIYEHTJNOORR-QFSBIZTOSA-N 1 2 323.408 4.549 20 0 DJADLO C[C@H](c1ccc(F)cc1F)[N@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000470194445 339313764 /nfs/dbraw/zinc/31/37/64/339313764.db2.gz KJVIYEHTJNOORR-QFSBIZTOSA-N 1 2 323.408 4.549 20 0 DJADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1csc(C2CCCC2)n1 ZINC000470952048 339332446 /nfs/dbraw/zinc/33/24/46/339332446.db2.gz ZYWIGODDOOFYRY-MFKMUULPSA-N 1 2 318.408 4.573 20 0 DJADLO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1csc(C2CCCC2)n1 ZINC000470952048 339332447 /nfs/dbraw/zinc/33/24/47/339332447.db2.gz ZYWIGODDOOFYRY-MFKMUULPSA-N 1 2 318.408 4.573 20 0 DJADLO CC(C)CCc1nc(C[N@@H+]2CC[C@H](C(F)(F)F)[C@H]2C)cs1 ZINC000470960386 339333115 /nfs/dbraw/zinc/33/31/15/339333115.db2.gz RTKSSGAAEVVPGO-YPMHNXCESA-N 1 2 320.424 4.504 20 0 DJADLO CC(C)CCc1nc(C[N@H+]2CC[C@H](C(F)(F)F)[C@H]2C)cs1 ZINC000470960386 339333116 /nfs/dbraw/zinc/33/31/16/339333116.db2.gz RTKSSGAAEVVPGO-YPMHNXCESA-N 1 2 320.424 4.504 20 0 DJADLO c1cc(-c2nc(C[N@@H+]3CC[C@@H]3c3ccccc3)cs2)cs1 ZINC000471172123 339339533 /nfs/dbraw/zinc/33/95/33/339339533.db2.gz DHMBHQVMEVUSHX-MRXNPFEDSA-N 1 2 312.463 4.819 20 0 DJADLO c1cc(-c2nc(C[N@H+]3CC[C@@H]3c3ccccc3)cs2)cs1 ZINC000471172123 339339534 /nfs/dbraw/zinc/33/95/34/339339534.db2.gz DHMBHQVMEVUSHX-MRXNPFEDSA-N 1 2 312.463 4.819 20 0 DJADLO C[C@H]([NH2+][C@H](CO)c1ccsc1)c1cc(Cl)sc1Cl ZINC000471583000 339348149 /nfs/dbraw/zinc/34/81/49/339348149.db2.gz SJJIMXAGLVXTSX-OIBJUYFYSA-N 1 2 322.282 4.501 20 0 DJADLO C[C@@H]([NH2+][C@H](CO)c1ccsc1)c1cc(Cl)sc1Cl ZINC000471582999 339348074 /nfs/dbraw/zinc/34/80/74/339348074.db2.gz SJJIMXAGLVXTSX-GMSGAONNSA-N 1 2 322.282 4.501 20 0 DJADLO CC(C)[C@H]([NH2+]Cc1ncc(Cl)s1)c1ccc(F)cc1F ZINC000472063256 339361807 /nfs/dbraw/zinc/36/18/07/339361807.db2.gz DDLZUGMZQFRWJU-AWEZNQCLSA-N 1 2 316.804 4.562 20 0 DJADLO Oc1cc(F)cc(CNc2cccc([NH+]3CCCCCC3)c2)c1 ZINC000472066252 339361851 /nfs/dbraw/zinc/36/18/51/339361851.db2.gz REZDNLJHTOKTSY-UHFFFAOYSA-N 1 2 314.404 4.524 20 0 DJADLO CCCCc1nc(C[N@@H+]2CCCC[C@H]2c2cccn2C)cs1 ZINC000472350272 339370503 /nfs/dbraw/zinc/37/05/03/339370503.db2.gz PUWPSLQQVYDLRN-KRWDZBQOSA-N 1 2 317.502 4.551 20 0 DJADLO CCCCc1nc(C[N@H+]2CCCC[C@H]2c2cccn2C)cs1 ZINC000472350272 339370504 /nfs/dbraw/zinc/37/05/04/339370504.db2.gz PUWPSLQQVYDLRN-KRWDZBQOSA-N 1 2 317.502 4.551 20 0 DJADLO C[N@H+](Cc1cc(Cl)cc(Cl)c1)Cc1ccncc1Cl ZINC000472427438 339371606 /nfs/dbraw/zinc/37/16/06/339371606.db2.gz RYKUFWRVGIIKKV-UHFFFAOYSA-N 1 2 315.631 4.674 20 0 DJADLO C[N@@H+](Cc1cc(Cl)cc(Cl)c1)Cc1ccncc1Cl ZINC000472427438 339371607 /nfs/dbraw/zinc/37/16/07/339371607.db2.gz RYKUFWRVGIIKKV-UHFFFAOYSA-N 1 2 315.631 4.674 20 0 DJADLO Clc1cccc([C@H]2CCC[N@@H+]2Cc2ccncc2Cl)c1 ZINC000472435655 339371731 /nfs/dbraw/zinc/37/17/31/339371731.db2.gz YGNLRQNXCZIVCC-MRXNPFEDSA-N 1 2 307.224 4.726 20 0 DJADLO Clc1cccc([C@H]2CCC[N@H+]2Cc2ccncc2Cl)c1 ZINC000472435655 339371732 /nfs/dbraw/zinc/37/17/32/339371732.db2.gz YGNLRQNXCZIVCC-MRXNPFEDSA-N 1 2 307.224 4.726 20 0 DJADLO CC(C)C[N@H+](Cc1ncc(Cl)s1)Cc1ccccc1F ZINC000473137870 339382036 /nfs/dbraw/zinc/38/20/36/339382036.db2.gz JDAXKSCNHUZWLM-UHFFFAOYSA-N 1 2 312.841 4.594 20 0 DJADLO CC(C)C[N@@H+](Cc1ncc(Cl)s1)Cc1ccccc1F ZINC000473137870 339382037 /nfs/dbraw/zinc/38/20/37/339382037.db2.gz JDAXKSCNHUZWLM-UHFFFAOYSA-N 1 2 312.841 4.594 20 0 DJADLO CC(C)(C)c1cnc(C[NH2+]C(C)(C)c2cccc(Cl)c2F)o1 ZINC000473441876 339385346 /nfs/dbraw/zinc/38/53/46/339385346.db2.gz YEIZRBKFOWSRIQ-UHFFFAOYSA-N 1 2 324.827 4.790 20 0 DJADLO COc1c(C)c[nH+]c(CSCCCCOC(C)(C)C)c1C ZINC000473782337 339391931 /nfs/dbraw/zinc/39/19/31/339391931.db2.gz DXNJEXWASDSBRV-UHFFFAOYSA-N 1 2 311.491 4.536 20 0 DJADLO COc1c2ccccc2oc1C[NH2+][C@H](C)c1ccc(F)cc1F ZINC000473784495 339391977 /nfs/dbraw/zinc/39/19/77/339391977.db2.gz GUMHEYAQYDTVLL-LLVKDONJSA-N 1 2 317.335 4.570 20 0 DJADLO Cc1ccc(NC(=O)N2CCCC[C@@H]2CCC(C)C)c(C)[nH+]1 ZINC000473810090 339392567 /nfs/dbraw/zinc/39/25/67/339392567.db2.gz UFAYFHSUWVVTJH-MRXNPFEDSA-N 1 2 303.450 4.521 20 0 DJADLO CCC[C@]1(C(F)(F)F)CCCN1CCCc1ccc(C)[nH+]c1 ZINC000474270979 339407943 /nfs/dbraw/zinc/40/79/43/339407943.db2.gz QCBJNKHGEXTFRF-MRXNPFEDSA-N 1 2 314.395 4.520 20 0 DJADLO Cc1ccc(CCCNc2ccc(CCC(F)(F)F)cc2)c[nH+]1 ZINC000474398337 339412510 /nfs/dbraw/zinc/41/25/10/339412510.db2.gz FPUCKLVVVJXCDC-UHFFFAOYSA-N 1 2 322.374 4.930 20 0 DJADLO CC[C@H]1CCCC[C@H]1C(=O)Nc1ccccc1-c1[nH]cc(C)[nH+]1 ZINC000476391250 339475853 /nfs/dbraw/zinc/47/58/53/339475853.db2.gz UOLSODGVJZOQKC-LSDHHAIUSA-N 1 2 311.429 4.540 20 0 DJADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)CC1(C)CCCCC1 ZINC000477977633 339506643 /nfs/dbraw/zinc/50/66/43/339506643.db2.gz UQFALKRQNIPBID-UHFFFAOYSA-N 1 2 311.429 4.684 20 0 DJADLO Cc1ccc(CNc2ccc(Cl)cc2OC(F)F)c(C)[nH+]1 ZINC000478390172 339514461 /nfs/dbraw/zinc/51/44/61/339514461.db2.gz IZRWCXJSMJATGB-UHFFFAOYSA-N 1 2 312.747 4.565 20 0 DJADLO CC(=O)c1ccc2cc(OCc3ccc(C)[nH+]c3C)ccc2c1 ZINC000478937805 339525059 /nfs/dbraw/zinc/52/50/59/339525059.db2.gz ZFVIPFZBCIJDCJ-UHFFFAOYSA-N 1 2 305.377 4.633 20 0 DJADLO CCN(C)c1ccc(CNc2ccccc2SC(C)C)c[nH+]1 ZINC000480262105 339566031 /nfs/dbraw/zinc/56/60/31/339566031.db2.gz RLGPTVSJYNTMSC-UHFFFAOYSA-N 1 2 315.486 4.650 20 0 DJADLO CCC[C@H](NC(=O)Nc1c(C)cc[nH+]c1C)C1CCCCC1 ZINC000485455467 339703700 /nfs/dbraw/zinc/70/37/00/339703700.db2.gz ZAXHQVWSBHJCSK-INIZCTEOSA-N 1 2 303.450 4.569 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H](C)c1cccc2ccccc21 ZINC000485568093 339706056 /nfs/dbraw/zinc/70/60/56/339706056.db2.gz JBXBXAFPSZRYPD-AWEZNQCLSA-N 1 2 319.408 4.734 20 0 DJADLO CC[C@@H]([NH2+][C@@H](COCC(C)C)c1ccco1)c1ccccc1F ZINC000490190550 339828319 /nfs/dbraw/zinc/82/83/19/339828319.db2.gz JUHMEFKGOKDCHC-MSOLQXFVSA-N 1 2 319.420 4.873 20 0 DJADLO CC(C)(C)c1cnc(C[NH2+]Cc2ccc(C3CC3)cc2F)s1 ZINC000491580423 339867740 /nfs/dbraw/zinc/86/77/40/339867740.db2.gz BFJFMLUHZBMLKE-UHFFFAOYSA-N 1 2 318.461 4.747 20 0 DJADLO CC(C)c1nc(N(C)[C@H](C)c2ccc(C(F)(F)F)cc2)cc[nH+]1 ZINC000498960735 340027093 /nfs/dbraw/zinc/02/70/93/340027093.db2.gz SXNQXMTYVJYNKK-GFCCVEGCSA-N 1 2 323.362 4.816 20 0 DJADLO Cc1ncc(C[N@@H+](C)[C@@H](C)c2ccc(Cl)cc2Cl)s1 ZINC000501267210 340077625 /nfs/dbraw/zinc/07/76/25/340077625.db2.gz RNVJEEDRYYZVEO-VIFPVBQESA-N 1 2 315.269 4.951 20 0 DJADLO Cc1ncc(C[N@H+](C)[C@@H](C)c2ccc(Cl)cc2Cl)s1 ZINC000501267210 340077626 /nfs/dbraw/zinc/07/76/26/340077626.db2.gz RNVJEEDRYYZVEO-VIFPVBQESA-N 1 2 315.269 4.951 20 0 DJADLO CC[N@H+](Cc1nccn1C(C)C)Cc1ccc2ccccc2c1 ZINC000501347668 340078914 /nfs/dbraw/zinc/07/89/14/340078914.db2.gz BEUXHAAPZPSVTQ-UHFFFAOYSA-N 1 2 307.441 4.639 20 0 DJADLO CC[N@@H+](Cc1nccn1C(C)C)Cc1ccc2ccccc2c1 ZINC000501347668 340078915 /nfs/dbraw/zinc/07/89/15/340078915.db2.gz BEUXHAAPZPSVTQ-UHFFFAOYSA-N 1 2 307.441 4.639 20 0 DJADLO C[C@H]([NH2+]Cc1ccc(Cl)o1)c1nc(-c2ccccc2)cs1 ZINC000501351914 340078954 /nfs/dbraw/zinc/07/89/54/340078954.db2.gz QIEQIUPBWDZUNA-NSHDSACASA-N 1 2 318.829 4.907 20 0 DJADLO Cn1cc[nH+]c1CS[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000516586197 340097090 /nfs/dbraw/zinc/09/70/90/340097090.db2.gz NQIBXBIKLFKGKC-SFHVURJKSA-N 1 2 312.413 4.582 20 0 DJADLO CC[C@@H]1C[C@]1([NH2+]Cc1ncc(C(C)(C)C)o1)c1cccc(C)c1 ZINC000502483804 340105706 /nfs/dbraw/zinc/10/57/06/340105706.db2.gz KNYRCSGVZSXZKH-FOIQADDNSA-N 1 2 312.457 4.696 20 0 DJADLO Clc1cccc(Cl)c1C[N@@H+]1CCC[C@@H]1c1ccncc1 ZINC000503180126 340122747 /nfs/dbraw/zinc/12/27/47/340122747.db2.gz GPYYCDUANLIQDA-MRXNPFEDSA-N 1 2 307.224 4.726 20 0 DJADLO Clc1cccc(Cl)c1C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000503180126 340122748 /nfs/dbraw/zinc/12/27/48/340122748.db2.gz GPYYCDUANLIQDA-MRXNPFEDSA-N 1 2 307.224 4.726 20 0 DJADLO Cc1cc([C@@H](C)[NH2+]Cc2ccccc2Oc2ccccc2)no1 ZINC000503262250 340124197 /nfs/dbraw/zinc/12/41/97/340124197.db2.gz QTKWKBIDUUHVJK-OAHLLOKOSA-N 1 2 308.381 4.626 20 0 DJADLO CCCCc1noc(C[NH2+][C@@H](c2ccc(Cl)cc2)C(C)C)n1 ZINC000505287473 340165607 /nfs/dbraw/zinc/16/56/07/340165607.db2.gz LSZQKURAUDXLDK-QGZVFWFLSA-N 1 2 321.852 4.553 20 0 DJADLO Cc1csc(C[NH+](Cc2ccccc2)Cc2ccccc2)n1 ZINC000505338734 340166509 /nfs/dbraw/zinc/16/65/09/340166509.db2.gz QUAKTUQMCPFYEA-UHFFFAOYSA-N 1 2 308.450 4.654 20 0 DJADLO C[C@@H]1C[C@H]1c1ccc(C[NH+](Cc2ccco2)Cc2ccco2)o1 ZINC000506085940 340185261 /nfs/dbraw/zinc/18/52/61/340185261.db2.gz LFSRDQSAAPWLFF-RDTXWAMCSA-N 1 2 311.381 4.791 20 0 DJADLO C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000506258303 340190240 /nfs/dbraw/zinc/19/02/40/340190240.db2.gz HGVHGWNHBTVSJK-GFCCVEGCSA-N 1 2 306.450 4.773 20 0 DJADLO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000506258303 340190241 /nfs/dbraw/zinc/19/02/41/340190241.db2.gz HGVHGWNHBTVSJK-GFCCVEGCSA-N 1 2 306.450 4.773 20 0 DJADLO COc1ccc([C@@H](C)[N@H+](C)Cc2csc(C(C)(C)C)n2)cc1 ZINC000506328411 340192457 /nfs/dbraw/zinc/19/24/57/340192457.db2.gz XWUUTFHPLRLNOO-CYBMUJFWSA-N 1 2 318.486 4.642 20 0 DJADLO COc1ccc([C@@H](C)[N@@H+](C)Cc2csc(C(C)(C)C)n2)cc1 ZINC000506328411 340192458 /nfs/dbraw/zinc/19/24/58/340192458.db2.gz XWUUTFHPLRLNOO-CYBMUJFWSA-N 1 2 318.486 4.642 20 0 DJADLO Fc1ccc(Cl)cc1SCc1[nH+]ccn1CC(F)(F)F ZINC000506381862 340193755 /nfs/dbraw/zinc/19/37/55/340193755.db2.gz PHOBXGWLMAOQTH-UHFFFAOYSA-N 1 2 324.730 4.530 20 0 DJADLO CC(C)c1ncc(C[N@H+](Cc2ccc(F)cc2F)C2CC2)s1 ZINC000506612383 340197606 /nfs/dbraw/zinc/19/76/06/340197606.db2.gz NPJHHUXATAUZQD-UHFFFAOYSA-N 1 2 322.424 4.709 20 0 DJADLO CC(C)c1ncc(C[N@@H+](Cc2ccc(F)cc2F)C2CC2)s1 ZINC000506612383 340197607 /nfs/dbraw/zinc/19/76/07/340197607.db2.gz NPJHHUXATAUZQD-UHFFFAOYSA-N 1 2 322.424 4.709 20 0 DJADLO Fc1ccc([C@H]2CCC[N@@H+]2Cc2cnc(-c3ccccc3)[nH]2)cc1 ZINC000506638348 340198264 /nfs/dbraw/zinc/19/82/64/340198264.db2.gz CXIWOMYFGIHIJH-LJQANCHMSA-N 1 2 321.399 4.553 20 0 DJADLO Fc1ccc([C@H]2CCC[N@H+]2Cc2cnc(-c3ccccc3)[nH]2)cc1 ZINC000506638348 340198265 /nfs/dbraw/zinc/19/82/65/340198265.db2.gz CXIWOMYFGIHIJH-LJQANCHMSA-N 1 2 321.399 4.553 20 0 DJADLO C[C@H](c1nc2ccccc2s1)[N@H+](C)Cc1cc(F)cc(F)c1 ZINC000506707543 340199904 /nfs/dbraw/zinc/19/99/04/340199904.db2.gz OYXCVYGKXRGKIL-LLVKDONJSA-N 1 2 318.392 4.768 20 0 DJADLO C[C@H](c1nc2ccccc2s1)[N@@H+](C)Cc1cc(F)cc(F)c1 ZINC000506707543 340199905 /nfs/dbraw/zinc/19/99/05/340199905.db2.gz OYXCVYGKXRGKIL-LLVKDONJSA-N 1 2 318.392 4.768 20 0 DJADLO CCc1ccc(C[N@H+](C)[C@H](C)c2nc3ccccc3s2)o1 ZINC000506722474 340200163 /nfs/dbraw/zinc/20/01/63/340200163.db2.gz VPUDNSNVCJJGTP-GFCCVEGCSA-N 1 2 300.427 4.645 20 0 DJADLO CCc1ccc(C[N@@H+](C)[C@H](C)c2nc3ccccc3s2)o1 ZINC000506722474 340200164 /nfs/dbraw/zinc/20/01/64/340200164.db2.gz VPUDNSNVCJJGTP-GFCCVEGCSA-N 1 2 300.427 4.645 20 0 DJADLO C[C@@H]1C[C@@H]1c1ccc(C[N@H+](C)Cc2nc3ccccc3s2)o1 ZINC000506732219 340200305 /nfs/dbraw/zinc/20/03/05/340200305.db2.gz VBSFKJQQSGEWAH-OCCSQVGLSA-N 1 2 312.438 4.645 20 0 DJADLO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+](C)Cc2nc3ccccc3s2)o1 ZINC000506732219 340200306 /nfs/dbraw/zinc/20/03/06/340200306.db2.gz VBSFKJQQSGEWAH-OCCSQVGLSA-N 1 2 312.438 4.645 20 0 DJADLO Clc1ccc([C@@H]2CCC[N@@H+]2Cc2cncs2)cc1Cl ZINC000507132209 340208631 /nfs/dbraw/zinc/20/86/31/340208631.db2.gz JNUMWOPGJMMERX-AWEZNQCLSA-N 1 2 313.253 4.787 20 0 DJADLO Clc1ccc([C@@H]2CCC[N@H+]2Cc2cncs2)cc1Cl ZINC000507132209 340208632 /nfs/dbraw/zinc/20/86/32/340208632.db2.gz JNUMWOPGJMMERX-AWEZNQCLSA-N 1 2 313.253 4.787 20 0 DJADLO C[C@H](c1cc(F)ccc1F)[N@H+](C)Cc1cccc(O)c1Cl ZINC000507190629 340212098 /nfs/dbraw/zinc/21/20/98/340212098.db2.gz DYHJDGNUSUGGBB-SNVBAGLBSA-N 1 2 311.759 4.517 20 0 DJADLO C[C@H](c1cc(F)ccc1F)[N@@H+](C)Cc1cccc(O)c1Cl ZINC000507190629 340212099 /nfs/dbraw/zinc/21/20/99/340212099.db2.gz DYHJDGNUSUGGBB-SNVBAGLBSA-N 1 2 311.759 4.517 20 0 DJADLO CC(C)c1ncc(C[N@H+](C)[C@@H](C)c2c(F)cccc2F)s1 ZINC000507235261 340215097 /nfs/dbraw/zinc/21/50/97/340215097.db2.gz UPJFWECTYOKIRI-NSHDSACASA-N 1 2 310.413 4.738 20 0 DJADLO CC(C)c1ncc(C[N@@H+](C)[C@@H](C)c2c(F)cccc2F)s1 ZINC000507235261 340215098 /nfs/dbraw/zinc/21/50/98/340215098.db2.gz UPJFWECTYOKIRI-NSHDSACASA-N 1 2 310.413 4.738 20 0 DJADLO CCC[N@H+](Cc1ncc(CSC)s1)Cc1ccc(F)cc1 ZINC000507313559 340217010 /nfs/dbraw/zinc/21/70/10/340217010.db2.gz XFCCIUYFQSEWIQ-UHFFFAOYSA-N 1 2 324.490 4.557 20 0 DJADLO CCC[N@@H+](Cc1ncc(CSC)s1)Cc1ccc(F)cc1 ZINC000507313559 340217011 /nfs/dbraw/zinc/21/70/11/340217011.db2.gz XFCCIUYFQSEWIQ-UHFFFAOYSA-N 1 2 324.490 4.557 20 0 DJADLO Cc1cc(C[N@@H+](C)Cc2sc3c(cccc3Cl)c2C)no1 ZINC000507369397 340218244 /nfs/dbraw/zinc/21/82/44/340218244.db2.gz FIKQROLJFVXHMJ-UHFFFAOYSA-N 1 2 320.845 4.792 20 0 DJADLO Cc1cc(C[N@H+](C)Cc2sc3c(cccc3Cl)c2C)no1 ZINC000507369397 340218245 /nfs/dbraw/zinc/21/82/45/340218245.db2.gz FIKQROLJFVXHMJ-UHFFFAOYSA-N 1 2 320.845 4.792 20 0 DJADLO Clc1cccc(C[N@H+](Cc2ccncc2)C2CC2)c1Cl ZINC000507440996 340219717 /nfs/dbraw/zinc/21/97/17/340219717.db2.gz LHISVUFYWZLSIN-UHFFFAOYSA-N 1 2 307.224 4.553 20 0 DJADLO Clc1cccc(C[N@@H+](Cc2ccncc2)C2CC2)c1Cl ZINC000507440996 340219718 /nfs/dbraw/zinc/21/97/18/340219718.db2.gz LHISVUFYWZLSIN-UHFFFAOYSA-N 1 2 307.224 4.553 20 0 DJADLO CCc1cccnc1[C@H](C)[NH2+][C@@H](C)c1c(F)cccc1Cl ZINC000507508582 340223262 /nfs/dbraw/zinc/22/32/62/340223262.db2.gz JPJBEZOHXGTSFT-RYUDHWBXSA-N 1 2 306.812 4.848 20 0 DJADLO Cc1csc(C[N@@H+](C)[C@@H](C)c2ccc(Cl)c(Cl)c2)n1 ZINC000507665176 340227709 /nfs/dbraw/zinc/22/77/09/340227709.db2.gz IJUSUFSJMOZSSR-JTQLQIEISA-N 1 2 315.269 4.951 20 0 DJADLO Cc1csc(C[N@H+](C)[C@@H](C)c2ccc(Cl)c(Cl)c2)n1 ZINC000507665176 340227710 /nfs/dbraw/zinc/22/77/10/340227710.db2.gz IJUSUFSJMOZSSR-JTQLQIEISA-N 1 2 315.269 4.951 20 0 DJADLO C[C@H](c1cccc(F)c1)[N@@H+]1CCO[C@H](c2ccccc2Cl)C1 ZINC000507786804 340231445 /nfs/dbraw/zinc/23/14/45/340231445.db2.gz BLNFRURUNVLQOZ-ACJLOTCBSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@H](c1cccc(F)c1)[N@H+]1CCO[C@H](c2ccccc2Cl)C1 ZINC000507786804 340231446 /nfs/dbraw/zinc/23/14/46/340231446.db2.gz BLNFRURUNVLQOZ-ACJLOTCBSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@@H](c1ccc(F)cc1)[N@@H+]1CCO[C@@H](c2ccccc2Cl)C1 ZINC000507789196 340231652 /nfs/dbraw/zinc/23/16/52/340231652.db2.gz SBKRWDOOSSAUET-SCLBCKFNSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@@H](c1ccc(F)cc1)[N@H+]1CCO[C@@H](c2ccccc2Cl)C1 ZINC000507789196 340231653 /nfs/dbraw/zinc/23/16/53/340231653.db2.gz SBKRWDOOSSAUET-SCLBCKFNSA-N 1 2 319.807 4.614 20 0 DJADLO Cc1noc([C@H](C)[NH2+][C@@H](C)c2ccc(Oc3ccccc3)cc2)n1 ZINC000507898171 340235509 /nfs/dbraw/zinc/23/55/09/340235509.db2.gz YGVIGZGQGZATLQ-KBPBESRZSA-N 1 2 323.396 4.582 20 0 DJADLO Cc1cc(C[N@@H+](C)Cc2cccc(-c3ccccc3C)c2)no1 ZINC000508569643 340246832 /nfs/dbraw/zinc/24/68/32/340246832.db2.gz OSGJGCIUMITQMW-UHFFFAOYSA-N 1 2 306.409 4.590 20 0 DJADLO Cc1cc(C[N@H+](C)Cc2cccc(-c3ccccc3C)c2)no1 ZINC000508569643 340246833 /nfs/dbraw/zinc/24/68/33/340246833.db2.gz OSGJGCIUMITQMW-UHFFFAOYSA-N 1 2 306.409 4.590 20 0 DJADLO Cc1cc(C[N@@H+](C)Cc2cccc(-c3ccc(C)cc3)c2)no1 ZINC000508581619 340246862 /nfs/dbraw/zinc/24/68/62/340246862.db2.gz WFXZHOWDJQJDKW-UHFFFAOYSA-N 1 2 306.409 4.590 20 0 DJADLO Cc1cc(C[N@H+](C)Cc2cccc(-c3ccc(C)cc3)c2)no1 ZINC000508581619 340246863 /nfs/dbraw/zinc/24/68/63/340246863.db2.gz WFXZHOWDJQJDKW-UHFFFAOYSA-N 1 2 306.409 4.590 20 0 DJADLO CCc1nc(C)c([C@H](C)[N@H+](C)Cc2cccc(O)c2Cl)s1 ZINC000508725680 340251632 /nfs/dbraw/zinc/25/16/32/340251632.db2.gz MUKIICYRIOEKHU-NSHDSACASA-N 1 2 324.877 4.566 20 0 DJADLO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2cccc(O)c2Cl)s1 ZINC000508725680 340251633 /nfs/dbraw/zinc/25/16/33/340251633.db2.gz MUKIICYRIOEKHU-NSHDSACASA-N 1 2 324.877 4.566 20 0 DJADLO Cc1cc(NC(=O)[C@]2(C)C[C@H]3C[C@H]3C2)ccc1Oc1cc[nH+]cc1 ZINC000508741510 340252141 /nfs/dbraw/zinc/25/21/41/340252141.db2.gz LWDXFCMMEUHSQU-YVWYUNDQSA-N 1 2 322.408 4.557 20 0 DJADLO Cc1ccc([C@H](C)[NH2+]Cc2nc(-c3ccc(C)cc3)cs2)o1 ZINC000508992529 340257545 /nfs/dbraw/zinc/25/75/45/340257545.db2.gz VOGBOXUKNWJOQT-AWEZNQCLSA-N 1 2 312.438 4.871 20 0 DJADLO CCc1ccccc1NC(=O)c1ccccc1Oc1cc[nH+]cc1 ZINC000509014456 340258381 /nfs/dbraw/zinc/25/83/81/340258381.db2.gz KPVHJDOTCRJTJE-UHFFFAOYSA-N 1 2 318.376 4.689 20 0 DJADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2cc(Cl)cc(Cl)c2)on1 ZINC000509779605 340278974 /nfs/dbraw/zinc/27/89/74/340278974.db2.gz BERWYKKATLGZTH-CQSZACIVSA-N 1 2 311.212 4.627 20 0 DJADLO Cc1cc([C@H]2CCC[N@H+]2Cc2cc(Cl)cc(Cl)c2)on1 ZINC000509779605 340278975 /nfs/dbraw/zinc/27/89/75/340278975.db2.gz BERWYKKATLGZTH-CQSZACIVSA-N 1 2 311.212 4.627 20 0 DJADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cccc(Cl)c2Cl)on1 ZINC000509828331 340280793 /nfs/dbraw/zinc/28/07/93/340280793.db2.gz TUMHVUCJLLOWTR-ZDUSSCGKSA-N 1 2 311.212 4.627 20 0 DJADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2cccc(Cl)c2Cl)on1 ZINC000509828331 340280794 /nfs/dbraw/zinc/28/07/94/340280794.db2.gz TUMHVUCJLLOWTR-ZDUSSCGKSA-N 1 2 311.212 4.627 20 0 DJADLO Fc1ccccc1C[N@H+](Cc1coc(-c2ccccc2)n1)C1CC1 ZINC000302753763 340281360 /nfs/dbraw/zinc/28/13/60/340281360.db2.gz JMPWFCWRRYNHSF-UHFFFAOYSA-N 1 2 322.383 4.645 20 0 DJADLO Fc1ccccc1C[N@@H+](Cc1coc(-c2ccccc2)n1)C1CC1 ZINC000302753763 340281361 /nfs/dbraw/zinc/28/13/61/340281361.db2.gz JMPWFCWRRYNHSF-UHFFFAOYSA-N 1 2 322.383 4.645 20 0 DJADLO CC1(C)CCC[C@H](NC(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000510390078 340297664 /nfs/dbraw/zinc/29/76/64/340297664.db2.gz QNQWTWJQDGWVAC-HNNXBMFYSA-N 1 2 324.424 4.573 20 0 DJADLO CC[C@H](CC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1)C(C)C ZINC000303452678 340326344 /nfs/dbraw/zinc/32/63/44/340326344.db2.gz LDTYOHHVXCWCBO-OAHLLOKOSA-N 1 2 312.413 4.885 20 0 DJADLO CC(C)C[C@@H](C)CC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000303455584 340326476 /nfs/dbraw/zinc/32/64/76/340326476.db2.gz MEIYDNVLWDHDJI-OAHLLOKOSA-N 1 2 312.413 4.885 20 0 DJADLO Cc1ccc(-c2nc(C[N@@H+]([C@@H](C)c3ccco3)C3CC3)co2)cc1 ZINC000511780435 340338229 /nfs/dbraw/zinc/33/82/29/340338229.db2.gz HSACITLPPCQUCD-HNNXBMFYSA-N 1 2 322.408 4.969 20 0 DJADLO Cc1ccc(-c2nc(C[N@H+]([C@@H](C)c3ccco3)C3CC3)co2)cc1 ZINC000511780435 340338230 /nfs/dbraw/zinc/33/82/30/340338230.db2.gz HSACITLPPCQUCD-HNNXBMFYSA-N 1 2 322.408 4.969 20 0 DJADLO Cc1[nH]ncc1C[N@@H+]([C@@H](C)c1ccc2ccccc2c1)C1CC1 ZINC000511793816 340338513 /nfs/dbraw/zinc/33/85/13/340338513.db2.gz RGDWMCFDJYYONG-HNNXBMFYSA-N 1 2 305.425 4.597 20 0 DJADLO Cc1[nH]ncc1C[N@H+]([C@@H](C)c1ccc2ccccc2c1)C1CC1 ZINC000511793816 340338514 /nfs/dbraw/zinc/33/85/14/340338514.db2.gz RGDWMCFDJYYONG-HNNXBMFYSA-N 1 2 305.425 4.597 20 0 DJADLO Clc1cccc(CNc2ccc(-n3cc[nH+]c3)cc2)c1Cl ZINC000512924092 340384246 /nfs/dbraw/zinc/38/42/46/340384246.db2.gz FOEBSJIYOHHYFU-UHFFFAOYSA-N 1 2 318.207 4.791 20 0 DJADLO COc1ccc([C@@H](Nc2cccc[nH+]2)c2ccc(C)cc2)cc1 ZINC000513202020 340396766 /nfs/dbraw/zinc/39/67/66/340396766.db2.gz SHFYHYCIGHSBHG-FQEVSTJZSA-N 1 2 304.393 4.600 20 0 DJADLO Cc1c2ccccc2oc1[C@H](C)[NH2+][C@H](C)c1nc(C(C)C)no1 ZINC000183588239 340488352 /nfs/dbraw/zinc/48/83/52/340488352.db2.gz DVICBXISRFOKCO-QWHCGFSZSA-N 1 2 313.401 4.659 20 0 DJADLO CSC[C@H](C)C(=O)Nc1c2ccccc2[nH+]c(C)c1C(C)C ZINC000191955928 340560594 /nfs/dbraw/zinc/56/05/94/340560594.db2.gz PSXVAEWBSNMXRJ-LBPRGKRZSA-N 1 2 316.470 4.604 20 0 DJADLO C[C@H](Nc1ccc(N2CCCC2)[nH+]c1)c1ccc(Cl)cc1 ZINC000036982161 340726153 /nfs/dbraw/zinc/72/61/53/340726153.db2.gz SXAFICLHANMOQU-ZDUSSCGKSA-N 1 2 301.821 4.508 20 0 DJADLO CCCCc1noc([C@H](C)[NH2+][C@H](CC)c2cc(C)ccc2C)n1 ZINC000528796510 340734701 /nfs/dbraw/zinc/73/47/01/340734701.db2.gz AFDIJJYCEWKOTQ-DOTOQJQBSA-N 1 2 315.461 4.831 20 0 DJADLO CCCCc1noc([C@@H](C)[NH2+][C@H](CC)c2cc(C)ccc2C)n1 ZINC000528796517 340734711 /nfs/dbraw/zinc/73/47/11/340734711.db2.gz AFDIJJYCEWKOTQ-NVXWUHKLSA-N 1 2 315.461 4.831 20 0 DJADLO Oc1cccc(C[NH2+]C(c2ccccc2)c2ccccc2)c1Cl ZINC000328315715 340775534 /nfs/dbraw/zinc/77/55/34/340775534.db2.gz GQNVHTWUEJLIRP-UHFFFAOYSA-N 1 2 323.823 4.925 20 0 DJADLO Clc1cccc(-c2cnc(C[NH2+]C3(c4ccccc4)CC3)o2)c1 ZINC000538160868 340811954 /nfs/dbraw/zinc/81/19/54/340811954.db2.gz FAHZPUFSDKXNEI-UHFFFAOYSA-N 1 2 324.811 4.774 20 0 DJADLO CCCc1nc(C[NH2+][C@@H](c2ccc(Cl)cc2)[C@H](C)CC)no1 ZINC000538188837 340812465 /nfs/dbraw/zinc/81/24/65/340812465.db2.gz ZSQXEHIICIJQOV-SJKOYZFVSA-N 1 2 321.852 4.553 20 0 DJADLO CCOc1ccccc1[C@H](C)[NH2+]Cc1nc(C(C)C)cs1 ZINC000128677904 340905551 /nfs/dbraw/zinc/90/55/51/340905551.db2.gz NDRKVTKJFXQBIF-ZDUSSCGKSA-N 1 2 304.459 4.516 20 0 DJADLO COc1cccc([C@@H](C)[NH2+]Cc2ncc(-c3ccccc3C)o2)c1 ZINC000540332497 340927312 /nfs/dbraw/zinc/92/73/12/340927312.db2.gz NCZDVXNDSPHZNU-OAHLLOKOSA-N 1 2 322.408 4.509 20 0 DJADLO CC(C)COC[C@@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1ccco1 ZINC000152613548 340959836 /nfs/dbraw/zinc/95/98/36/340959836.db2.gz HMSOFSKPDSDDAG-XJKSGUPXSA-N 1 2 323.383 4.622 20 0 DJADLO CC(C)C[C@H]([NH2+]Cc1nc(C2CCCC2)no1)c1cccs1 ZINC000541626275 340978461 /nfs/dbraw/zinc/97/84/61/340978461.db2.gz WUWRIMNLLFPIMP-AWEZNQCLSA-N 1 2 319.474 4.666 20 0 DJADLO CC(C)c1ccc(C[N@H+](C)Cc2nc(C3CC3)cs2)cc1 ZINC000542208876 341000217 /nfs/dbraw/zinc/00/02/17/341000217.db2.gz LMECZQXBTANJAE-UHFFFAOYSA-N 1 2 300.471 4.776 20 0 DJADLO CC(C)c1ccc(C[N@@H+](C)Cc2nc(C3CC3)cs2)cc1 ZINC000542208876 341000218 /nfs/dbraw/zinc/00/02/18/341000218.db2.gz LMECZQXBTANJAE-UHFFFAOYSA-N 1 2 300.471 4.776 20 0 DJADLO CC(C)c1cnc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)s1 ZINC000543395755 341041932 /nfs/dbraw/zinc/04/19/32/341041932.db2.gz UJYZDMOARVPTHX-OAHLLOKOSA-N 1 2 318.511 4.557 20 0 DJADLO CC(C)c1cnc(C[N@H+]2CCSC[C@@H]2c2ccccc2)s1 ZINC000543395755 341041933 /nfs/dbraw/zinc/04/19/33/341041933.db2.gz UJYZDMOARVPTHX-OAHLLOKOSA-N 1 2 318.511 4.557 20 0 DJADLO Cc1cccc(C[NH2+][C@H](c2cccnc2)c2ccc(F)cc2F)c1 ZINC000543407653 341042740 /nfs/dbraw/zinc/04/27/40/341042740.db2.gz WOPMVUGFVRZLNO-HXUWFJFHSA-N 1 2 324.374 4.547 20 0 DJADLO CC[C@@H]([NH2+][C@@H](C)c1cccc(Cl)c1Cl)c1ccn(C)n1 ZINC000543591990 341049701 /nfs/dbraw/zinc/04/97/01/341049701.db2.gz RSDUMWLUJKPERF-GXFFZTMASA-N 1 2 312.244 4.529 20 0 DJADLO Cc1ccc([C@H](Nc2ccc(N3CCCC3)[nH+]c2)C2CCC2)o1 ZINC000543625986 341051724 /nfs/dbraw/zinc/05/17/24/341051724.db2.gz ROWDCOHFRSJIQC-LJQANCHMSA-N 1 2 311.429 4.537 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1cc2c(ccc3ccccc23)o1)c1ccon1 ZINC000543627159 341051840 /nfs/dbraw/zinc/05/18/40/341051840.db2.gz SJQNPFZDDGEZFD-OLZOCXBDSA-N 1 2 306.365 4.986 20 0 DJADLO Cc1cc(C)c(NC(=O)c2ccc(-c3cccs3)o2)c(C)[nH+]1 ZINC000544021179 341066762 /nfs/dbraw/zinc/06/67/62/341066762.db2.gz JNZMYQDUIIUJKO-UHFFFAOYSA-N 1 2 312.394 4.581 20 0 DJADLO Fc1ccc([C@H]2CCCC[N@@H+]2Cc2nc(C3CC3)cs2)cc1 ZINC000544147020 341072331 /nfs/dbraw/zinc/07/23/31/341072331.db2.gz YPFQZKIFHJLWDB-QGZVFWFLSA-N 1 2 316.445 4.887 20 0 DJADLO Fc1ccc([C@H]2CCCC[N@H+]2Cc2nc(C3CC3)cs2)cc1 ZINC000544147020 341072332 /nfs/dbraw/zinc/07/23/32/341072332.db2.gz YPFQZKIFHJLWDB-QGZVFWFLSA-N 1 2 316.445 4.887 20 0 DJADLO CSc1cccc(NCc2cc(-n3cc[nH+]c3)cs2)c1C ZINC000544178264 341073016 /nfs/dbraw/zinc/07/30/16/341073016.db2.gz HZSABFFYAOEEBZ-UHFFFAOYSA-N 1 2 315.467 4.576 20 0 DJADLO Fc1cc2[nH+]cn(Cc3c(Cl)cccc3Cl)c2cc1F ZINC000131322526 341076211 /nfs/dbraw/zinc/07/62/11/341076211.db2.gz IMQVFIQTVNHOBB-UHFFFAOYSA-N 1 2 313.134 4.670 20 0 DJADLO CSc1ccccc1C[NH2+][C@@H](C)c1ncc(-c2ccccc2)o1 ZINC000544463180 341083200 /nfs/dbraw/zinc/08/32/00/341083200.db2.gz GHLAECHCMHFSBO-AWEZNQCLSA-N 1 2 324.449 4.914 20 0 DJADLO C[C@H]([NH2+]Cc1ccc(Sc2ccccc2)cc1)c1ccon1 ZINC000544617338 341089509 /nfs/dbraw/zinc/08/95/09/341089509.db2.gz NCFJUODXBZVLFF-AWEZNQCLSA-N 1 2 310.422 4.677 20 0 DJADLO CC[C@H](CC(F)(F)F)[NH2+][C@@H](CCc1ccccc1)C(F)F ZINC000544943831 341100441 /nfs/dbraw/zinc/10/04/41/341100441.db2.gz UTYMOWOPUMHBMW-OLZOCXBDSA-N 1 2 309.322 4.574 20 0 DJADLO C[C@@H](c1cc2ccccc2o1)[N@H+](C)Cc1ccncc1Cl ZINC000075586247 341178796 /nfs/dbraw/zinc/17/87/96/341178796.db2.gz YCJYAQOSDKHOJP-LBPRGKRZSA-N 1 2 300.789 4.674 20 0 DJADLO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)Cc1ccncc1Cl ZINC000075586247 341178797 /nfs/dbraw/zinc/17/87/97/341178797.db2.gz YCJYAQOSDKHOJP-LBPRGKRZSA-N 1 2 300.789 4.674 20 0 DJADLO Clc1cnccc1C[N@H+](Cc1ccco1)Cc1ccccc1 ZINC000075620223 341179867 /nfs/dbraw/zinc/17/98/67/341179867.db2.gz RRMQMEKSBPJAFX-UHFFFAOYSA-N 1 2 312.800 4.530 20 0 DJADLO Clc1cnccc1C[N@@H+](Cc1ccco1)Cc1ccccc1 ZINC000075620223 341179868 /nfs/dbraw/zinc/17/98/68/341179868.db2.gz RRMQMEKSBPJAFX-UHFFFAOYSA-N 1 2 312.800 4.530 20 0 DJADLO CCO[C@H](C)c1nc(C[N@H+](C)[C@@H](C)c2ccc(C)cc2)cs1 ZINC000076720198 341212905 /nfs/dbraw/zinc/21/29/05/341212905.db2.gz SXVLWCPTSCUOSI-LSDHHAIUSA-N 1 2 318.486 4.742 20 0 DJADLO CCO[C@H](C)c1nc(C[N@@H+](C)[C@@H](C)c2ccc(C)cc2)cs1 ZINC000076720198 341212906 /nfs/dbraw/zinc/21/29/06/341212906.db2.gz SXVLWCPTSCUOSI-LSDHHAIUSA-N 1 2 318.486 4.742 20 0 DJADLO C[C@H](c1ccco1)[N@H+](C)Cc1csc(-c2ccccc2F)n1 ZINC000077376392 341223900 /nfs/dbraw/zinc/22/39/00/341223900.db2.gz BJNJSFIMHXZNKL-GFCCVEGCSA-N 1 2 316.401 4.735 20 0 DJADLO C[C@H](c1ccco1)[N@@H+](C)Cc1csc(-c2ccccc2F)n1 ZINC000077376392 341223901 /nfs/dbraw/zinc/22/39/01/341223901.db2.gz BJNJSFIMHXZNKL-GFCCVEGCSA-N 1 2 316.401 4.735 20 0 DJADLO CC[N@H+](Cc1nccs1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000135009166 341228835 /nfs/dbraw/zinc/22/88/35/341228835.db2.gz TWAOGFJDFOZBNK-LLVKDONJSA-N 1 2 314.376 4.745 20 0 DJADLO CC[N@@H+](Cc1nccs1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000135009166 341228836 /nfs/dbraw/zinc/22/88/36/341228836.db2.gz TWAOGFJDFOZBNK-LLVKDONJSA-N 1 2 314.376 4.745 20 0 DJADLO Cc1cnc([C@@H](C)[NH2+]Cc2cc(Cl)ccc2Cl)s1 ZINC000135441756 341239652 /nfs/dbraw/zinc/23/96/52/341239652.db2.gz CNVBYWPZPXPNEX-SECBINFHSA-N 1 2 301.242 4.609 20 0 DJADLO CCn1ccnc1C[N@H+](Cc1ccccc1Cl)C1CCCC1 ZINC000078516428 341243249 /nfs/dbraw/zinc/24/32/49/341243249.db2.gz LYOZOLMCBBRSST-UHFFFAOYSA-N 1 2 317.864 4.501 20 0 DJADLO CCn1ccnc1C[N@@H+](Cc1ccccc1Cl)C1CCCC1 ZINC000078516428 341243250 /nfs/dbraw/zinc/24/32/50/341243250.db2.gz LYOZOLMCBBRSST-UHFFFAOYSA-N 1 2 317.864 4.501 20 0 DJADLO C[C@H]([NH2+][C@H](c1ccco1)c1ccccc1)c1ccc(F)cc1F ZINC000078970902 341250925 /nfs/dbraw/zinc/25/09/25/341250925.db2.gz DRVCKEKRAOTPIW-DJJJIMSYSA-N 1 2 313.347 4.998 20 0 DJADLO Cc1csc([C@@H](C)[NH2+]Cc2c(Cl)cccc2Cl)n1 ZINC000080273405 341272098 /nfs/dbraw/zinc/27/20/98/341272098.db2.gz PAYIEGNAPNFGCE-SECBINFHSA-N 1 2 301.242 4.609 20 0 DJADLO CC1=C(c2ccco2)C[N@H+](Cc2ncc(Cl)cc2Cl)CC1 ZINC000549159973 341287679 /nfs/dbraw/zinc/28/76/79/341287679.db2.gz YTXMOZHFNCIEPC-UHFFFAOYSA-N 1 2 323.223 4.661 20 0 DJADLO CC1=C(c2ccco2)C[N@@H+](Cc2ncc(Cl)cc2Cl)CC1 ZINC000549159973 341287680 /nfs/dbraw/zinc/28/76/80/341287680.db2.gz YTXMOZHFNCIEPC-UHFFFAOYSA-N 1 2 323.223 4.661 20 0 DJADLO C[C@H]1C[N@H+](Cc2coc(-c3cccs3)n2)[C@H]1c1ccccc1 ZINC000245443470 341294437 /nfs/dbraw/zinc/29/44/37/341294437.db2.gz XFTNKDSIPVTPBQ-SUMWQHHRSA-N 1 2 310.422 4.596 20 0 DJADLO C[C@H]1C[N@@H+](Cc2coc(-c3cccs3)n2)[C@H]1c1ccccc1 ZINC000245443470 341294438 /nfs/dbraw/zinc/29/44/38/341294438.db2.gz XFTNKDSIPVTPBQ-SUMWQHHRSA-N 1 2 310.422 4.596 20 0 DJADLO C[C@@H]1C[N@H+](Cc2coc(-c3cccs3)n2)[C@H]1c1ccccc1 ZINC000245443469 341294478 /nfs/dbraw/zinc/29/44/78/341294478.db2.gz XFTNKDSIPVTPBQ-CXAGYDPISA-N 1 2 310.422 4.596 20 0 DJADLO C[C@@H]1C[N@@H+](Cc2coc(-c3cccs3)n2)[C@H]1c1ccccc1 ZINC000245443469 341294479 /nfs/dbraw/zinc/29/44/79/341294479.db2.gz XFTNKDSIPVTPBQ-CXAGYDPISA-N 1 2 310.422 4.596 20 0 DJADLO Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]CC(C)(F)F ZINC000550881677 341325370 /nfs/dbraw/zinc/32/53/70/341325370.db2.gz ASMNNVYBEPDOMW-LLVKDONJSA-N 1 2 310.413 4.733 20 0 DJADLO C[C@H]1c2cccn2CC[N@H+]1Cc1cnc(C2CCCCC2)s1 ZINC000551921542 341355121 /nfs/dbraw/zinc/35/51/21/341355121.db2.gz PGBXGDJAMIOZAP-AWEZNQCLSA-N 1 2 315.486 4.569 20 0 DJADLO C[C@H]1c2cccn2CC[N@@H+]1Cc1cnc(C2CCCCC2)s1 ZINC000551921542 341355122 /nfs/dbraw/zinc/35/51/22/341355122.db2.gz PGBXGDJAMIOZAP-AWEZNQCLSA-N 1 2 315.486 4.569 20 0 DJADLO Cc1ccnc([C@H](C)[NH2+][C@@H](C)c2nc(C(C)(C)C)cs2)c1 ZINC000552046489 341364724 /nfs/dbraw/zinc/36/47/24/341364724.db2.gz IZBMEOXNAJORCA-STQMWFEESA-N 1 2 303.475 4.556 20 0 DJADLO CC(C)Cc1cccc([C@@H](C)[NH2+]Cc2nnc(C(C)C)s2)c1 ZINC000552057377 341365763 /nfs/dbraw/zinc/36/57/63/341365763.db2.gz QZCVIOMAPOTOEF-CQSZACIVSA-N 1 2 317.502 4.711 20 0 DJADLO Cc1ccnc([C@H](C)Nc2cccc([NH+]3CCCCCC3)c2)c1 ZINC000552283858 341383986 /nfs/dbraw/zinc/38/39/86/341383986.db2.gz LNDSENCYXHIYDD-KRWDZBQOSA-N 1 2 309.457 4.944 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1ccc(Cl)c(F)c1 ZINC000552327614 341386915 /nfs/dbraw/zinc/38/69/15/341386915.db2.gz AXJJECNKVAJRLL-BDAKNGLRSA-N 1 2 314.738 4.564 20 0 DJADLO C[C@H]1C[C@@]1([NH2+]Cc1cc(C(C)(C)C)on1)c1ccc(Cl)cc1 ZINC000564392643 341396943 /nfs/dbraw/zinc/39/69/43/341396943.db2.gz ACIUYKQZXSQSBV-SGTLLEGYSA-N 1 2 318.848 4.650 20 0 DJADLO COc1ccccc1[C@H]([NH2+][C@H]1CCc2ccccc21)c1ccco1 ZINC000090534405 341416746 /nfs/dbraw/zinc/41/67/46/341416746.db2.gz XIYRMZIPESNPMY-RXVVDRJESA-N 1 2 319.404 4.655 20 0 DJADLO C[C@H]([NH2+][C@@H](c1ccccc1)c1cccc(F)c1)c1nccs1 ZINC000091735806 341428014 /nfs/dbraw/zinc/42/80/14/341428014.db2.gz NYMFPYMPGGMZOD-GUYCJALGSA-N 1 2 312.413 4.722 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H]1CCC[C@@H](c2ccccc2)C1 ZINC000554388172 341452951 /nfs/dbraw/zinc/45/29/51/341452951.db2.gz OTDARTKBZKVALF-MSOLQXFVSA-N 1 2 323.440 4.546 20 0 DJADLO CC(C)(C)C(C)(C)C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000555626697 341487651 /nfs/dbraw/zinc/48/76/51/341487651.db2.gz YHBSGYWEIKCXAF-UHFFFAOYSA-N 1 2 312.413 4.885 20 0 DJADLO Cc1nc([C@H](C)[NH2+][C@H](c2ccc(C(C)(C)C)cc2)C(C)C)no1 ZINC000565567123 341531352 /nfs/dbraw/zinc/53/13/52/341531352.db2.gz SCHHJDCOCRMKOV-GUYCJALGSA-N 1 2 315.461 4.723 20 0 DJADLO CCC[C@H]1CCCN(C(=O)c2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000155306732 341605939 /nfs/dbraw/zinc/60/59/39/341605939.db2.gz KTYGSFWXBDREIJ-INIZCTEOSA-N 1 2 324.424 4.526 20 0 DJADLO Cc1cnc([C@H](C)[NH2+]Cc2ccc(-c3ccc(C)cc3)o2)s1 ZINC000175858044 341849009 /nfs/dbraw/zinc/84/90/09/341849009.db2.gz GUWARCIGTLEZPI-AWEZNQCLSA-N 1 2 312.438 4.871 20 0 DJADLO Fc1cc2[nH+]ccc(NCc3cnc(C4CC4)o3)c2cc1Cl ZINC000576790853 341863346 /nfs/dbraw/zinc/86/33/46/341863346.db2.gz DBJYSKVZBDFGBL-UHFFFAOYSA-N 1 2 317.751 4.505 20 0 DJADLO C[C@@H]([NH2+][C@H]1CCSc2c(Cl)cccc21)c1cscn1 ZINC000577005806 341875340 /nfs/dbraw/zinc/87/53/40/341875340.db2.gz GBRBOWIZHRAKOK-SKDRFNHKSA-N 1 2 310.875 4.684 20 0 DJADLO CC[C@@H]([NH2+]Cc1cc(C(C)(C)C)on1)c1ccc(Cl)s1 ZINC000577563254 341917957 /nfs/dbraw/zinc/91/79/57/341917957.db2.gz HODODJZKGPOBSN-LLVKDONJSA-N 1 2 312.866 4.928 20 0 DJADLO CCc1ccc([C@@H](COC)[NH2+][C@@H](C)c2ccccc2Cl)o1 ZINC000177372738 341919098 /nfs/dbraw/zinc/91/90/98/341919098.db2.gz JEEQZWJNDAXAPW-BLLLJJGKSA-N 1 2 307.821 4.534 20 0 DJADLO CC(C)[C@H]([NH2+]Cc1nccn1C(C)C)c1ccc(Cl)cc1F ZINC000180266270 519821149 /nfs/dbraw/zinc/82/11/49/519821149.db2.gz QWTFHTGRNOQHBA-KRWDZBQOSA-N 1 2 323.843 4.743 20 0 DJADLO CC(C)c1nnc(C[NH2+][C@H](CC2CCCC2)c2ccccc2)o1 ZINC000181942024 519887980 /nfs/dbraw/zinc/88/79/80/519887980.db2.gz ZECRJDHEVKYJEM-QGZVFWFLSA-N 1 2 313.445 4.604 20 0 DJADLO CCCOc1ccccc1[C@H](CC(C)C)[NH2+]Cc1ncc(C)o1 ZINC000181721059 520485325 /nfs/dbraw/zinc/48/53/25/520485325.db2.gz AXRUQUHQYQWNLJ-KRWDZBQOSA-N 1 2 316.445 4.649 20 0 DJADLO CCC[C@@H]([NH2+]Cc1ncc(-c2ccccc2)cn1)c1ccsc1 ZINC000187920090 520786234 /nfs/dbraw/zinc/78/62/34/520786234.db2.gz BQKVBLUZZYZZJZ-GOSISDBHSA-N 1 2 323.465 4.836 20 0 DJADLO CCC[C@H]([NH2+]Cc1ncc(-c2ccccc2)cn1)c1ccsc1 ZINC000187920059 521166858 /nfs/dbraw/zinc/16/68/58/521166858.db2.gz BQKVBLUZZYZZJZ-SFHVURJKSA-N 1 2 323.465 4.836 20 0 DJADLO CCc1nc(C)c([C@@H](C)[N@H+](C)Cc2csc(C3CC3)n2)s1 ZINC000163133548 522220809 /nfs/dbraw/zinc/22/08/09/522220809.db2.gz RSWNCLOWPNOCJS-LLVKDONJSA-N 1 2 321.515 4.541 20 0 DJADLO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2csc(C3CC3)n2)s1 ZINC000163133548 522220829 /nfs/dbraw/zinc/22/08/29/522220829.db2.gz RSWNCLOWPNOCJS-LLVKDONJSA-N 1 2 321.515 4.541 20 0 DJADLO CCc1nc(C[NH2+][C@@H](CC)c2cc(Cl)ccc2OC)cs1 ZINC000156412335 522348565 /nfs/dbraw/zinc/34/85/65/522348565.db2.gz KLRJTVCCWPJPGZ-AWEZNQCLSA-N 1 2 324.877 4.608 20 0 DJADLO CCc1nc([C@H](C)[NH2+][C@H](C)c2cc3ccccc3o2)cs1 ZINC000162415833 522452991 /nfs/dbraw/zinc/45/29/91/522452991.db2.gz DAXSOGSPWSACRU-NWDGAFQWSA-N 1 2 300.427 4.864 20 0 DJADLO CO[C@@H](C)c1nc(C[N@H+]2CCCCC[C@H]2c2ccco2)cs1 ZINC000267085945 523467236 /nfs/dbraw/zinc/46/72/36/523467236.db2.gz ZMWGFMPFTPKBJM-ZFWWWQNUSA-N 1 2 320.458 4.561 20 0 DJADLO CO[C@@H](C)c1nc(C[N@@H+]2CCCCC[C@H]2c2ccco2)cs1 ZINC000267085945 523467227 /nfs/dbraw/zinc/46/72/27/523467227.db2.gz ZMWGFMPFTPKBJM-ZFWWWQNUSA-N 1 2 320.458 4.561 20 0 DJADLO Cc1ccc(-c2nc(C[N@@H+](C)[C@@H](C)c3cccnc3)cs2)cc1 ZINC000180808722 525808971 /nfs/dbraw/zinc/80/89/71/525808971.db2.gz NBSDPWVVIHUFOU-HNNXBMFYSA-N 1 2 323.465 4.707 20 0 DJADLO Cc1ccc(-c2nc(C[N@H+](C)[C@@H](C)c3cccnc3)cs2)cc1 ZINC000180808722 525808978 /nfs/dbraw/zinc/80/89/78/525808978.db2.gz NBSDPWVVIHUFOU-HNNXBMFYSA-N 1 2 323.465 4.707 20 0 DJADLO C[C@@H](c1cccc(C(F)(F)F)c1)[N@H+](C)Cc1ncc(C2CC2)o1 ZINC000270521827 526068381 /nfs/dbraw/zinc/06/83/81/526068381.db2.gz CVYKDNJFQWHLAY-NSHDSACASA-N 1 2 324.346 4.764 20 0 DJADLO C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)Cc1ncc(C2CC2)o1 ZINC000270521827 526068389 /nfs/dbraw/zinc/06/83/89/526068389.db2.gz CVYKDNJFQWHLAY-NSHDSACASA-N 1 2 324.346 4.764 20 0 DJADLO COc1cccc(Cl)c1C[N@H+](C)[C@H](C)c1sc(C)nc1C ZINC000338303499 526098001 /nfs/dbraw/zinc/09/80/01/526098001.db2.gz HDUYTEYVUFXBMV-LLVKDONJSA-N 1 2 324.877 4.615 20 0 DJADLO COc1cccc(Cl)c1C[N@@H+](C)[C@H](C)c1sc(C)nc1C ZINC000338303499 526098012 /nfs/dbraw/zinc/09/80/12/526098012.db2.gz HDUYTEYVUFXBMV-LLVKDONJSA-N 1 2 324.877 4.615 20 0 DJADLO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2csc(C(C)(C)C)n2)s1 ZINC000106875405 526750838 /nfs/dbraw/zinc/75/08/38/526750838.db2.gz GYTTZBXWYPPPOU-NSHDSACASA-N 1 2 323.531 4.707 20 0 DJADLO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2csc(C(C)(C)C)n2)s1 ZINC000106875405 526750842 /nfs/dbraw/zinc/75/08/42/526750842.db2.gz GYTTZBXWYPPPOU-NSHDSACASA-N 1 2 323.531 4.707 20 0 DJADLO O=C(Nc1cccc(Oc2cc[nH+]cc2)c1)c1ccoc1C1CC1 ZINC000337003832 527370266 /nfs/dbraw/zinc/37/02/66/527370266.db2.gz XNGMDCFIMBQGMS-UHFFFAOYSA-N 1 2 320.348 4.597 20 0 DJADLO c1ccc(C[C@@H](Nc2cc[nH+]c(C3CC3)n2)c2ccccc2)cc1 ZINC000170624592 563908837 /nfs/dbraw/zinc/90/88/37/563908837.db2.gz LIVHRFUHDQDSON-LJQANCHMSA-N 1 2 315.420 4.750 20 0 DJADLO CC(C)c1nc([C@H](C)[NH2+][C@H]2CCOc3c(F)cccc32)cs1 ZINC000090049890 185279751 /nfs/dbraw/zinc/27/97/51/185279751.db2.gz SAZDLUMAQONOHF-FZMZJTMJSA-N 1 2 320.433 4.580 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1cccnc1Cl)c1c(F)cccc1Cl ZINC000090180394 185285496 /nfs/dbraw/zinc/28/54/96/185285496.db2.gz YGTREMOLNCKCLD-VHSXEESVSA-N 1 2 313.203 4.939 20 0 DJADLO CC[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccc(F)cc1F ZINC000090460495 185297806 /nfs/dbraw/zinc/29/78/06/185297806.db2.gz CITXRGWYOVNIAS-AWEZNQCLSA-N 1 2 308.397 4.540 20 0 DJADLO CCn1c2ccccc2nc1[C@H](C)[NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000237000307 202115996 /nfs/dbraw/zinc/11/59/96/202115996.db2.gz UTNPXIDLJQDAMO-OFQRWUPVSA-N 1 2 323.440 4.623 20 0 DJADLO COc1c(C)c[nH+]c(CSc2nc3ccccc3s2)c1C ZINC000039937911 183023305 /nfs/dbraw/zinc/02/33/05/183023305.db2.gz QZMVWAOUDXZPTO-UHFFFAOYSA-N 1 2 316.451 4.609 20 0 DJADLO FC(F)(F)c1ccc(-c2ccc(Cn3cc[nH+]c3)cc2)cc1 ZINC000040829165 183138737 /nfs/dbraw/zinc/13/87/37/183138737.db2.gz ZGVRGKQQDLAUKP-UHFFFAOYSA-N 1 2 302.299 4.617 20 0 DJADLO Cc1cccc([C@H](C)[NH2+]Cc2noc(C3CCCCC3)n2)c1C ZINC000183730013 335041256 /nfs/dbraw/zinc/04/12/56/335041256.db2.gz QRJFRJIODWFBFH-HNNXBMFYSA-N 1 2 313.445 4.585 20 0 DJADLO CC(C)[C@H]([NH2+][C@@H](C)c1cscn1)c1ccc(Cl)cc1F ZINC000272711486 130055847 /nfs/dbraw/zinc/05/58/47/130055847.db2.gz BEJIMAJRFQWFTP-BONVTDFDSA-N 1 2 312.841 4.984 20 0 DJADLO Cc1nnc([C@@H](C)[N@H+](C)Cc2ccccc2-c2ccccc2)s1 ZINC000273202772 130097210 /nfs/dbraw/zinc/09/72/10/130097210.db2.gz SHRPZNLKKXASKQ-CQSZACIVSA-N 1 2 323.465 4.707 20 0 DJADLO Cc1nnc([C@@H](C)[N@@H+](C)Cc2ccccc2-c2ccccc2)s1 ZINC000273202772 130097214 /nfs/dbraw/zinc/09/72/14/130097214.db2.gz SHRPZNLKKXASKQ-CQSZACIVSA-N 1 2 323.465 4.707 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1Cl)c1ccc(Cl)cn1 ZINC000274914360 130273470 /nfs/dbraw/zinc/27/34/70/130273470.db2.gz NVNUVEBDXJWTOZ-UWVGGRQHSA-N 1 2 313.203 4.939 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1Cl)c1ccc(Cl)cn1 ZINC000274914364 130273572 /nfs/dbraw/zinc/27/35/72/130273572.db2.gz NVNUVEBDXJWTOZ-ZJUUUORDSA-N 1 2 313.203 4.939 20 0 DJADLO C[C@H]([NH2+]Cc1ncc(C2CC2)o1)c1cc(Cl)ccc1Cl ZINC000275124906 130294099 /nfs/dbraw/zinc/29/40/99/130294099.db2.gz QIQSTGVVAZHOJS-VIFPVBQESA-N 1 2 311.212 4.710 20 0 DJADLO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2Cl)s1 ZINC000282509073 130926638 /nfs/dbraw/zinc/92/66/38/130926638.db2.gz OHRROTLKDXTYSP-HTQZYQBOSA-N 1 2 316.257 4.565 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1ccccc1)C1CC1)c1noc(-c2ccccc2)n1 ZINC000283959798 131036449 /nfs/dbraw/zinc/03/64/49/131036449.db2.gz DWKWKIZVSBWPBV-KDOFPFPSSA-N 1 2 319.408 4.539 20 0 DJADLO CCCCOc1ccc(C[NH2+][C@@H](C)c2cc(C)on2)cc1Cl ZINC000285211310 131147751 /nfs/dbraw/zinc/14/77/51/131147751.db2.gz ONZSGMXIZNOOTE-ZDUSSCGKSA-N 1 2 322.836 4.666 20 0 DJADLO Cc1noc(C)c1C(C)(C)[NH2+]Cc1c(Cl)cccc1Cl ZINC000285616360 131186309 /nfs/dbraw/zinc/18/63/09/131186309.db2.gz KMHMOWYGGKNMMZ-UHFFFAOYSA-N 1 2 313.228 4.623 20 0 DJADLO Cc1ccc(-c2csc(C[N@@H+](C)[C@@H](C)c3ccncc3)n2)cc1 ZINC000285683801 131192378 /nfs/dbraw/zinc/19/23/78/131192378.db2.gz QSGOIZNUQJJBTK-HNNXBMFYSA-N 1 2 323.465 4.707 20 0 DJADLO Cc1ccc(-c2csc(C[N@H+](C)[C@@H](C)c3ccncc3)n2)cc1 ZINC000285683801 131192379 /nfs/dbraw/zinc/19/23/79/131192379.db2.gz QSGOIZNUQJJBTK-HNNXBMFYSA-N 1 2 323.465 4.707 20 0 DJADLO Cc1nc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)c3ccccc32)no1 ZINC000289307868 131372717 /nfs/dbraw/zinc/37/27/17/131372717.db2.gz CIVFVPYBPFUNRQ-GHMZBOCLSA-N 1 2 315.804 4.596 20 0 DJADLO COc1cccc(F)c1[C@@H](C)[NH2+][C@H](C)c1cc(F)ccc1F ZINC000174220996 332847326 /nfs/dbraw/zinc/84/73/26/332847326.db2.gz VQGLUMJEBVFYOR-GHMZBOCLSA-N 1 2 309.331 4.524 20 0 DJADLO COc1cccc(F)c1[C@H](C)[NH2+][C@@H](C)c1cc(F)ccc1F ZINC000174220908 332847342 /nfs/dbraw/zinc/84/73/42/332847342.db2.gz VQGLUMJEBVFYOR-QWRGUYRKSA-N 1 2 309.331 4.524 20 0 DJADLO CC[C@H]([NH2+][C@H](C)c1csnn1)c1ccc(Cl)cc1Cl ZINC000398263206 331603508 /nfs/dbraw/zinc/60/35/08/331603508.db2.gz VVPAHEBXAFXMRK-PELKAZGASA-N 1 2 316.257 4.647 20 0 DJADLO FC(F)(F)CC1CC[NH+](Cc2coc(-c3ccccc3)n2)CC1 ZINC000556505738 331709384 /nfs/dbraw/zinc/70/93/84/331709384.db2.gz FRPMPLUXXMSQEO-UHFFFAOYSA-N 1 2 324.346 4.506 20 0 DJADLO Cc1cc(C[NH2+][C@@H](c2ccccc2)c2ccc(Cl)cc2)no1 ZINC000557202297 331776384 /nfs/dbraw/zinc/77/63/84/331776384.db2.gz QGHZZSWZGFWCNQ-SFHVURJKSA-N 1 2 312.800 4.516 20 0 DJADLO CCCCCOc1cc(C)ccc1C[NH2+][C@H](C)c1cc(C)on1 ZINC000557341230 331783729 /nfs/dbraw/zinc/78/37/29/331783729.db2.gz DQKMBCRONGBVMD-MRXNPFEDSA-N 1 2 316.445 4.711 20 0 DJADLO CC[C@H]([NH2+]Cc1cc(Cl)ccc1Cl)c1nccs1 ZINC000087759443 331791647 /nfs/dbraw/zinc/79/16/47/331791647.db2.gz ZSNZWAZLXATUII-LBPRGKRZSA-N 1 2 301.242 4.691 20 0 DJADLO CCCCc1nc(C[N@H+](CCC)[C@H](CC)c2ccccc2)no1 ZINC000521192938 332023317 /nfs/dbraw/zinc/02/33/17/332023317.db2.gz VSNQJZLKCSAGBW-QGZVFWFLSA-N 1 2 315.461 4.776 20 0 DJADLO CCCCc1nc(C[N@@H+](CCC)[C@H](CC)c2ccccc2)no1 ZINC000521192938 332023319 /nfs/dbraw/zinc/02/33/19/332023319.db2.gz VSNQJZLKCSAGBW-QGZVFWFLSA-N 1 2 315.461 4.776 20 0 DJADLO CCC[N@H+](Cc1ncc(C(C)(C)C)o1)Cc1ccc(F)cc1 ZINC000521195715 332054743 /nfs/dbraw/zinc/05/47/43/332054743.db2.gz QCMPMYAVHMSQLQ-UHFFFAOYSA-N 1 2 304.409 4.523 20 0 DJADLO CCC[N@@H+](Cc1ncc(C(C)(C)C)o1)Cc1ccc(F)cc1 ZINC000521195715 332054744 /nfs/dbraw/zinc/05/47/44/332054744.db2.gz QCMPMYAVHMSQLQ-UHFFFAOYSA-N 1 2 304.409 4.523 20 0 DJADLO CC(C)n1nccc1C[NH+]1Cc2ccccc2-c2ccccc2C1 ZINC000410343500 332113393 /nfs/dbraw/zinc/11/33/93/332113393.db2.gz CZPLLNGVLWKKAV-UHFFFAOYSA-N 1 2 317.436 4.647 20 0 DJADLO CC(C)n1nccc1C[N@H+]([C@@H](C)c1ccccc1Cl)C1CC1 ZINC000410347271 332114585 /nfs/dbraw/zinc/11/45/85/332114585.db2.gz AFEOQWWYBCLUDB-AWEZNQCLSA-N 1 2 317.864 4.843 20 0 DJADLO CC(C)n1nccc1C[N@@H+]([C@@H](C)c1ccccc1Cl)C1CC1 ZINC000410347271 332114586 /nfs/dbraw/zinc/11/45/86/332114586.db2.gz AFEOQWWYBCLUDB-AWEZNQCLSA-N 1 2 317.864 4.843 20 0 DJADLO Cc1csc([C@H](C)[NH2+]Cc2c(Cl)oc3ccccc32)n1 ZINC000133185337 332138123 /nfs/dbraw/zinc/13/81/23/332138123.db2.gz SLAPSQXOWBQZMJ-JTQLQIEISA-N 1 2 306.818 4.702 20 0 DJADLO Cc1cc(C(=O)Nc2c3ccccc3[nH+]c(C)c2C(C)C)oc1C ZINC000584267168 332176836 /nfs/dbraw/zinc/17/68/36/332176836.db2.gz AKTCQKQWWNHNCI-UHFFFAOYSA-N 1 2 322.408 4.551 20 0 DJADLO C[C@H]1C[C@H](C(F)(F)F)CC[N@@H+]1Cc1csc(C(C)(C)C)n1 ZINC000449463309 332234891 /nfs/dbraw/zinc/23/48/91/332234891.db2.gz VVUDJWOHDLMTII-WDEREUQCSA-N 1 2 320.424 4.603 20 0 DJADLO C[C@H]1C[C@H](C(F)(F)F)CC[N@H+]1Cc1csc(C(C)(C)C)n1 ZINC000449463309 332234893 /nfs/dbraw/zinc/23/48/93/332234893.db2.gz VVUDJWOHDLMTII-WDEREUQCSA-N 1 2 320.424 4.603 20 0 DJADLO CCCCOC1CCN(c2cc(C(C)C)[nH+]c(C(C)C)n2)CC1 ZINC000536391598 332238374 /nfs/dbraw/zinc/23/83/74/332238374.db2.gz SFAPTUFDSLIMNL-UHFFFAOYSA-N 1 2 319.493 4.509 20 0 DJADLO C[N@@H+](Cc1coc(-c2ccccc2)n1)Cc1cc2ccccc2o1 ZINC000531104463 332263957 /nfs/dbraw/zinc/26/39/57/332263957.db2.gz DHYOHKZCJVGWAW-UHFFFAOYSA-N 1 2 318.376 4.720 20 0 DJADLO C[N@H+](Cc1coc(-c2ccccc2)n1)Cc1cc2ccccc2o1 ZINC000531104463 332263959 /nfs/dbraw/zinc/26/39/59/332263959.db2.gz DHYOHKZCJVGWAW-UHFFFAOYSA-N 1 2 318.376 4.720 20 0 DJADLO Cn1cccc1[C@@H]1CCCC[N@@H+]1Cc1csc(C(C)(C)C)n1 ZINC000531104763 332264042 /nfs/dbraw/zinc/26/40/42/332264042.db2.gz YADIZMDCDCALAQ-INIZCTEOSA-N 1 2 317.502 4.506 20 0 DJADLO Cn1cccc1[C@@H]1CCCC[N@H+]1Cc1csc(C(C)(C)C)n1 ZINC000531104763 332264044 /nfs/dbraw/zinc/26/40/44/332264044.db2.gz YADIZMDCDCALAQ-INIZCTEOSA-N 1 2 317.502 4.506 20 0 DJADLO COC[C@H]([NH2+][C@@H](C)c1cc2ccc(C)cc2o1)c1ccc(C)o1 ZINC000426071660 335098643 /nfs/dbraw/zinc/09/86/43/335098643.db2.gz UGOPUBGDRICJGE-HOCLYGCPSA-N 1 2 313.397 4.681 20 0 DJADLO COC[C@@H]([NH2+][C@H](C)c1cc2ccc(C)cc2o1)c1ccc(C)o1 ZINC000426071658 335098696 /nfs/dbraw/zinc/09/86/96/335098696.db2.gz UGOPUBGDRICJGE-GDBMZVCRSA-N 1 2 313.397 4.681 20 0 DJADLO CCOCc1cccc(N[C@H](c2[nH]cc[nH+]2)C2CCCCC2)c1 ZINC000560553688 332359216 /nfs/dbraw/zinc/35/92/16/332359216.db2.gz YVKQGCLTRVXEMO-SFHVURJKSA-N 1 2 313.445 4.680 20 0 DJADLO C[C@@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1ccccc1Cl ZINC000152713413 332428799 /nfs/dbraw/zinc/42/87/99/332428799.db2.gz DWAAIAKSNVEJRW-CYBMUJFWSA-N 1 2 312.800 4.846 20 0 DJADLO COCC[C@H](Nc1cc[nH+]c2c(Cl)cccc12)c1ccco1 ZINC000561291534 332434681 /nfs/dbraw/zinc/43/46/81/332434681.db2.gz QCIGSDPAGISSAN-HNNXBMFYSA-N 1 2 316.788 4.671 20 0 DJADLO c1c[nH+]c(CNc2cccc(CSC3CCCCC3)c2)[nH]1 ZINC000151064103 332501746 /nfs/dbraw/zinc/50/17/46/332501746.db2.gz LMORFTIAMXJBFS-UHFFFAOYSA-N 1 2 301.459 4.588 20 0 DJADLO Cc1cnc([C@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2Cl)cn1 ZINC000427817846 332527582 /nfs/dbraw/zinc/52/75/82/332527582.db2.gz NGHMPJUQCRGUMV-MNOVXSKESA-N 1 2 310.228 4.504 20 0 DJADLO Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+][C@H](C)c1cscn1 ZINC000570058396 332707158 /nfs/dbraw/zinc/70/71/58/332707158.db2.gz SUNFCSCRDYQWFY-ZJUUUORDSA-N 1 2 309.504 4.617 20 0 DJADLO CC(C)c1ccc(NC(=O)C[C@H](C)n2cc[nH+]c2)c(C(C)C)c1 ZINC000570099067 332711854 /nfs/dbraw/zinc/71/18/54/332711854.db2.gz ZBWFYKQEZFSKDU-HNNXBMFYSA-N 1 2 313.445 4.720 20 0 DJADLO CCCc1nc(C[NH2+][C@H](C)c2ccc(F)cc2Cl)cs1 ZINC000183773903 333062770 /nfs/dbraw/zinc/06/27/70/333062770.db2.gz GNEWSABOVGLTDI-SNVBAGLBSA-N 1 2 312.841 4.739 20 0 DJADLO CC[C@H](C)Oc1cccc(NCc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000378910933 333063087 /nfs/dbraw/zinc/06/30/87/333063087.db2.gz SJGGCGOFIONADP-INIZCTEOSA-N 1 2 321.424 4.662 20 0 DJADLO O=C(C[C@@H]1C=CCCC1)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000187927530 333153989 /nfs/dbraw/zinc/15/39/89/333153989.db2.gz ZHCPBZUWLXQAQW-OAHLLOKOSA-N 1 2 308.381 4.559 20 0 DJADLO CCc1cnccc1[C@H](C)[NH2+][C@@H](CCc1ccccc1)C(F)F ZINC000498764061 333252561 /nfs/dbraw/zinc/25/25/61/333252561.db2.gz JLTWRFBDKHTWNZ-KSSFIOAISA-N 1 2 318.411 4.561 20 0 DJADLO C[C@H](c1cccc(Cl)c1)[N@@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000497590741 333266483 /nfs/dbraw/zinc/26/64/83/333266483.db2.gz MXZGLSWHQLJSLM-FZKQIMNGSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@H](c1cccc(Cl)c1)[N@H+]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000497590741 333266484 /nfs/dbraw/zinc/26/64/84/333266484.db2.gz MXZGLSWHQLJSLM-FZKQIMNGSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@@H](c1cccc(Cl)c1)[N@@H+]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000497590743 333266680 /nfs/dbraw/zinc/26/66/80/333266680.db2.gz MXZGLSWHQLJSLM-UGSOOPFHSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@@H](c1cccc(Cl)c1)[N@H+]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000497590743 333266682 /nfs/dbraw/zinc/26/66/82/333266682.db2.gz MXZGLSWHQLJSLM-UGSOOPFHSA-N 1 2 319.807 4.614 20 0 DJADLO CCCCc1nc(C[N@@H+]2CCc3sccc3[C@@H]2C)cs1 ZINC000497998844 333318469 /nfs/dbraw/zinc/31/84/69/333318469.db2.gz WRUOWINFWWETPX-LBPRGKRZSA-N 1 2 306.500 4.667 20 0 DJADLO CCCCc1nc(C[N@H+]2CCc3sccc3[C@@H]2C)cs1 ZINC000497998844 333318471 /nfs/dbraw/zinc/31/84/71/333318471.db2.gz WRUOWINFWWETPX-LBPRGKRZSA-N 1 2 306.500 4.667 20 0 DJADLO Cc1nc(C[N@@H+](C)Cc2ccc(OC(C)C)c(Cl)c2)cs1 ZINC000493811682 333343186 /nfs/dbraw/zinc/34/31/86/333343186.db2.gz CGAQEFAONWEXQS-UHFFFAOYSA-N 1 2 324.877 4.524 20 0 DJADLO Cc1nc(C[N@H+](C)Cc2ccc(OC(C)C)c(Cl)c2)cs1 ZINC000493811682 333343187 /nfs/dbraw/zinc/34/31/87/333343187.db2.gz CGAQEFAONWEXQS-UHFFFAOYSA-N 1 2 324.877 4.524 20 0 DJADLO c1ncc(CNc2[nH+]c3ccccc3n2C2CCCCC2)s1 ZINC000124023999 333351051 /nfs/dbraw/zinc/35/10/51/333351051.db2.gz DHPDBOIGWZEDDD-UHFFFAOYSA-N 1 2 312.442 4.610 20 0 DJADLO Cc1oc(-c2ccccc2)nc1CSCCc1cccc(C)[nH+]1 ZINC000563147419 333396876 /nfs/dbraw/zinc/39/68/76/333396876.db2.gz PKCZEIKXTBPTOZ-UHFFFAOYSA-N 1 2 324.449 4.829 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1ccccc1Cl)c1nc2ccccc2o1 ZINC000182422867 333503582 /nfs/dbraw/zinc/50/35/82/333503582.db2.gz BJUCYKSVESNSFO-VXGBXAGGSA-N 1 2 300.789 4.893 20 0 DJADLO CCc1ccc(C[NH2+][C@H](c2ccccc2)c2ccccc2OC)o1 ZINC000531611928 333538022 /nfs/dbraw/zinc/53/80/22/333538022.db2.gz WLVSRWDEDQQCTB-OAQYLSRUSA-N 1 2 321.420 4.730 20 0 DJADLO CCc1ccc(C[NH+](Cc2ccco2)Cc2ccco2)s1 ZINC000534333055 333575653 /nfs/dbraw/zinc/57/56/53/333575653.db2.gz MGJYFYKYLZMZIZ-UHFFFAOYSA-N 1 2 301.411 4.699 20 0 DJADLO CCn1cc[nH+]c1[C@@H](C)Nc1ccc(-c2cnc(C3CC3)o2)cc1 ZINC000571614513 333821259 /nfs/dbraw/zinc/82/12/59/333821259.db2.gz JQOUSXNUBWRZPL-CYBMUJFWSA-N 1 2 322.412 4.609 20 0 DJADLO CCc1ccc([C@@H]2CCC[N@@H+]2Cc2nc(C3CC3)cs2)o1 ZINC000343547533 335171293 /nfs/dbraw/zinc/17/12/93/335171293.db2.gz HCAWLZAAWKROQX-HNNXBMFYSA-N 1 2 302.443 4.513 20 0 DJADLO CCc1ccc([C@@H]2CCC[N@H+]2Cc2nc(C3CC3)cs2)o1 ZINC000343547533 335171296 /nfs/dbraw/zinc/17/12/96/335171296.db2.gz HCAWLZAAWKROQX-HNNXBMFYSA-N 1 2 302.443 4.513 20 0 DJADLO CC[C@H]([NH2+][C@H](C)c1nc(C(C)C)no1)c1ccc(Cl)s1 ZINC000273466562 334047611 /nfs/dbraw/zinc/04/76/11/334047611.db2.gz DVLAAOLRNGHMBE-ZJUUUORDSA-N 1 2 313.854 4.710 20 0 DJADLO Clc1cccc(Cl)c1C1([NH2+]Cc2nccs2)CCC1 ZINC000278273397 334094156 /nfs/dbraw/zinc/09/41/56/334094156.db2.gz JHJXKYXFZXSRNF-UHFFFAOYSA-N 1 2 313.253 4.619 20 0 DJADLO CC(C)[C@@H]1CCCCN1C(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000343512204 335173133 /nfs/dbraw/zinc/17/31/33/335173133.db2.gz OCCXXFHBNOWHEE-IBGZPJMESA-N 1 2 324.424 4.525 20 0 DJADLO CC[C@@H]([NH2+]Cc1csc(Cl)n1)c1ccc(Cl)s1 ZINC000295077890 334217666 /nfs/dbraw/zinc/21/76/66/334217666.db2.gz XGBZMHYKEHPSMN-MRVPVSSYSA-N 1 2 307.271 4.752 20 0 DJADLO CCn1ccnc1[C@@H](C)[NH2+][C@@H](C)c1ccc(Cl)cc1Cl ZINC000296081143 334229773 /nfs/dbraw/zinc/22/97/73/334229773.db2.gz SPFVAMZJSIELQI-WDEREUQCSA-N 1 2 312.244 4.622 20 0 DJADLO CCn1ccnc1[C@@H](C)[NH2+][C@H](C)c1cccc(Cl)c1Cl ZINC000453106514 334231405 /nfs/dbraw/zinc/23/14/05/334231405.db2.gz DWKZUUHUNISXEE-GHMZBOCLSA-N 1 2 312.244 4.622 20 0 DJADLO Cc1ccccc1-c1cnc(C[N@@H+]2CC[C@H]2c2ccccc2)o1 ZINC000534529165 334279181 /nfs/dbraw/zinc/27/91/81/334279181.db2.gz WYAPLLWGMIRPNK-SFHVURJKSA-N 1 2 304.393 4.597 20 0 DJADLO Cc1ccccc1-c1cnc(C[N@H+]2CC[C@H]2c2ccccc2)o1 ZINC000534529165 334279182 /nfs/dbraw/zinc/27/91/82/334279182.db2.gz WYAPLLWGMIRPNK-SFHVURJKSA-N 1 2 304.393 4.597 20 0 DJADLO C[C@H]([NH2+]Cc1nc2ccccc2[nH]1)c1ccc(Cl)cc1Cl ZINC000048776719 334296381 /nfs/dbraw/zinc/29/63/81/334296381.db2.gz HZKUGWKGOHRWHW-JTQLQIEISA-N 1 2 320.223 4.721 20 0 DJADLO C[C@@H](c1cccc(Cl)c1)[N@@H+]1CCO[C@@H](c2ccccc2F)C1 ZINC000303225071 334304951 /nfs/dbraw/zinc/30/49/51/334304951.db2.gz WGUPQZOKMFAFKA-SCLBCKFNSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@@H](c1cccc(Cl)c1)[N@H+]1CCO[C@@H](c2ccccc2F)C1 ZINC000303225071 334304952 /nfs/dbraw/zinc/30/49/52/334304952.db2.gz WGUPQZOKMFAFKA-SCLBCKFNSA-N 1 2 319.807 4.614 20 0 DJADLO Clc1ccc(C[N@H+](Cc2ccncc2)C2CC2)c(Cl)c1 ZINC000534939771 334349702 /nfs/dbraw/zinc/34/97/02/334349702.db2.gz KMQVTAMLKNXEBR-UHFFFAOYSA-N 1 2 307.224 4.553 20 0 DJADLO Clc1ccc(C[N@@H+](Cc2ccncc2)C2CC2)c(Cl)c1 ZINC000534939771 334349704 /nfs/dbraw/zinc/34/97/04/334349704.db2.gz KMQVTAMLKNXEBR-UHFFFAOYSA-N 1 2 307.224 4.553 20 0 DJADLO Clc1ccc(Cl)c(C[N@H+](Cc2cccnc2)C2CC2)c1 ZINC000534939647 334349800 /nfs/dbraw/zinc/34/98/00/334349800.db2.gz BMJUHARSRFETSD-UHFFFAOYSA-N 1 2 307.224 4.553 20 0 DJADLO Clc1ccc(Cl)c(C[N@@H+](Cc2cccnc2)C2CC2)c1 ZINC000534939647 334349801 /nfs/dbraw/zinc/34/98/01/334349801.db2.gz BMJUHARSRFETSD-UHFFFAOYSA-N 1 2 307.224 4.553 20 0 DJADLO Cc1ccccc1-c1cnc(C[N@@H+](Cc2ccco2)C(C)C)o1 ZINC000535259692 334383331 /nfs/dbraw/zinc/38/33/31/334383331.db2.gz DRDWECWHQAZFEW-UHFFFAOYSA-N 1 2 310.397 4.654 20 0 DJADLO Cc1ccccc1-c1cnc(C[N@H+](Cc2ccco2)C(C)C)o1 ZINC000535259692 334383332 /nfs/dbraw/zinc/38/33/32/334383332.db2.gz DRDWECWHQAZFEW-UHFFFAOYSA-N 1 2 310.397 4.654 20 0 DJADLO Cc1ccc(N[C@H](c2[nH]cc[nH+]2)c2ccc(F)cc2)c(Cl)c1 ZINC000188431609 334711636 /nfs/dbraw/zinc/71/16/36/334711636.db2.gz BKPMJAZOOVYNQG-INIZCTEOSA-N 1 2 315.779 4.712 20 0 DJADLO O=C(Nc1ccccc1Cl)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000112625202 334720044 /nfs/dbraw/zinc/72/00/44/334720044.db2.gz UJVKUUGEGNUFEW-UHFFFAOYSA-N 1 2 324.767 4.780 20 0 DJADLO Clc1cccc([C@@H]2CCCN2c2cc[nH+]c3ccncc32)c1 ZINC000444109714 338468416 /nfs/dbraw/zinc/46/84/16/338468416.db2.gz NTZVIBBKLQKKKR-KRWDZBQOSA-N 1 2 309.800 4.625 20 0 DJADLO Cc1ccc([C@H]2CCCN2c2cc[nH+]c3ccncc32)cc1C ZINC000444109229 338468421 /nfs/dbraw/zinc/46/84/21/338468421.db2.gz BMOCIQKBOZAWOU-LJQANCHMSA-N 1 2 303.409 4.588 20 0 DJADLO CC[C@@H]1CCCN(C(=O)c2cccc(Oc3cc[nH+]cc3)c2)CC1 ZINC000343620845 335182237 /nfs/dbraw/zinc/18/22/37/335182237.db2.gz MMYYHGWVGVCELW-MRXNPFEDSA-N 1 2 324.424 4.526 20 0 DJADLO CCC[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccc(F)cc1F ZINC000343680267 335187804 /nfs/dbraw/zinc/18/78/04/335187804.db2.gz DUODYAKFTVINCS-OAHLLOKOSA-N 1 2 322.424 4.930 20 0 DJADLO C[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1c(F)cccc1Cl ZINC000343688041 335188407 /nfs/dbraw/zinc/18/84/07/335188407.db2.gz KGLBHMZSPDRVEI-SECBINFHSA-N 1 2 310.825 4.664 20 0 DJADLO CCc1c[nH+]ccc1[C@@H](C)[C@@H](Cc1ccccn1)c1cccnc1 ZINC000345843081 335354891 /nfs/dbraw/zinc/35/48/91/335354891.db2.gz TVCKBXGSUMKRSF-IIBYNOLFSA-N 1 2 317.436 4.564 20 0 DJADLO CCC(CC)N(CC)C(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000346233121 335386664 /nfs/dbraw/zinc/38/66/64/335386664.db2.gz GVIQMUUCYMXPIO-UHFFFAOYSA-N 1 2 312.413 4.525 20 0 DJADLO C[C@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1ccccc1Cl ZINC000093978007 335695949 /nfs/dbraw/zinc/69/59/49/335695949.db2.gz LZESAKXASZRFKS-NSHDSACASA-N 1 2 308.878 4.945 20 0 DJADLO CC[N@H+](Cc1nc(-c2ccc(C)cc2)cs1)Cc1ccccn1 ZINC000351871945 336074774 /nfs/dbraw/zinc/07/47/74/336074774.db2.gz WQDHXSWVEGANCB-UHFFFAOYSA-N 1 2 323.465 4.536 20 0 DJADLO CC[N@@H+](Cc1nc(-c2ccc(C)cc2)cs1)Cc1ccccn1 ZINC000351871945 336074776 /nfs/dbraw/zinc/07/47/76/336074776.db2.gz WQDHXSWVEGANCB-UHFFFAOYSA-N 1 2 323.465 4.536 20 0 DJADLO Cc1ccc([C@H](C)[NH2+]Cc2noc(C3CCCCC3)n2)c(C)c1 ZINC000332326285 336168614 /nfs/dbraw/zinc/16/86/14/336168614.db2.gz SPHUYXBIOWAFHG-HNNXBMFYSA-N 1 2 313.445 4.585 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H]1CCC(C)(C)c2ccccc21 ZINC000351923448 336179007 /nfs/dbraw/zinc/17/90/07/336179007.db2.gz WGBKRUHPLCODPZ-KRWDZBQOSA-N 1 2 323.440 4.633 20 0 DJADLO CC[C@H](NC(=O)Nc1c(C)cc[nH+]c1C)c1ccc(Cl)cc1 ZINC000351931715 336180685 /nfs/dbraw/zinc/18/06/85/336180685.db2.gz UANLYCHFVONMPG-HNNXBMFYSA-N 1 2 317.820 4.625 20 0 DJADLO CCc1ccc([C@@H](C)[NH2+]Cc2nc3cc(Cl)ccc3s2)o1 ZINC000532465930 336249291 /nfs/dbraw/zinc/24/92/91/336249291.db2.gz XHPILZNFJMUYCR-SNVBAGLBSA-N 1 2 320.845 4.956 20 0 DJADLO Cc1ccc(C[N@H+](Cc2ccco2)Cc2ccc(C)s2)o1 ZINC000352821318 336256838 /nfs/dbraw/zinc/25/68/38/336256838.db2.gz AXDUXWFZCFFPJK-UHFFFAOYSA-N 1 2 301.411 4.753 20 0 DJADLO Cc1ccc(C[N@@H+](Cc2ccco2)Cc2ccc(C)s2)o1 ZINC000352821318 336256839 /nfs/dbraw/zinc/25/68/39/336256839.db2.gz AXDUXWFZCFFPJK-UHFFFAOYSA-N 1 2 301.411 4.753 20 0 DJADLO Cc1cccn2cc(-c3ccc(NCc4ccco4)cc3)[nH+]c12 ZINC000532728081 336267772 /nfs/dbraw/zinc/26/77/72/336267772.db2.gz MLEXWVGHUJFRSF-UHFFFAOYSA-N 1 2 303.365 4.515 20 0 DJADLO CC[C@H](c1ccccc1)[N@@H+](Cc1nnsc1Cl)CC(C)C ZINC000532715551 336268053 /nfs/dbraw/zinc/26/80/53/336268053.db2.gz SQFILERDJJWEMC-OAHLLOKOSA-N 1 2 323.893 4.801 20 0 DJADLO CC[C@H](c1ccccc1)[N@H+](Cc1nnsc1Cl)CC(C)C ZINC000532715551 336268054 /nfs/dbraw/zinc/26/80/54/336268054.db2.gz SQFILERDJJWEMC-OAHLLOKOSA-N 1 2 323.893 4.801 20 0 DJADLO C[C@H]([NH2+]Cc1ncc(Cl)cc1Cl)c1cc2ccccc2o1 ZINC000182647801 336278364 /nfs/dbraw/zinc/27/83/64/336278364.db2.gz DNXWQXIZDVGMQN-JTQLQIEISA-N 1 2 321.207 4.985 20 0 DJADLO COc1c(C)ccc(N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)c1C ZINC000325113672 336279360 /nfs/dbraw/zinc/27/93/60/336279360.db2.gz JJHJHBVGOLKAKA-MRXNPFEDSA-N 1 2 321.424 4.671 20 0 DJADLO Cc1cc(C)cc([C@H](C)Nc2cc(C)[nH+]c(-c3cccnc3)n2)c1 ZINC000301185204 336293828 /nfs/dbraw/zinc/29/38/28/336293828.db2.gz JQFRTOLKGUDXAF-INIZCTEOSA-N 1 2 318.424 4.637 20 0 DJADLO C[C@H](Nc1cc[nH+]c(C2CC2)n1)c1ccc(-c2ccncc2)cc1 ZINC000301420092 336305601 /nfs/dbraw/zinc/30/56/01/336305601.db2.gz DUMYTWPMYZEIFA-AWEZNQCLSA-N 1 2 316.408 4.589 20 0 DJADLO CC(C)(C)c1nc(N[C@@H]2CCSc3ccc(F)cc32)cc[nH+]1 ZINC000301503930 336310983 /nfs/dbraw/zinc/31/09/83/336310983.db2.gz GDUWQOOVQDRTPO-CYBMUJFWSA-N 1 2 317.433 4.562 20 0 DJADLO CC(C)(C)c1nc(N[C@H]2CCSc3c(F)cccc32)cc[nH+]1 ZINC000301564078 336315136 /nfs/dbraw/zinc/31/51/36/336315136.db2.gz YSYHBEIHSZPUJS-ZDUSSCGKSA-N 1 2 317.433 4.562 20 0 DJADLO CCC(CC)c1cc(CNc2cc(C(F)(F)F)cc[nH+]2)on1 ZINC000301565644 336315338 /nfs/dbraw/zinc/31/53/38/336315338.db2.gz PUUIKFFBTMELOX-UHFFFAOYSA-N 1 2 313.323 4.604 20 0 DJADLO Cc1cc2ccccc2[nH+]c1N1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000301737417 336326527 /nfs/dbraw/zinc/32/65/27/336326527.db2.gz VUVCMKVFNRUVLG-KDOFPFPSSA-N 1 2 324.449 4.571 20 0 DJADLO Cc1cc(NCc2ccn(C3CCCC3)n2)c2cccc(F)c2[nH+]1 ZINC000301777758 336329155 /nfs/dbraw/zinc/32/91/55/336329155.db2.gz RMSIYADYNHINLS-UHFFFAOYSA-N 1 2 324.403 4.606 20 0 DJADLO CCc1nc([C@H](C)Nc2cc(C(C)C)[nH+]c(C(C)C)n2)cs1 ZINC000301881441 336335932 /nfs/dbraw/zinc/33/59/32/336335932.db2.gz WAVWRWGUVRDOSU-LBPRGKRZSA-N 1 2 318.490 4.915 20 0 DJADLO CC(C)c1cc(N[C@H]2CCOC3(CCCC3)C2)nc(C(C)C)[nH+]1 ZINC000301882577 336336101 /nfs/dbraw/zinc/33/61/01/336336101.db2.gz XEWRBVGHWJRBLX-HNNXBMFYSA-N 1 2 317.477 4.627 20 0 DJADLO CC(C)c1cc(N2C[C@H](C)C[C@@H]2c2cccnc2)nc(C(C)C)[nH+]1 ZINC000302164537 336351819 /nfs/dbraw/zinc/35/18/19/336351819.db2.gz ZLQNSGJYLRZCBO-CRAIPNDOSA-N 1 2 324.472 4.706 20 0 DJADLO FC(F)(F)c1cc[nH+]c(N2CCC(c3ccsc3)CC2)c1 ZINC000302395655 336358148 /nfs/dbraw/zinc/35/81/48/336358148.db2.gz GIZGUGRMRBTWEX-UHFFFAOYSA-N 1 2 312.360 4.546 20 0 DJADLO COc1cccc2c(NCc3ccc(C(F)F)cc3)cc[nH+]c12 ZINC000302506757 336360398 /nfs/dbraw/zinc/36/03/98/336360398.db2.gz DXSJLEHBURFBDC-UHFFFAOYSA-N 1 2 314.335 4.793 20 0 DJADLO CC(C)c1cc(N2CCC(c3ccncc3)CC2)nc(C(C)C)[nH+]1 ZINC000302780297 336368843 /nfs/dbraw/zinc/36/88/43/336368843.db2.gz IMSBGRMLMAWPHF-UHFFFAOYSA-N 1 2 324.472 4.502 20 0 DJADLO Brc1ccsc1CNc1ccc2ccccc2[nH+]1 ZINC000110437114 336396302 /nfs/dbraw/zinc/39/63/02/336396302.db2.gz IHPZPMSNUBAHCV-UHFFFAOYSA-N 1 2 319.227 4.671 20 0 DJADLO CO[C@H](C)c1nc(C[NH2+][C@@H](CCC(C)C)c2ccoc2)cs1 ZINC000353537008 336423319 /nfs/dbraw/zinc/42/33/19/336423319.db2.gz ZEIWWUVBSUEFDE-CJNGLKHVSA-N 1 2 322.474 4.711 20 0 DJADLO Cc1ccc(C(C)(C)[NH2+]Cc2csc(C3CCCC3)n2)cn1 ZINC000353583202 336426876 /nfs/dbraw/zinc/42/68/76/336426876.db2.gz WJPXSFYRCJPTSD-UHFFFAOYSA-N 1 2 315.486 4.529 20 0 DJADLO O=C(CCC[NH+](Cc1ccco1)Cc1ccco1)c1ccccc1 ZINC000357356905 336582300 /nfs/dbraw/zinc/58/23/00/336582300.db2.gz QOCAJTAKFDHQNX-UHFFFAOYSA-N 1 2 323.392 4.538 20 0 DJADLO Cc1ccc(C[NH2+]Cc2nc(-c3cc4ccccc4o3)cs2)o1 ZINC000358970381 336650520 /nfs/dbraw/zinc/65/05/20/336650520.db2.gz UEWDEDHEYZYGHG-UHFFFAOYSA-N 1 2 324.405 4.748 20 0 DJADLO CC(C)[C@H]([NH2+][C@H](c1nccs1)c1ccccc1)c1cccnc1 ZINC000359371250 336669827 /nfs/dbraw/zinc/66/98/27/336669827.db2.gz KNRGWBWAGVFSMX-ROUUACIJSA-N 1 2 323.465 4.614 20 0 DJADLO Cc1ccc([C@@H]([NH2+]Cc2cccc(F)c2F)c2ccccn2)cc1 ZINC000373397568 336959071 /nfs/dbraw/zinc/95/90/71/336959071.db2.gz BIRIXHCYSCAVLW-HXUWFJFHSA-N 1 2 324.374 4.547 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1ccsc1)c1ccc(Cl)cc1)c1ncc[nH]1 ZINC000375895871 337022443 /nfs/dbraw/zinc/02/24/43/337022443.db2.gz QNWVPZGAPUYTGC-IAQYHMDHSA-N 1 2 317.845 4.565 20 0 DJADLO Cc1ccc([C@H](C)[NH2+][C@H](c2nccs2)c2ccccc2)s1 ZINC000123070408 337035024 /nfs/dbraw/zinc/03/50/24/337035024.db2.gz VXTWELNTRMJWMZ-BBRMVZONSA-N 1 2 314.479 4.953 20 0 DJADLO Cc1ccc([C@@H](C)[NH2+][C@H](c2nccs2)c2ccccc2)cc1 ZINC000123343626 337044893 /nfs/dbraw/zinc/04/48/93/337044893.db2.gz GZWXTHLOSNKPQX-QAPCUYQASA-N 1 2 308.450 4.892 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1cc(Cl)cc(Cl)c1)c1cscn1 ZINC000582736560 337127817 /nfs/dbraw/zinc/12/78/17/337127817.db2.gz ANOHVTCLOIWHQE-RKDXNWHRSA-N 1 2 301.242 4.862 20 0 DJADLO C[C@H]([NH2+][C@@H](c1cccc(Cl)c1)c1ccccn1)c1ccoc1 ZINC000178488570 337163002 /nfs/dbraw/zinc/16/30/02/337163002.db2.gz DAAPYCDIFAXSAU-UGSOOPFHSA-N 1 2 312.800 4.768 20 0 DJADLO C[C@@H]([NH2+][C@H](c1ccco1)c1ccccc1)c1ccc(Cl)nc1 ZINC000179098013 337167102 /nfs/dbraw/zinc/16/71/02/337167102.db2.gz YEIRKQGEFCEAEZ-ACJLOTCBSA-N 1 2 312.800 4.768 20 0 DJADLO CC(C)c1csc(C[NH2+][C@@H](c2ccccc2)c2ccccn2)n1 ZINC000180787631 337177888 /nfs/dbraw/zinc/17/78/88/337177888.db2.gz HAJSCCRPTFMCFF-IBGZPJMESA-N 1 2 323.465 4.541 20 0 DJADLO COc1ccsc1[C@H](C)[NH2+][C@@H](c1ccco1)c1ccccc1 ZINC000186088912 337253418 /nfs/dbraw/zinc/25/34/18/337253418.db2.gz ZWAGBJXQEAKBIJ-SUMWQHHRSA-N 1 2 313.422 4.790 20 0 DJADLO COc1cc(C)ccc1[C@@H](C)[NH2+]Cc1cc(-c2ccccc2)on1 ZINC000583178804 337255691 /nfs/dbraw/zinc/25/56/91/337255691.db2.gz OVQKAQWOJOTEGP-OAHLLOKOSA-N 1 2 322.408 4.509 20 0 DJADLO CC(C)Sc1cccc(Cl)c1C[NH2+]Cc1nccs1 ZINC000192489973 337305525 /nfs/dbraw/zinc/30/55/25/337305525.db2.gz ZFVXOBBBCXVYMO-UHFFFAOYSA-N 1 2 312.891 4.587 20 0 DJADLO CC[C@@H]([NH2+][C@H](C)c1noc(-c2ccccc2)n1)c1cccs1 ZINC000124349768 337404933 /nfs/dbraw/zinc/40/49/33/337404933.db2.gz NUCBOMSRZAUROW-TZMCWYRMSA-N 1 2 313.426 4.600 20 0 DJADLO CCCCc1noc([C@H](C)[NH2+][C@@H](C)c2ccc(C3CC3)cc2)n1 ZINC000419332780 337479949 /nfs/dbraw/zinc/47/99/49/337479949.db2.gz DZNUMXYHPBBSCN-KBPBESRZSA-N 1 2 313.445 4.701 20 0 DJADLO FC(F)(F)Cn1cc[nH+]c1CSCCC1=CCCCC1 ZINC000419423193 337483905 /nfs/dbraw/zinc/48/39/05/337483905.db2.gz BJMINKYZUSCVPS-UHFFFAOYSA-N 1 2 304.381 4.569 20 0 DJADLO Cc1cnc([C@@H](C)SCc2ccc(C(C)C)[nH+]c2C)cn1 ZINC000419498185 337485687 /nfs/dbraw/zinc/48/56/87/337485687.db2.gz WFNWFFLODKLAID-CQSZACIVSA-N 1 2 301.459 4.606 20 0 DJADLO C[C@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1cc2ccccc2o1 ZINC000161861075 337598133 /nfs/dbraw/zinc/59/81/33/337598133.db2.gz RNLKDUAFWGEJGH-AWEZNQCLSA-N 1 2 318.376 4.939 20 0 DJADLO CC[C@@H]([NH2+][C@@H](C)c1ncccc1F)c1cc(Cl)ccc1OC ZINC000528036268 337782579 /nfs/dbraw/zinc/78/25/79/337782579.db2.gz QRELISHQHNIEPZ-XHDPSFHLSA-N 1 2 322.811 4.685 20 0 DJADLO Cc1ccc([C@H](C)[NH2+][C@H]2COc3c2ccc(Cl)c3Cl)o1 ZINC000536875532 337790988 /nfs/dbraw/zinc/79/09/88/337790988.db2.gz GXILGKPZYLRADG-CABZTGNLSA-N 1 2 312.196 4.679 20 0 DJADLO Clc1ccccc1C[NH2+]Cc1nc(-c2ccccc2)cs1 ZINC000057997816 337868069 /nfs/dbraw/zinc/86/80/69/337868069.db2.gz SMHVXWHEIMCPQL-UHFFFAOYSA-N 1 2 314.841 4.753 20 0 DJADLO COc1ccccc1[C@@H]([NH2+][C@H](C)c1cccs1)c1ccccn1 ZINC000090913495 337887113 /nfs/dbraw/zinc/88/71/13/337887113.db2.gz FGJNPBCUXXRPAU-AUUYWEPGSA-N 1 2 324.449 4.592 20 0 DJADLO CC(C)CCc1nc(C[NH2+][C@H](C)c2cccc(F)c2F)cs1 ZINC000537128554 337894215 /nfs/dbraw/zinc/89/42/15/337894215.db2.gz LFMSKEAHXCTEEN-GFCCVEGCSA-N 1 2 324.440 4.861 20 0 DJADLO c1ccc(N2Cc3cccc(NC4CCCCCC4)c3C2)[nH+]c1 ZINC000537326124 337931123 /nfs/dbraw/zinc/93/11/23/337931123.db2.gz QQAZXKJISPASMW-UHFFFAOYSA-N 1 2 307.441 4.737 20 0 DJADLO Fc1cc(N[C@H](c2ccccc2)C2CC2)ccc1-n1cc[nH+]c1 ZINC000537530701 337940761 /nfs/dbraw/zinc/94/07/61/337940761.db2.gz LMBMJHXJBNKZRI-LJQANCHMSA-N 1 2 307.372 4.575 20 0 DJADLO Cc1cccn2cc(CS[C@H](C)c3nc4ccccc4o3)[nH+]c12 ZINC000537600366 337945069 /nfs/dbraw/zinc/94/50/69/337945069.db2.gz IJIQASHOHXITLJ-CYBMUJFWSA-N 1 2 323.421 4.778 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)sc1Cl)c1cscn1 ZINC000514799320 337971791 /nfs/dbraw/zinc/97/17/91/337971791.db2.gz QUOZUFGKTPLAHT-NKWVEPMBSA-N 1 2 307.271 4.923 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H](C)c1cccc(CC(C)C)c1 ZINC000425597670 338015954 /nfs/dbraw/zinc/01/59/54/338015954.db2.gz UGRDDPCZVHCWRL-HNNXBMFYSA-N 1 2 310.441 4.639 20 0 DJADLO CCc1nc(C[NH2+][C@H](C)c2cc3ccc(C)cc3o2)cs1 ZINC000426021418 338019632 /nfs/dbraw/zinc/01/96/32/338019632.db2.gz LIPJTPAVZCGRHE-GFCCVEGCSA-N 1 2 300.427 4.611 20 0 DJADLO Cc1ccoc1C[NH2+][C@@H](C)c1csc(-c2ccccc2F)n1 ZINC000426286952 338024601 /nfs/dbraw/zinc/02/46/01/338024601.db2.gz UJLZMJYJJKMALS-LBPRGKRZSA-N 1 2 316.401 4.701 20 0 DJADLO C[C@H]([NH2+]Cc1ccc(-c2ccccc2)cc1F)c1nccs1 ZINC000426286406 338024631 /nfs/dbraw/zinc/02/46/31/338024631.db2.gz NSNXRGIBCKZWNO-ZDUSSCGKSA-N 1 2 312.413 4.800 20 0 DJADLO Cc1ccoc1C[NH2+][C@H](c1cc2ccccc2o1)c1cccnc1 ZINC000426332957 338027595 /nfs/dbraw/zinc/02/75/95/338027595.db2.gz SSPIBABNOLPHAK-FQEVSTJZSA-N 1 2 318.376 4.608 20 0 DJADLO Cc1nc(C(C)C)oc1C[NH2+][C@@H](C)c1c(F)cccc1Cl ZINC000428350823 338048420 /nfs/dbraw/zinc/04/84/20/338048420.db2.gz WJCOTVSUEFYGSL-NSHDSACASA-N 1 2 310.800 4.750 20 0 DJADLO Fc1ccc2nc(C[NH2+]Cc3c(F)cccc3Cl)sc2c1 ZINC000428865434 338063184 /nfs/dbraw/zinc/06/31/84/338063184.db2.gz FACPXPCWKCNVCW-UHFFFAOYSA-N 1 2 324.783 4.518 20 0 DJADLO CCc1nc([C@@H](C)[NH2+]Cc2ccc(C(F)(F)F)s2)cs1 ZINC000428891423 338064719 /nfs/dbraw/zinc/06/47/19/338064719.db2.gz XVCOQLGOIMCPBT-MRVPVSSYSA-N 1 2 320.405 4.637 20 0 DJADLO CC(C)([NH2+]Cc1ncc(-c2cccs2)o1)c1ccccc1F ZINC000429262396 338075186 /nfs/dbraw/zinc/07/51/86/338075186.db2.gz FKIBNZYSLZZQMM-UHFFFAOYSA-N 1 2 316.401 4.567 20 0 DJADLO Cc1ccc(-c2cnc(C[NH2+]C(C)(C)c3ccccc3F)o2)cc1 ZINC000429271515 338075454 /nfs/dbraw/zinc/07/54/54/338075454.db2.gz LKSKWBGABZLLKK-UHFFFAOYSA-N 1 2 324.399 4.814 20 0 DJADLO CC[C@@](C)([NH2+]Cc1c(Cl)cccc1OC)c1nc(C)cs1 ZINC000429699220 338087589 /nfs/dbraw/zinc/08/75/89/338087589.db2.gz OETPRFTYTAXZOD-MRXNPFEDSA-N 1 2 324.877 4.529 20 0 DJADLO CC1(C)C[N@H+](Cc2cccc(C(F)(F)F)c2)[C@@H]1c1cccnc1 ZINC000430085006 338095331 /nfs/dbraw/zinc/09/53/31/338095331.db2.gz LOVHUUUWYSTRII-MRXNPFEDSA-N 1 2 320.358 4.684 20 0 DJADLO CC1(C)C[N@@H+](Cc2cccc(C(F)(F)F)c2)[C@@H]1c1cccnc1 ZINC000430085006 338095332 /nfs/dbraw/zinc/09/53/32/338095332.db2.gz LOVHUUUWYSTRII-MRXNPFEDSA-N 1 2 320.358 4.684 20 0 DJADLO C[C@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1csc(Cl)c1 ZINC000430732864 338112626 /nfs/dbraw/zinc/11/26/26/338112626.db2.gz HOTUTZMSYQWYRL-LURJTMIESA-N 1 2 323.742 4.809 20 0 DJADLO CCc1noc(C)c1C[N@@H+]1CCCC[C@H]1c1ccc(F)cc1F ZINC000432017360 338143765 /nfs/dbraw/zinc/14/37/65/338143765.db2.gz BYHVXUGQPGNNPA-SFHVURJKSA-N 1 2 320.383 4.551 20 0 DJADLO CCc1noc(C)c1C[N@H+]1CCCC[C@H]1c1ccc(F)cc1F ZINC000432017360 338143766 /nfs/dbraw/zinc/14/37/66/338143766.db2.gz BYHVXUGQPGNNPA-SFHVURJKSA-N 1 2 320.383 4.551 20 0 DJADLO CC(F)(F)c1ccc(CNc2cc(C(F)(F)F)cc[nH+]2)cc1 ZINC000432138767 338146747 /nfs/dbraw/zinc/14/67/47/338146747.db2.gz YFQGKDPYWRSXOA-UHFFFAOYSA-N 1 2 316.273 4.824 20 0 DJADLO Cc1csc([C@@H](C)[NH2+]Cc2csc(Cl)c2Cl)n1 ZINC000432242643 338150148 /nfs/dbraw/zinc/15/01/48/338150148.db2.gz MUULJMCHYFIGMJ-SSDOTTSWSA-N 1 2 307.271 4.671 20 0 DJADLO Cc1cnc([C@H](C)[NH2+]Cc2ccc(F)c(Cl)c2Cl)s1 ZINC000432250153 338150891 /nfs/dbraw/zinc/15/08/91/338150891.db2.gz IUZLBJBYKGDQNC-QMMMGPOBSA-N 1 2 319.232 4.748 20 0 DJADLO Cc1ccc(CNc2ccc(Br)c(C)c2F)c(C)[nH+]1 ZINC000432697385 338163405 /nfs/dbraw/zinc/16/34/05/338163405.db2.gz WNJIJMAGROIHFP-UHFFFAOYSA-N 1 2 323.209 4.521 20 0 DJADLO Cc1noc(C)c1CNc1ccc(-c2ccc(Cl)s2)c[nH+]1 ZINC000432729684 338164522 /nfs/dbraw/zinc/16/45/22/338164522.db2.gz HTWFVCFKYRWUDY-UHFFFAOYSA-N 1 2 319.817 4.680 20 0 DJADLO Cc1ncsc1CNc1ccc(-c2ccc(Cl)s2)c[nH+]1 ZINC000432731968 338164632 /nfs/dbraw/zinc/16/46/32/338164632.db2.gz RUJBAPCCABYCEB-UHFFFAOYSA-N 1 2 321.858 4.841 20 0 DJADLO Cc1ccc(C[N@H+](Cc2cocn2)[C@H]2CCc3ccccc32)cc1 ZINC000432736212 338165054 /nfs/dbraw/zinc/16/50/54/338165054.db2.gz BXPYJMCCBULESK-NRFANRHFSA-N 1 2 318.420 4.673 20 0 DJADLO Cc1ccc(C[N@@H+](Cc2cocn2)[C@H]2CCc3ccccc32)cc1 ZINC000432736212 338165055 /nfs/dbraw/zinc/16/50/55/338165055.db2.gz BXPYJMCCBULESK-NRFANRHFSA-N 1 2 318.420 4.673 20 0 DJADLO CC[C@@H](C)Oc1cccc(NC(=O)Nc2ccc(C)[nH+]c2C)c1 ZINC000433018975 338176433 /nfs/dbraw/zinc/17/64/33/338176433.db2.gz HKCAYZCPWMTDJZ-CYBMUJFWSA-N 1 2 313.401 4.520 20 0 DJADLO Cc1ccc(CN2CC[C@@H](C(F)(F)F)c3ccccc32)c(C)[nH+]1 ZINC000433028895 338177215 /nfs/dbraw/zinc/17/72/15/338177215.db2.gz QFVGHAUCJKRXET-MRXNPFEDSA-N 1 2 320.358 4.755 20 0 DJADLO CC(C)[C@@H]([NH2+][C@H](C)c1nc(C2CC2)no1)c1ccc(Cl)cc1 ZINC000433782600 338201673 /nfs/dbraw/zinc/20/16/73/338201673.db2.gz JRVOOSAUDDFRCB-IAQYHMDHSA-N 1 2 319.836 4.648 20 0 DJADLO Cc1cccc2[nH+]c(CSc3nc(-c4ccccc4)co3)cn21 ZINC000436240413 338263035 /nfs/dbraw/zinc/26/30/35/338263035.db2.gz AQLINIDHERMGCJ-UHFFFAOYSA-N 1 2 321.405 4.590 20 0 DJADLO CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)[NH+]1Cc2ccccc2C1 ZINC000155529097 338287801 /nfs/dbraw/zinc/28/78/01/338287801.db2.gz YXBWUNYDQHAYAN-CVEARBPZSA-N 1 2 322.452 4.543 20 0 DJADLO Clc1ccc2nc([C@@H]3CCC[N@@H+]3Cc3cccs3)[nH]c2c1 ZINC000438285820 338338725 /nfs/dbraw/zinc/33/87/25/338338725.db2.gz SGQWHBNRKWKQCV-HNNXBMFYSA-N 1 2 317.845 4.615 20 0 DJADLO Clc1ccc2nc([C@@H]3CCC[N@H+]3Cc3cccs3)[nH]c2c1 ZINC000438285820 338338726 /nfs/dbraw/zinc/33/87/26/338338726.db2.gz SGQWHBNRKWKQCV-HNNXBMFYSA-N 1 2 317.845 4.615 20 0 DJADLO Cc1cc(Cl)ccc1NCc1c[nH+]cn1Cc1ccccc1 ZINC000438303512 338339120 /nfs/dbraw/zinc/33/91/20/338339120.db2.gz SLDKXFKVPVKESJ-UHFFFAOYSA-N 1 2 311.816 4.505 20 0 DJADLO c1[nH+]cn(Cc2ccccc2)c1CNc1csc2ccccc12 ZINC000438315496 338339352 /nfs/dbraw/zinc/33/93/52/338339352.db2.gz MGUSMAXCAPFZSL-UHFFFAOYSA-N 1 2 319.433 4.758 20 0 DJADLO C[C@H](SCc1cn2ccccc2[nH+]1)c1ccc(F)c(F)c1 ZINC000439522657 338372372 /nfs/dbraw/zinc/37/23/72/338372372.db2.gz CTDZPHOELKOJFN-NSHDSACASA-N 1 2 304.365 4.607 20 0 DJADLO c1c[nH+]c([C@H](Nc2cccc3ccsc32)c2ccccc2)[nH]1 ZINC000446880593 338539176 /nfs/dbraw/zinc/53/91/76/338539176.db2.gz FSUCIGOWMFUDKY-MRXNPFEDSA-N 1 2 305.406 4.826 20 0 DJADLO Fc1ccc([C@H](Nc2cccc3ccsc32)c2[nH]cc[nH+]2)cc1 ZINC000446880917 338539198 /nfs/dbraw/zinc/53/91/98/338539198.db2.gz KKVIPMJGWSDIJB-INIZCTEOSA-N 1 2 323.396 4.965 20 0 DJADLO CC[C@@H](c1ccccc1)N(CC)C(=O)Nc1ccc(C)[nH+]c1C ZINC000447186090 338547109 /nfs/dbraw/zinc/54/71/09/338547109.db2.gz KQBHFYYOSSRJTG-SFHVURJKSA-N 1 2 311.429 4.704 20 0 DJADLO Cc1ccccc1[C@H](CC(F)(F)F)[NH2+][C@@H](C)c1nccs1 ZINC000447564835 338557258 /nfs/dbraw/zinc/55/72/58/338557258.db2.gz HMVIYDWCRYMTNB-AAEUAGOBSA-N 1 2 314.376 4.796 20 0 DJADLO Fc1ccccc1C1([NH2+][C@H]2CCc3cc(F)c(F)c(F)c32)CC1 ZINC000449161953 338598207 /nfs/dbraw/zinc/59/82/07/338598207.db2.gz QGTDDDXXOUNPRX-AWEZNQCLSA-N 1 2 321.317 4.509 20 0 DJADLO CC(C)N(C)c1ccc(CNc2ccccc2C(C)(F)F)c[nH+]1 ZINC000449478480 338628948 /nfs/dbraw/zinc/62/89/48/338628948.db2.gz YHLMHKCWIHVNBF-UHFFFAOYSA-N 1 2 319.399 4.650 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)c2ccccc21)c1csnn1 ZINC000450778308 338705062 /nfs/dbraw/zinc/70/50/62/338705062.db2.gz UDZRQZVMXPJLFH-WDEREUQCSA-N 1 2 317.845 4.757 20 0 DJADLO Fc1ccc([C@H]([NH2+]Cc2ncc(C3CC3)o2)C2CC2)cc1Cl ZINC000451355222 338730940 /nfs/dbraw/zinc/73/09/40/338730940.db2.gz PFEXJOACHBZUAV-QGZVFWFLSA-N 1 2 320.795 4.585 20 0 DJADLO CC(C)c1nc2ccc(N[C@H]3C[C@@H](C)n4cc[nH+]c43)cc2s1 ZINC000453186073 338804461 /nfs/dbraw/zinc/80/44/61/338804461.db2.gz LRJFOULGTCKNFG-RISCZKNCSA-N 1 2 312.442 4.734 20 0 DJADLO Fc1ccc([C@@H]([NH2+]Cc2cnc(C3CC3)o2)c2ccccc2)cc1 ZINC000453366444 338832526 /nfs/dbraw/zinc/83/25/26/338832526.db2.gz RURFCPMZFHXDPE-IBGZPJMESA-N 1 2 322.383 4.570 20 0 DJADLO Cc1ccc([C@H]2CCCN2C(=O)Nc2c(C)cc(C)[nH+]c2C)cc1 ZINC000455476029 338895721 /nfs/dbraw/zinc/89/57/21/338895721.db2.gz LBCNHMYCTHELDP-GOSISDBHSA-N 1 2 323.440 4.684 20 0 DJADLO c1csc([C@H]([NH2+]Cc2ccc(C3CC3)cc2)c2ccccc2)n1 ZINC000459407850 339027497 /nfs/dbraw/zinc/02/74/97/339027497.db2.gz WPYMEFWXDRXNJO-LJQANCHMSA-N 1 2 320.461 4.900 20 0 DJADLO CCCCc1nc(C[NH2+][C@H](C)c2cc(C)ccc2OC)cs1 ZINC000459655566 339040815 /nfs/dbraw/zinc/04/08/15/339040815.db2.gz IZJNGMRAPSDZND-CQSZACIVSA-N 1 2 318.486 4.654 20 0 DJADLO COCC[C@H](C)SCCCCCn1c(C)[nH+]c2ccccc21 ZINC000461248555 339060861 /nfs/dbraw/zinc/06/08/61/339060861.db2.gz PNKOFAAKKLMAFJ-HNNXBMFYSA-N 1 2 320.502 4.673 20 0 DJADLO Cc1cccn2cc(CNc3ccc(C(F)(F)F)c(C)c3)[nH+]c12 ZINC000462180700 339073355 /nfs/dbraw/zinc/07/33/55/339073355.db2.gz ZXQLNZSPUJIBSE-UHFFFAOYSA-N 1 2 319.330 4.582 20 0 DJADLO Cc1nc(N[C@@H](c2cccs2)c2ccc(Cl)cc2)cc[nH+]1 ZINC000462378221 339077435 /nfs/dbraw/zinc/07/74/35/339077435.db2.gz RJBKFAUCLAFNQL-MRXNPFEDSA-N 1 2 315.829 4.701 20 0 DJADLO Cc1nc(N[C@H](c2cccs2)c2ccc(Cl)cc2)cc[nH+]1 ZINC000462378220 339077494 /nfs/dbraw/zinc/07/74/94/339077494.db2.gz RJBKFAUCLAFNQL-INIZCTEOSA-N 1 2 315.829 4.701 20 0 DJADLO Cc1nc([C@@H](C)[NH2+][C@@H](c2ccc(F)cc2F)C(C)C)cs1 ZINC000462806435 339090230 /nfs/dbraw/zinc/09/02/30/339090230.db2.gz PJUOZGCRQYZBEE-QLJPJBMISA-N 1 2 310.413 4.778 20 0 DJADLO Cc1nc([C@@H](C)[NH2+][C@@H](C)c2nc(C(C)(C)C)cs2)cs1 ZINC000462823059 339092265 /nfs/dbraw/zinc/09/22/65/339092265.db2.gz YDWARRVCHDARDJ-ZJUUUORDSA-N 1 2 309.504 4.617 20 0 DJADLO c1cn(-c2csc(CNc3cccc(C4CCC4)c3)c2)c[nH+]1 ZINC000462861683 339094873 /nfs/dbraw/zinc/09/48/73/339094873.db2.gz LUZIWGDXPCLFRC-UHFFFAOYSA-N 1 2 309.438 4.813 20 0 DJADLO Fc1ccccc1C1C[NH+](Cc2ncc(-c3ccccc3)s2)C1 ZINC000463043657 339102823 /nfs/dbraw/zinc/10/28/23/339102823.db2.gz OSNGFWQNOZYIMH-UHFFFAOYSA-N 1 2 324.424 4.549 20 0 DJADLO C[C@H](SCc1[nH+]ccn1C)c1ccc(Cl)c(Cl)c1 ZINC000463192885 339108836 /nfs/dbraw/zinc/10/88/36/339108836.db2.gz MPPYUXPNFKKZOZ-VIFPVBQESA-N 1 2 301.242 4.721 20 0 DJADLO COc1ccccc1[C@H](C)SCc1c(C)[nH+]c2ccccn21 ZINC000463206521 339109331 /nfs/dbraw/zinc/10/93/31/339109331.db2.gz PRAVMINPUFYRQT-AWEZNQCLSA-N 1 2 312.438 4.646 20 0 DJADLO C[C@H]1C[C@H](c2ccccc2F)[N@H+](Cc2ncc(C(C)(C)C)o2)C1 ZINC000464727976 339150211 /nfs/dbraw/zinc/15/02/11/339150211.db2.gz BYWOSWDGOZNPBC-XJKSGUPXSA-N 1 2 316.420 4.694 20 0 DJADLO C[C@H]1C[C@H](c2ccccc2F)[N@@H+](Cc2ncc(C(C)(C)C)o2)C1 ZINC000464727976 339150212 /nfs/dbraw/zinc/15/02/12/339150212.db2.gz BYWOSWDGOZNPBC-XJKSGUPXSA-N 1 2 316.420 4.694 20 0 DJADLO C[C@@H]1CC[N@H+](Cc2ncc(C(C)(C)C)o2)[C@@H](c2ccco2)C1 ZINC000464851372 339157933 /nfs/dbraw/zinc/15/79/33/339157933.db2.gz GKCGDTJKUOHDMD-ZIAGYGMSSA-N 1 2 302.418 4.538 20 0 DJADLO C[C@@H]1CC[N@@H+](Cc2ncc(C(C)(C)C)o2)[C@@H](c2ccco2)C1 ZINC000464851372 339157934 /nfs/dbraw/zinc/15/79/34/339157934.db2.gz GKCGDTJKUOHDMD-ZIAGYGMSSA-N 1 2 302.418 4.538 20 0 DJADLO COCc1ccc([C@H]2CCC[N@@H+]2Cc2cccc(Cl)c2F)o1 ZINC000467203385 339228116 /nfs/dbraw/zinc/22/81/16/339228116.db2.gz XPLZWFJLCGHFLZ-OAHLLOKOSA-N 1 2 323.795 4.556 20 0 DJADLO COCc1ccc([C@H]2CCC[N@H+]2Cc2cccc(Cl)c2F)o1 ZINC000467203385 339228117 /nfs/dbraw/zinc/22/81/17/339228117.db2.gz XPLZWFJLCGHFLZ-OAHLLOKOSA-N 1 2 323.795 4.556 20 0 DJADLO Cc1nc2ccc(N[C@H]3CCC[C@H](c4[nH+]cccc4C)C3)cc2o1 ZINC000467357859 339233773 /nfs/dbraw/zinc/23/37/73/339233773.db2.gz ZFEJWWMVMIELSC-HOTGVXAUSA-N 1 2 321.424 4.978 20 0 DJADLO COCCc1ccccc1N[C@H]1CCC[C@H](c2[nH+]cccc2C)C1 ZINC000467360688 339234071 /nfs/dbraw/zinc/23/40/71/339234071.db2.gz ZFCJZEDFQFQIRW-OALUTQOASA-N 1 2 324.468 4.717 20 0 DJADLO COCc1cccc(N[C@@H]2CCC[C@@H](c3[nH+]cccc3C)C2)c1 ZINC000467374638 339235126 /nfs/dbraw/zinc/23/51/26/339235126.db2.gz ZFZQCTLNODOGGD-IEBWSBKVSA-N 1 2 310.441 4.675 20 0 DJADLO C[C@@H]1C[C@H](c2ccccc2)CC[N@@H+]1Cc1ncc(Cl)s1 ZINC000467549823 339241881 /nfs/dbraw/zinc/24/18/81/339241881.db2.gz CWPQKXWIYVXJKM-TZMCWYRMSA-N 1 2 306.862 4.565 20 0 DJADLO C[C@@H]1C[C@H](c2ccccc2)CC[N@H+]1Cc1ncc(Cl)s1 ZINC000467549823 339241882 /nfs/dbraw/zinc/24/18/82/339241882.db2.gz CWPQKXWIYVXJKM-TZMCWYRMSA-N 1 2 306.862 4.565 20 0 DJADLO Cc1cccn2cc(CNc3cc(C(F)(F)F)ccc3C)[nH+]c12 ZINC000467730046 339245018 /nfs/dbraw/zinc/24/50/18/339245018.db2.gz BAWPYYRXRBGDQU-UHFFFAOYSA-N 1 2 319.330 4.582 20 0 DJADLO C[C@H](c1ccccc1Cl)[N@@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000468127964 339254829 /nfs/dbraw/zinc/25/48/29/339254829.db2.gz CSRPQQIDZYOWBV-MLGOLLRUSA-N 1 2 307.846 4.536 20 0 DJADLO C[C@H](c1ccccc1Cl)[N@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000468127964 339254830 /nfs/dbraw/zinc/25/48/30/339254830.db2.gz CSRPQQIDZYOWBV-MLGOLLRUSA-N 1 2 307.846 4.536 20 0 DJADLO CC1(C)CCC(SCc2[nH+]ccn2CC(F)(F)F)CC1 ZINC000468388440 339261302 /nfs/dbraw/zinc/26/13/02/339261302.db2.gz UBDLCJKRJYQUNH-UHFFFAOYSA-N 1 2 306.397 4.647 20 0 DJADLO C[C@@H]1CC[C@H](CC(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)C1 ZINC000468924064 339274867 /nfs/dbraw/zinc/27/48/67/339274867.db2.gz KUBRCPFGRJAEDQ-CABCVRRESA-N 1 2 310.397 4.639 20 0 DJADLO CC[C@H]([NH2+][C@H]1CC=C(c2ccc(F)cc2)CC1)C(F)(F)F ZINC000469045368 339278463 /nfs/dbraw/zinc/27/84/63/339278463.db2.gz OQOLZZNNSGLYTH-GJZGRUSLSA-N 1 2 301.327 4.692 20 0 DJADLO C[C@H](c1ccccc1Cl)[N@H+](Cc1ccc(F)cn1)C1CC1 ZINC000469579082 339293613 /nfs/dbraw/zinc/29/36/13/339293613.db2.gz RWOUXZVUMFCTDU-GFCCVEGCSA-N 1 2 304.796 4.600 20 0 DJADLO C[C@H](c1ccccc1Cl)[N@@H+](Cc1ccc(F)cn1)C1CC1 ZINC000469579082 339293614 /nfs/dbraw/zinc/29/36/14/339293614.db2.gz RWOUXZVUMFCTDU-GFCCVEGCSA-N 1 2 304.796 4.600 20 0 DJADLO C[C@H]([NH2+]Cc1ccc(F)cn1)c1cc(F)c(Cl)cc1Cl ZINC000469759474 339297999 /nfs/dbraw/zinc/29/79/99/339297999.db2.gz ZMDQQXWLUFBKKE-QMMMGPOBSA-N 1 2 317.166 4.517 20 0 DJADLO CC(C)c1nc([C@@H](C)[NH2+]C2(c3ccc(F)cc3)CC2)cs1 ZINC000469781124 339299519 /nfs/dbraw/zinc/29/95/19/339299519.db2.gz SKCRWTKNWRHZBK-GFCCVEGCSA-N 1 2 304.434 4.746 20 0 DJADLO Cc1ccc2c(c1C)OC[C@H]2[NH2+][C@H](C)c1csc(C(C)C)n1 ZINC000469789389 339300115 /nfs/dbraw/zinc/30/01/15/339300115.db2.gz YIWNKTOQVFJLAE-UKRRQHHQSA-N 1 2 316.470 4.668 20 0 DJADLO Cc1ccc(NC(=O)N2CCCC3(CCCCC3)CC2)c(C)[nH+]1 ZINC000470407128 339319204 /nfs/dbraw/zinc/31/92/04/339319204.db2.gz HOPFUBJNQWQDRF-UHFFFAOYSA-N 1 2 315.461 4.667 20 0 DJADLO C[C@@H]1COC[C@@H](c2ccccc2)[N@@H+]1Cc1cccc(C(F)F)c1 ZINC000470762091 339327004 /nfs/dbraw/zinc/32/70/04/339327004.db2.gz OPGFEDSJROAEJR-KDOFPFPSSA-N 1 2 317.379 4.586 20 0 DJADLO C[C@@H]1COC[C@@H](c2ccccc2)[N@H+]1Cc1cccc(C(F)F)c1 ZINC000470762091 339327005 /nfs/dbraw/zinc/32/70/05/339327005.db2.gz OPGFEDSJROAEJR-KDOFPFPSSA-N 1 2 317.379 4.586 20 0 DJADLO CSc1ccccc1C[N@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000470993912 339333982 /nfs/dbraw/zinc/33/39/82/339333982.db2.gz DLDGDLBXUGADDZ-UHFFFAOYSA-N 1 2 320.527 4.795 20 0 DJADLO CSc1ccccc1C[N@@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000470993912 339333983 /nfs/dbraw/zinc/33/39/83/339333983.db2.gz DLDGDLBXUGADDZ-UHFFFAOYSA-N 1 2 320.527 4.795 20 0 DJADLO CSc1ccccc1C[N@H+](C)[C@H](C)c1ncc(C(C)(C)C)o1 ZINC000471003621 339334183 /nfs/dbraw/zinc/33/41/83/339334183.db2.gz FSDVFLDQPVZRFD-CYBMUJFWSA-N 1 2 318.486 4.887 20 0 DJADLO CSc1ccccc1C[N@@H+](C)[C@H](C)c1ncc(C(C)(C)C)o1 ZINC000471003621 339334184 /nfs/dbraw/zinc/33/41/84/339334184.db2.gz FSDVFLDQPVZRFD-CYBMUJFWSA-N 1 2 318.486 4.887 20 0 DJADLO Cc1cccc(C(=O)Nc2ccc3[nH]c(C4CCC4)[nH+]c3c2)c1F ZINC000471044656 339335444 /nfs/dbraw/zinc/33/54/44/339335444.db2.gz SXAUBLWXFVINOV-UHFFFAOYSA-N 1 2 323.371 4.530 20 0 DJADLO Cc1ccc([C@@H]([NH2+]Cc2c(F)cccc2F)c2ccccn2)cc1 ZINC000471064276 339336262 /nfs/dbraw/zinc/33/62/62/339336262.db2.gz CGSPCCVLKPBKMZ-HXUWFJFHSA-N 1 2 324.374 4.547 20 0 DJADLO C[C@H]([NH2+]Cc1ncc(Cl)s1)c1ccccc1C(F)(F)F ZINC000472050410 339360932 /nfs/dbraw/zinc/36/09/32/339360932.db2.gz YIIHTHFFTZVIJX-QMMMGPOBSA-N 1 2 320.767 4.666 20 0 DJADLO CC[C@H](C)Oc1cc(C)ccc1C[NH2+]Cc1ncc(Cl)s1 ZINC000472051570 339360989 /nfs/dbraw/zinc/36/09/89/339360989.db2.gz GZMZVCJVQAGVSE-LBPRGKRZSA-N 1 2 324.877 4.572 20 0 DJADLO C[N@H+](Cc1nccs1)Cc1ccccc1Oc1ccccc1 ZINC000472452850 339372223 /nfs/dbraw/zinc/37/22/23/339372223.db2.gz DYPGVCBVTHENAD-UHFFFAOYSA-N 1 2 310.422 4.567 20 0 DJADLO C[N@@H+](Cc1nccs1)Cc1ccccc1Oc1ccccc1 ZINC000472452850 339372224 /nfs/dbraw/zinc/37/22/24/339372224.db2.gz DYPGVCBVTHENAD-UHFFFAOYSA-N 1 2 310.422 4.567 20 0 DJADLO Cc1ccc([C@H](C)[N@H+](C)Cc2noc(-c3ccccc3C)n2)cc1 ZINC000472755341 339376984 /nfs/dbraw/zinc/37/69/84/339376984.db2.gz UTLCMXOUOFOHIO-INIZCTEOSA-N 1 2 321.424 4.546 20 0 DJADLO Cc1ccc([C@H](C)[N@@H+](C)Cc2noc(-c3ccccc3C)n2)cc1 ZINC000472755341 339376985 /nfs/dbraw/zinc/37/69/85/339376985.db2.gz UTLCMXOUOFOHIO-INIZCTEOSA-N 1 2 321.424 4.546 20 0 DJADLO C[C@H](c1cccc(Cl)c1)[N@@H+]1CCO[C@@H](c2cccs2)C1 ZINC000472833077 339378239 /nfs/dbraw/zinc/37/82/39/339378239.db2.gz XXPDIFMGKRPORY-IUODEOHRSA-N 1 2 307.846 4.536 20 0 DJADLO C[C@H](c1cccc(Cl)c1)[N@H+]1CCO[C@@H](c2cccs2)C1 ZINC000472833077 339378240 /nfs/dbraw/zinc/37/82/40/339378240.db2.gz XXPDIFMGKRPORY-IUODEOHRSA-N 1 2 307.846 4.536 20 0 DJADLO C[C@@H]1CC[N@H+](Cc2ncc(Cl)s2)[C@@H]1c1cccc(F)c1 ZINC000473139071 339382106 /nfs/dbraw/zinc/38/21/06/339382106.db2.gz LWHYZOHYKJZFLP-BMIGLBTASA-N 1 2 310.825 4.519 20 0 DJADLO C[N@H+](Cc1ncc(Cl)s1)Cc1cccc2ccccc21 ZINC000473137932 339382097 /nfs/dbraw/zinc/38/20/97/339382097.db2.gz GSKXMZCWAJNGDX-UHFFFAOYSA-N 1 2 302.830 4.582 20 0 DJADLO C[N@@H+](Cc1ncc(Cl)s1)Cc1cccc2ccccc21 ZINC000473137932 339382098 /nfs/dbraw/zinc/38/20/98/339382098.db2.gz GSKXMZCWAJNGDX-UHFFFAOYSA-N 1 2 302.830 4.582 20 0 DJADLO C[C@@H]1CC[N@@H+](Cc2ncc(Cl)s2)[C@@H]1c1cccc(F)c1 ZINC000473139071 339382107 /nfs/dbraw/zinc/38/21/07/339382107.db2.gz LWHYZOHYKJZFLP-BMIGLBTASA-N 1 2 310.825 4.519 20 0 DJADLO Cc1ccc(C)c([C@H]2CCC[N@@H+]2Cc2ncc(Cl)s2)c1 ZINC000473140931 339382245 /nfs/dbraw/zinc/38/22/45/339382245.db2.gz DLMXDJXYOUNRIN-CQSZACIVSA-N 1 2 306.862 4.750 20 0 DJADLO Cc1ccc(C)c([C@H]2CCC[N@H+]2Cc2ncc(Cl)s2)c1 ZINC000473140931 339382246 /nfs/dbraw/zinc/38/22/46/339382246.db2.gz DLMXDJXYOUNRIN-CQSZACIVSA-N 1 2 306.862 4.750 20 0 DJADLO Clc1cnc(C[N@H+](Cc2ccc(Cl)cc2)C2CC2)s1 ZINC000473139219 339382398 /nfs/dbraw/zinc/38/23/98/339382398.db2.gz IKCAAZDSPJNAEP-UHFFFAOYSA-N 1 2 313.253 4.615 20 0 DJADLO Clc1cnc(C[N@@H+](Cc2ccc(Cl)cc2)C2CC2)s1 ZINC000473139219 339382399 /nfs/dbraw/zinc/38/23/99/339382399.db2.gz IKCAAZDSPJNAEP-UHFFFAOYSA-N 1 2 313.253 4.615 20 0 DJADLO C[C@@H](c1cccc(Cl)c1)[N@H+](C)Cc1ncc(Cl)s1 ZINC000473143785 339382695 /nfs/dbraw/zinc/38/26/95/339382695.db2.gz GLONCVIPLWLRKN-VIFPVBQESA-N 1 2 301.242 4.643 20 0 DJADLO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)Cc1ncc(Cl)s1 ZINC000473143785 339382696 /nfs/dbraw/zinc/38/26/96/339382696.db2.gz GLONCVIPLWLRKN-VIFPVBQESA-N 1 2 301.242 4.643 20 0 DJADLO Cc1ccc([C@H]2CCC[N@@H+]2Cc2ncc(Cl)s2)cc1C ZINC000473146502 339382931 /nfs/dbraw/zinc/38/29/31/339382931.db2.gz UEWGCVAXSQVVRH-CQSZACIVSA-N 1 2 306.862 4.750 20 0 DJADLO Cc1ccc([C@H]2CCC[N@H+]2Cc2ncc(Cl)s2)cc1C ZINC000473146502 339382932 /nfs/dbraw/zinc/38/29/32/339382932.db2.gz UEWGCVAXSQVVRH-CQSZACIVSA-N 1 2 306.862 4.750 20 0 DJADLO Cc1cccc([C@H]2CCC[N@@H+]2Cc2ncc(Cl)s2)c1C ZINC000473150131 339383033 /nfs/dbraw/zinc/38/30/33/339383033.db2.gz ZDNHFMOEZDRALX-CQSZACIVSA-N 1 2 306.862 4.750 20 0 DJADLO Cc1cccc([C@H]2CCC[N@H+]2Cc2ncc(Cl)s2)c1C ZINC000473150131 339383034 /nfs/dbraw/zinc/38/30/34/339383034.db2.gz ZDNHFMOEZDRALX-CQSZACIVSA-N 1 2 306.862 4.750 20 0 DJADLO COc1c2ccccc2oc1C[NH2+]Cc1cc(Cl)ccc1F ZINC000473990583 339396372 /nfs/dbraw/zinc/39/63/72/339396372.db2.gz PKNYSNDINDHOJH-UHFFFAOYSA-N 1 2 319.763 4.524 20 0 DJADLO Cc1coc(-c2ccc(C)c(NCCCc3ccc(C)[nH+]c3)c2)n1 ZINC000474470671 339416015 /nfs/dbraw/zinc/41/60/15/339416015.db2.gz ARGDWGJUHNMLLV-UHFFFAOYSA-N 1 2 321.424 4.707 20 0 DJADLO Cc1ccc(-c2[nH]cc[nH+]2)cc1NC(=O)[C@H]1CCCC(C)(C)C1 ZINC000477989161 339506819 /nfs/dbraw/zinc/50/68/19/339506819.db2.gz LLTSORWSIUHVQQ-HNNXBMFYSA-N 1 2 311.429 4.540 20 0 DJADLO Cc1ccc(CSCc2nc(C(C)(C)C)cs2)c(C)[nH+]1 ZINC000478912498 339524485 /nfs/dbraw/zinc/52/44/85/339524485.db2.gz QRPTYLAEFXVXJL-UHFFFAOYSA-N 1 2 306.500 4.886 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@@H]1c2ccccc2CCC[C@H]1C ZINC000485427247 339703057 /nfs/dbraw/zinc/70/30/57/339703057.db2.gz BUBFUMRAMAFXIV-YJYMSZOUSA-N 1 2 323.440 4.534 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H]1c2ccccc2CCC[C@@H]1C ZINC000485427245 339703135 /nfs/dbraw/zinc/70/31/35/339703135.db2.gz BUBFUMRAMAFXIV-ORAYPTAESA-N 1 2 323.440 4.534 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)c1cc2c(s1)CCCCCC2 ZINC000485483696 339704175 /nfs/dbraw/zinc/70/41/75/339704175.db2.gz XVYPCPFFISDCDN-UHFFFAOYSA-N 1 2 314.454 4.671 20 0 DJADLO Cc1cc(N2CCCC[C@H]2c2ccccc2C(F)(F)F)nc[nH+]1 ZINC000487209662 339746475 /nfs/dbraw/zinc/74/64/75/339746475.db2.gz QSUAHMRNSGPTDI-HNNXBMFYSA-N 1 2 321.346 4.535 20 0 DJADLO Fc1ccc(C2=CC[C@H]([NH2+][C@@H](C3CC3)C(F)(F)F)CC2)cc1 ZINC000489762280 339817931 /nfs/dbraw/zinc/81/79/31/339817931.db2.gz CPPUDFCEIYJMHE-HOTGVXAUSA-N 1 2 313.338 4.692 20 0 DJADLO C[C@@H](c1cccc(C(F)(F)F)c1)N(C)c1cc[nH+]c(C2CC2)n1 ZINC000498956911 340027000 /nfs/dbraw/zinc/02/70/00/340027000.db2.gz KJJOJEOIUCUQAK-NSHDSACASA-N 1 2 321.346 4.570 20 0 DJADLO C[C@H]([NH2+]C1(C(F)F)CC1)c1cccc(OCc2ccccc2)c1 ZINC000503919998 340136858 /nfs/dbraw/zinc/13/68/58/340136858.db2.gz JKTOTHAFGQLPFG-AWEZNQCLSA-N 1 2 317.379 4.714 20 0 DJADLO C[C@@H]([NH2+]C1(C(F)F)CC1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000503937759 340137631 /nfs/dbraw/zinc/13/76/31/340137631.db2.gz OZDBUIKBTFAJNN-BDAKNGLRSA-N 1 2 324.198 4.537 20 0 DJADLO Cc1cc(C(=O)Nc2ccc3[nH]c(C4CCC4)[nH+]c3c2)ccc1F ZINC000505112729 340161876 /nfs/dbraw/zinc/16/18/76/340161876.db2.gz FNAPEGYYGBRGAK-UHFFFAOYSA-N 1 2 323.371 4.530 20 0 DJADLO Fc1cc(F)c(C[N@@H+]2CCCCC[C@H]2c2ccncc2)cc1F ZINC000505265658 340165190 /nfs/dbraw/zinc/16/51/90/340165190.db2.gz LZHAFSLUYNDTDI-SFHVURJKSA-N 1 2 320.358 4.616 20 0 DJADLO Fc1cc(F)c(C[N@H+]2CCCCC[C@H]2c2ccncc2)cc1F ZINC000505265658 340165191 /nfs/dbraw/zinc/16/51/91/340165191.db2.gz LZHAFSLUYNDTDI-SFHVURJKSA-N 1 2 320.358 4.616 20 0 DJADLO Clc1ccc(C[N@H+](Cc2ccco2)Cc2cccs2)o1 ZINC000505559161 340170991 /nfs/dbraw/zinc/17/09/91/340170991.db2.gz IEYUTJSGLKMSDT-UHFFFAOYSA-N 1 2 307.802 4.790 20 0 DJADLO Clc1ccc(C[N@@H+](Cc2ccco2)Cc2cccs2)o1 ZINC000505559161 340170992 /nfs/dbraw/zinc/17/09/92/340170992.db2.gz IEYUTJSGLKMSDT-UHFFFAOYSA-N 1 2 307.802 4.790 20 0 DJADLO Fc1cccc(F)c1C[NH2+][C@@H](CC(F)(F)F)c1ccccc1 ZINC000505636358 340173842 /nfs/dbraw/zinc/17/38/42/340173842.db2.gz PAJVZTQTIOYHBZ-HNNXBMFYSA-N 1 2 315.285 4.748 20 0 DJADLO O=C(Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1)C1CCCC1 ZINC000505822569 340178757 /nfs/dbraw/zinc/17/87/57/340178757.db2.gz AJKPTDKRKNTLBO-UHFFFAOYSA-N 1 2 316.788 4.656 20 0 DJADLO COc1ccccc1/C=C\C[NH+](Cc1ccco1)Cc1ccco1 ZINC000506088224 340185094 /nfs/dbraw/zinc/18/50/94/340185094.db2.gz VMVPTFOZIONXJR-YWEYNIOJSA-N 1 2 323.392 4.597 20 0 DJADLO CC(C)Cc1ncc(C[N@H+](C)Cc2ccc(Cl)s2)s1 ZINC000506101394 340185786 /nfs/dbraw/zinc/18/57/86/340185786.db2.gz QQLPYZNFQGHZHZ-UHFFFAOYSA-N 1 2 314.907 4.689 20 0 DJADLO CC(C)Cc1ncc(C[N@@H+](C)Cc2ccc(Cl)s2)s1 ZINC000506101394 340185787 /nfs/dbraw/zinc/18/57/87/340185787.db2.gz QQLPYZNFQGHZHZ-UHFFFAOYSA-N 1 2 314.907 4.689 20 0 DJADLO Cc1ccc(-c2nc(C[N@@H+](Cc3ccco3)C(C)C)co2)cc1 ZINC000506442779 340194782 /nfs/dbraw/zinc/19/47/82/340194782.db2.gz HTUZUBBQXYMCDU-UHFFFAOYSA-N 1 2 310.397 4.654 20 0 DJADLO Cc1ccc(-c2nc(C[N@H+](Cc3ccco3)C(C)C)co2)cc1 ZINC000506442779 340194783 /nfs/dbraw/zinc/19/47/83/340194783.db2.gz HTUZUBBQXYMCDU-UHFFFAOYSA-N 1 2 310.397 4.654 20 0 DJADLO C[C@H](c1ccccc1F)[N@H+](C)Cc1cnc(C(C)(C)C)s1 ZINC000506569075 340196981 /nfs/dbraw/zinc/19/69/81/340196981.db2.gz WOERTXZPLWHHMI-GFCCVEGCSA-N 1 2 306.450 4.773 20 0 DJADLO C[C@H](c1ccccc1F)[N@@H+](C)Cc1cnc(C(C)(C)C)s1 ZINC000506569075 340196982 /nfs/dbraw/zinc/19/69/82/340196982.db2.gz WOERTXZPLWHHMI-GFCCVEGCSA-N 1 2 306.450 4.773 20 0 DJADLO Cc1nc(C[N@H+](C)Cc2ccc(-c3ccc(C)cc3)o2)cs1 ZINC000506668404 340199051 /nfs/dbraw/zinc/19/90/51/340199051.db2.gz ITWIHLRBHYGJIM-UHFFFAOYSA-N 1 2 312.438 4.652 20 0 DJADLO Cc1nc(C[N@@H+](C)Cc2ccc(-c3ccc(C)cc3)o2)cs1 ZINC000506668404 340199052 /nfs/dbraw/zinc/19/90/52/340199052.db2.gz ITWIHLRBHYGJIM-UHFFFAOYSA-N 1 2 312.438 4.652 20 0 DJADLO C[C@@H](c1nc2ccccc2s1)[N@H+](C)Cc1ccc(Cl)o1 ZINC000506707320 340199793 /nfs/dbraw/zinc/19/97/93/340199793.db2.gz OUNFSZXFLJNAFZ-JTQLQIEISA-N 1 2 306.818 4.736 20 0 DJADLO C[C@@H](c1nc2ccccc2s1)[N@@H+](C)Cc1ccc(Cl)o1 ZINC000506707320 340199794 /nfs/dbraw/zinc/19/97/94/340199794.db2.gz OUNFSZXFLJNAFZ-JTQLQIEISA-N 1 2 306.818 4.736 20 0 DJADLO COc1ccsc1C[N@H+](C)[C@@H](C)c1nc2ccccc2s1 ZINC000506720946 340200157 /nfs/dbraw/zinc/20/01/57/340200157.db2.gz WDTFZNFKCALBQO-NSHDSACASA-N 1 2 318.467 4.559 20 0 DJADLO COc1ccsc1C[N@@H+](C)[C@@H](C)c1nc2ccccc2s1 ZINC000506720946 340200158 /nfs/dbraw/zinc/20/01/58/340200158.db2.gz WDTFZNFKCALBQO-NSHDSACASA-N 1 2 318.467 4.559 20 0 DJADLO Clc1ccc([C@H]2CCC[N@@H+]2Cc2ccccn2)cc1Cl ZINC000507132408 340208773 /nfs/dbraw/zinc/20/87/73/340208773.db2.gz LYXOKIQEIHWIOA-MRXNPFEDSA-N 1 2 307.224 4.726 20 0 DJADLO Clc1ccc([C@H]2CCC[N@H+]2Cc2ccccn2)cc1Cl ZINC000507132408 340208774 /nfs/dbraw/zinc/20/87/74/340208774.db2.gz LYXOKIQEIHWIOA-MRXNPFEDSA-N 1 2 307.224 4.726 20 0 DJADLO Fc1cccc([C@H]2CCC[N@@H+]2Cc2cnc(-c3ccccc3)[nH]2)c1 ZINC000507186453 340211778 /nfs/dbraw/zinc/21/17/78/340211778.db2.gz DUVHYLVWCOYPQL-LJQANCHMSA-N 1 2 321.399 4.553 20 0 DJADLO Fc1cccc([C@H]2CCC[N@H+]2Cc2cnc(-c3ccccc3)[nH]2)c1 ZINC000507186453 340211779 /nfs/dbraw/zinc/21/17/79/340211779.db2.gz DUVHYLVWCOYPQL-LJQANCHMSA-N 1 2 321.399 4.553 20 0 DJADLO CSCc1cnc(C[N@H+](C)[C@@H](C)c2ccc(C)cc2)s1 ZINC000507192019 340212439 /nfs/dbraw/zinc/21/24/39/340212439.db2.gz QPTRJZDPGNGHFG-ZDUSSCGKSA-N 1 2 306.500 4.508 20 0 DJADLO CSCc1cnc(C[N@@H+](C)[C@@H](C)c2ccc(C)cc2)s1 ZINC000507192019 340212440 /nfs/dbraw/zinc/21/24/40/340212440.db2.gz QPTRJZDPGNGHFG-ZDUSSCGKSA-N 1 2 306.500 4.508 20 0 DJADLO CSCc1cnc(C[N@H+](Cc2ccc(F)cc2)C(C)C)s1 ZINC000507226194 340214392 /nfs/dbraw/zinc/21/43/92/340214392.db2.gz FTPCCEKZCAKBLF-UHFFFAOYSA-N 1 2 324.490 4.556 20 0 DJADLO CSCc1cnc(C[N@@H+](Cc2ccc(F)cc2)C(C)C)s1 ZINC000507226194 340214393 /nfs/dbraw/zinc/21/43/93/340214393.db2.gz FTPCCEKZCAKBLF-UHFFFAOYSA-N 1 2 324.490 4.556 20 0 DJADLO CC(C)c1ncc(C[N@H+](C)[C@H](C)c2c(F)cccc2F)s1 ZINC000507235260 340215079 /nfs/dbraw/zinc/21/50/79/340215079.db2.gz UPJFWECTYOKIRI-LLVKDONJSA-N 1 2 310.413 4.738 20 0 DJADLO CC(C)c1ncc(C[N@@H+](C)[C@H](C)c2c(F)cccc2F)s1 ZINC000507235260 340215080 /nfs/dbraw/zinc/21/50/80/340215080.db2.gz UPJFWECTYOKIRI-LLVKDONJSA-N 1 2 310.413 4.738 20 0 DJADLO CCc1nocc1C[N@H+](Cc1ccccc1)Cc1ccccc1F ZINC000507417659 340218843 /nfs/dbraw/zinc/21/88/43/340218843.db2.gz MVZVUAJIZGVZRG-UHFFFAOYSA-N 1 2 324.399 4.579 20 0 DJADLO CCc1nocc1C[N@@H+](Cc1ccccc1)Cc1ccccc1F ZINC000507417659 340218844 /nfs/dbraw/zinc/21/88/44/340218844.db2.gz MVZVUAJIZGVZRG-UHFFFAOYSA-N 1 2 324.399 4.579 20 0 DJADLO CCCCc1noc([C@H](C)[NH2+][C@H](C)c2ccc(SC)cc2)n1 ZINC000507465441 340220833 /nfs/dbraw/zinc/22/08/33/340220833.db2.gz AUNQESOHHQSRMG-OLZOCXBDSA-N 1 2 319.474 4.546 20 0 DJADLO CC[N@H+](Cc1ncc(CSC)s1)[C@@H](C)c1ccc(F)cc1 ZINC000507621064 340226744 /nfs/dbraw/zinc/22/67/44/340226744.db2.gz MRNINGYDPDTNKE-LBPRGKRZSA-N 1 2 324.490 4.728 20 0 DJADLO CC[N@@H+](Cc1ncc(CSC)s1)[C@@H](C)c1ccc(F)cc1 ZINC000507621064 340226745 /nfs/dbraw/zinc/22/67/45/340226745.db2.gz MRNINGYDPDTNKE-LBPRGKRZSA-N 1 2 324.490 4.728 20 0 DJADLO Cc1cc(C[N@@H+]2CCO[C@H](c3ccccc3Cl)C2)c(C)s1 ZINC000507765755 340230481 /nfs/dbraw/zinc/23/04/81/340230481.db2.gz HBDRYXLZJSOZJS-KRWDZBQOSA-N 1 2 321.873 4.592 20 0 DJADLO Cc1cc(C[N@H+]2CCO[C@H](c3ccccc3Cl)C2)c(C)s1 ZINC000507765755 340230482 /nfs/dbraw/zinc/23/04/82/340230482.db2.gz HBDRYXLZJSOZJS-KRWDZBQOSA-N 1 2 321.873 4.592 20 0 DJADLO Fc1ccc(F)c2c1CC[C@H]2[NH2+]Cc1c(F)cccc1Cl ZINC000507806365 340232240 /nfs/dbraw/zinc/23/22/40/340232240.db2.gz DCBHSMBHTCDZRU-OAHLLOKOSA-N 1 2 311.734 4.534 20 0 DJADLO C[C@H]([NH2+][C@@H]1CCc2c1c(F)ccc2F)c1c(F)cccc1F ZINC000507850433 340234039 /nfs/dbraw/zinc/23/40/39/340234039.db2.gz GYVKBGGOVPYKLG-BJOHPYRUSA-N 1 2 309.306 4.581 20 0 DJADLO Cc1cnc(C[NH2+]Cc2ccc(-c3ccccc3)cc2F)s1 ZINC000507896772 340235401 /nfs/dbraw/zinc/23/54/01/340235401.db2.gz FQCOQLQZFSJIEO-UHFFFAOYSA-N 1 2 312.413 4.547 20 0 DJADLO Cc1cc(C[N@@H+](C)Cc2ccc(Sc3ccccc3)cc2)no1 ZINC000508567377 340246617 /nfs/dbraw/zinc/24/66/17/340246617.db2.gz YCUSDOABHONSMY-UHFFFAOYSA-N 1 2 324.449 4.766 20 0 DJADLO Cc1cc(C[N@H+](C)Cc2ccc(Sc3ccccc3)cc2)no1 ZINC000508567377 340246618 /nfs/dbraw/zinc/24/66/18/340246618.db2.gz YCUSDOABHONSMY-UHFFFAOYSA-N 1 2 324.449 4.766 20 0 DJADLO Cc1ccc(NC(=O)c2ccccc2Oc2cc[nH+]cc2)cc1C ZINC000509034447 340258966 /nfs/dbraw/zinc/25/89/66/340258966.db2.gz PNYCYTQXQGZPFA-UHFFFAOYSA-N 1 2 318.376 4.743 20 0 DJADLO Cc1cccc(NC(=O)c2ccccc2Oc2cc[nH+]cc2)c1F ZINC000509326637 340266307 /nfs/dbraw/zinc/26/63/07/340266307.db2.gz WDJMEHDOCBWQRF-UHFFFAOYSA-N 1 2 322.339 4.574 20 0 DJADLO Cc1ccc(CNc2cc(Cc3ccccn3)ccc2C)c(C)[nH+]1 ZINC000509503014 340271565 /nfs/dbraw/zinc/27/15/65/340271565.db2.gz YDBKAWXYSSQXGM-UHFFFAOYSA-N 1 2 317.436 4.605 20 0 DJADLO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cc(Cl)ccc2Cl)on1 ZINC000509825818 340280654 /nfs/dbraw/zinc/28/06/54/340280654.db2.gz HBLNOWVBVBRERU-AWEZNQCLSA-N 1 2 311.212 4.627 20 0 DJADLO Cc1cc([C@@H]2CCC[N@H+]2Cc2cc(Cl)ccc2Cl)on1 ZINC000509825818 340280655 /nfs/dbraw/zinc/28/06/55/340280655.db2.gz HBLNOWVBVBRERU-AWEZNQCLSA-N 1 2 311.212 4.627 20 0 DJADLO C[N@H+](Cc1coc(-c2ccccc2)n1)Cc1cccc(Cl)c1 ZINC000302744076 340280978 /nfs/dbraw/zinc/28/09/78/340280978.db2.gz DKYOLMGQVRKCED-UHFFFAOYSA-N 1 2 312.800 4.627 20 0 DJADLO C[N@@H+](Cc1coc(-c2ccccc2)n1)Cc1cccc(Cl)c1 ZINC000302744076 340280979 /nfs/dbraw/zinc/28/09/79/340280979.db2.gz DKYOLMGQVRKCED-UHFFFAOYSA-N 1 2 312.800 4.627 20 0 DJADLO C[N@H+](Cc1csc(-c2ccsc2)n1)Cc1cccc(F)c1 ZINC000302748812 340281012 /nfs/dbraw/zinc/28/10/12/340281012.db2.gz JRTZBFCJICCMPT-UHFFFAOYSA-N 1 2 318.442 4.643 20 0 DJADLO C[N@@H+](Cc1csc(-c2ccsc2)n1)Cc1cccc(F)c1 ZINC000302748812 340281013 /nfs/dbraw/zinc/28/10/13/340281013.db2.gz JRTZBFCJICCMPT-UHFFFAOYSA-N 1 2 318.442 4.643 20 0 DJADLO Cc1cc(Cl)ccc1NCc1cn2cc(Cl)ccc2[nH+]1 ZINC000302818050 340282849 /nfs/dbraw/zinc/28/28/49/340282849.db2.gz ZZBGLSZHXSGOSQ-UHFFFAOYSA-N 1 2 306.196 4.562 20 0 DJADLO Cn1c(CCSCc2cccc(Cl)c2)[nH+]c2ccccc21 ZINC000509966637 340284197 /nfs/dbraw/zinc/28/41/97/340284197.db2.gz HFOAXXVWGZJFJM-UHFFFAOYSA-N 1 2 316.857 4.703 20 0 DJADLO C[C@@H]([NH2+]Cc1ccc(F)c(Cl)c1Cl)c1ccncc1F ZINC000509979897 340284519 /nfs/dbraw/zinc/28/45/19/340284519.db2.gz UCNNAZDPTDKGIK-MRVPVSSYSA-N 1 2 317.166 4.517 20 0 DJADLO Cc1cnc(C[N@@H+](Cc2ccccc2Cl)CC2CC2)s1 ZINC000510168000 340291342 /nfs/dbraw/zinc/29/13/42/340291342.db2.gz GYZCXMPUGFDLCZ-UHFFFAOYSA-N 1 2 306.862 4.517 20 0 DJADLO Cc1cnc(C[N@H+](Cc2ccccc2Cl)CC2CC2)s1 ZINC000510168000 340291343 /nfs/dbraw/zinc/29/13/43/340291343.db2.gz GYZCXMPUGFDLCZ-UHFFFAOYSA-N 1 2 306.862 4.517 20 0 DJADLO C[C@@H](CC(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)C1CCCCC1 ZINC000303194067 340311564 /nfs/dbraw/zinc/31/15/64/340311564.db2.gz ZUIXAEOVOXWBRP-AWEZNQCLSA-N 1 2 311.429 4.622 20 0 DJADLO Clc1ccc([C@@H]2CC[N@@H+]2Cc2nc3ccccc3s2)cc1 ZINC000511587417 340331640 /nfs/dbraw/zinc/33/16/40/340331640.db2.gz WAFGCLVHINXZGM-HNNXBMFYSA-N 1 2 314.841 4.897 20 0 DJADLO Clc1ccc([C@@H]2CC[N@H+]2Cc2nc3ccccc3s2)cc1 ZINC000511587417 340331641 /nfs/dbraw/zinc/33/16/41/340331641.db2.gz WAFGCLVHINXZGM-HNNXBMFYSA-N 1 2 314.841 4.897 20 0 DJADLO CCc1ccc(-c2ccc(C[N@H+](C)Cc3cscn3)o2)cc1 ZINC000512051944 340346838 /nfs/dbraw/zinc/34/68/38/340346838.db2.gz JWHRTDSONDQVJT-UHFFFAOYSA-N 1 2 312.438 4.598 20 0 DJADLO CCc1ccc(-c2ccc(C[N@@H+](C)Cc3cscn3)o2)cc1 ZINC000512051944 340346839 /nfs/dbraw/zinc/34/68/39/340346839.db2.gz JWHRTDSONDQVJT-UHFFFAOYSA-N 1 2 312.438 4.598 20 0 DJADLO CSCc1cnc(C[N@@H+]2CCCC[C@H]2c2ccccc2)s1 ZINC000512547856 340366455 /nfs/dbraw/zinc/36/64/55/340366455.db2.gz TXHCACOLMXQUSG-INIZCTEOSA-N 1 2 318.511 4.733 20 0 DJADLO CSCc1cnc(C[N@H+]2CCCC[C@H]2c2ccccc2)s1 ZINC000512547856 340366456 /nfs/dbraw/zinc/36/64/56/340366456.db2.gz TXHCACOLMXQUSG-INIZCTEOSA-N 1 2 318.511 4.733 20 0 DJADLO Cc1ccc(C[NH2+][C@@H](C)c2nc(C3CCCCC3)no2)cc1C ZINC000173866018 340376293 /nfs/dbraw/zinc/37/62/93/340376293.db2.gz DONOVKIPTPTWKU-HNNXBMFYSA-N 1 2 313.445 4.585 20 0 DJADLO CC[C@@](C)([NH2+]Cc1c(F)cccc1Cl)c1nc(C)cs1 ZINC000173943828 340378471 /nfs/dbraw/zinc/37/84/71/340378471.db2.gz OSMYSTPXCIZFMZ-OAHLLOKOSA-N 1 2 312.841 4.659 20 0 DJADLO CCc1oc2ccccc2c1CNc1ccc(-n2cc[nH+]c2)cc1 ZINC000512935132 340384719 /nfs/dbraw/zinc/38/47/19/340384719.db2.gz ZZHHDMWSGAUXLY-UHFFFAOYSA-N 1 2 317.392 4.793 20 0 DJADLO CCc1ccc(NCc2ccc(N3CCCC3)[nH+]c2)cc1Cl ZINC000512988061 340387133 /nfs/dbraw/zinc/38/71/33/340387133.db2.gz GJLVLVBDSZBQQI-UHFFFAOYSA-N 1 2 315.848 4.510 20 0 DJADLO c1cc(-c2ccccc2)oc1CNc1ccc(N2CCCC2)c[nH+]1 ZINC000513061381 340391597 /nfs/dbraw/zinc/39/15/97/340391597.db2.gz LQTRQWUIQFQBPZ-UHFFFAOYSA-N 1 2 319.408 4.554 20 0 DJADLO CC[N@H+](Cc1cnc(C(C)C)s1)Cc1c(F)cccc1F ZINC000513112119 340393813 /nfs/dbraw/zinc/39/38/13/340393813.db2.gz SUNIHNUVPLATKS-UHFFFAOYSA-N 1 2 310.413 4.567 20 0 DJADLO CC[N@@H+](Cc1cnc(C(C)C)s1)Cc1c(F)cccc1F ZINC000513112119 340393814 /nfs/dbraw/zinc/39/38/14/340393814.db2.gz SUNIHNUVPLATKS-UHFFFAOYSA-N 1 2 310.413 4.567 20 0 DJADLO C[C@@H]([NH2+]Cc1cccc(Cl)c1Cl)c1c(F)cncc1F ZINC000513118115 340394099 /nfs/dbraw/zinc/39/40/99/340394099.db2.gz YCFYJIQOCAJVFI-MRVPVSSYSA-N 1 2 317.166 4.517 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1c(F)cncc1F)c1cccc(Cl)c1F ZINC000513261468 340399794 /nfs/dbraw/zinc/39/97/94/340399794.db2.gz NGGVMOZCHRBYSO-RKDXNWHRSA-N 1 2 314.738 4.564 20 0 DJADLO Cc1ccc(CNc2ccc(Cl)c(OC(F)F)c2)c(C)[nH+]1 ZINC000184505794 340493550 /nfs/dbraw/zinc/49/35/50/340493550.db2.gz OMPSMKWQSVEUOP-UHFFFAOYSA-N 1 2 312.747 4.565 20 0 DJADLO CCc1cccc(C[NH2+][C@H](C)c2nc(C3CCCCC3)no2)c1 ZINC000189969076 340541516 /nfs/dbraw/zinc/54/15/16/340541516.db2.gz ZRUNFJIPPIGSAB-CQSZACIVSA-N 1 2 313.445 4.531 20 0 DJADLO C[C@H]([NH2+]Cc1csc(-c2ccco2)n1)c1csc(Cl)c1 ZINC000191346037 340553148 /nfs/dbraw/zinc/55/31/48/340553148.db2.gz NTUCHFVNUVDFLV-VIFPVBQESA-N 1 2 324.858 4.969 20 0 DJADLO CCCOc1ccccc1NCc1c[nH+]c(C)n1-c1ccccc1 ZINC000236965876 340666795 /nfs/dbraw/zinc/66/67/95/340666795.db2.gz YCLUUPBUIDWGGN-UHFFFAOYSA-N 1 2 321.424 4.582 20 0 DJADLO C[C@@H](Nc1ccc(N2CCCCC2)[nH+]c1)c1cccc(F)c1F ZINC000322575315 340705369 /nfs/dbraw/zinc/70/53/69/340705369.db2.gz ZZDJACMSYNYUPE-CYBMUJFWSA-N 1 2 317.383 4.523 20 0 DJADLO C[C@H]([NH2+][C@H](c1ccccn1)C1CCC1)c1ncc(C(C)(C)C)o1 ZINC000528654275 340728089 /nfs/dbraw/zinc/72/80/89/340728089.db2.gz BKIRXFUFXKBHOU-GUYCJALGSA-N 1 2 313.445 4.559 20 0 DJADLO Cc1ccc([C@H](C)[NH2+][C@H](C)c2noc(-c3ccccc3)n2)c(C)c1 ZINC000124423592 340799031 /nfs/dbraw/zinc/79/90/31/340799031.db2.gz YYMKMWMDYCEDMQ-JKSUJKDBSA-N 1 2 321.424 4.765 20 0 DJADLO C[C@H]([NH2+][C@H](COc1ccccc1)c1ccccc1)c1cscn1 ZINC000539069701 340870387 /nfs/dbraw/zinc/87/03/87/340870387.db2.gz SNVUWAHSRLXZDX-MAUKXSAKSA-N 1 2 324.449 4.614 20 0 DJADLO CCCCOc1cccc(N[C@H](c2[nH]cc[nH+]2)c2ccccc2)c1 ZINC000128579701 340898747 /nfs/dbraw/zinc/89/87/47/340898747.db2.gz XGFLBWQZCRATTM-IBGZPJMESA-N 1 2 321.424 4.790 20 0 DJADLO C[C@@H]([NH2+]Cc1csc(-c2ccoc2)n1)c1c(F)cccc1F ZINC000540332485 340927452 /nfs/dbraw/zinc/92/74/52/340927452.db2.gz DMKZUFIDUSNRNT-SNVBAGLBSA-N 1 2 320.364 4.532 20 0 DJADLO CC(C)[C@@H]([NH2+]Cc1ncc(C2CC2)o1)c1ccccc1Cl ZINC000540386748 340929049 /nfs/dbraw/zinc/92/90/49/340929049.db2.gz YRNUCQZNMCYVDE-QGZVFWFLSA-N 1 2 304.821 4.692 20 0 DJADLO CC(C)CC[C@@H](C)Nc1cccc2c1CN(c1cccc[nH+]1)C2 ZINC000540789893 340946038 /nfs/dbraw/zinc/94/60/38/340946038.db2.gz IHPUJKRGTCIKHJ-MRXNPFEDSA-N 1 2 309.457 4.838 20 0 DJADLO CCc1cnc(C[N@@H+]2CCC[C@@H]2c2ccccc2Cl)s1 ZINC000542464764 341008167 /nfs/dbraw/zinc/00/81/67/341008167.db2.gz IWIWSIZCYGYBMB-OAHLLOKOSA-N 1 2 306.862 4.696 20 0 DJADLO CCc1cnc(C[N@H+]2CCC[C@@H]2c2ccccc2Cl)s1 ZINC000542464764 341008168 /nfs/dbraw/zinc/00/81/68/341008168.db2.gz IWIWSIZCYGYBMB-OAHLLOKOSA-N 1 2 306.862 4.696 20 0 DJADLO CC(C)c1cnc(C[N@@H+]2CC[C@H](C)C[C@H]2c2ccco2)s1 ZINC000542465825 341008520 /nfs/dbraw/zinc/00/85/20/341008520.db2.gz MIAZHDLGRSYDDX-KBPBESRZSA-N 1 2 304.459 4.833 20 0 DJADLO CC(C)c1cnc(C[N@H+]2CC[C@H](C)C[C@H]2c2ccco2)s1 ZINC000542465825 341008521 /nfs/dbraw/zinc/00/85/21/341008521.db2.gz MIAZHDLGRSYDDX-KBPBESRZSA-N 1 2 304.459 4.833 20 0 DJADLO CC(C)C[C@@H]([NH2+][C@H](C)c1nc(C(C)C)no1)c1cccs1 ZINC000542557615 341013633 /nfs/dbraw/zinc/01/36/33/341013633.db2.gz WYQLKBIZCKIEDX-CHWSQXEVSA-N 1 2 307.463 4.693 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1cc(F)c(Cl)cc1Cl)c1ccon1 ZINC000542699559 341017800 /nfs/dbraw/zinc/01/78/00/341017800.db2.gz JHIHQUCFSWAXII-JGVFFNPUSA-N 1 2 303.164 4.532 20 0 DJADLO Cc1ccc(-c2nnc([C@@H](C)[N@@H+]3Cc4ccccc4[C@@H]3C)o2)cc1 ZINC000543061271 341029803 /nfs/dbraw/zinc/02/98/03/341029803.db2.gz RWAODLNWRJPGIH-LSDHHAIUSA-N 1 2 319.408 4.683 20 0 DJADLO Cc1ccc(-c2nnc([C@@H](C)[N@H+]3Cc4ccccc4[C@@H]3C)o2)cc1 ZINC000543061271 341029804 /nfs/dbraw/zinc/02/98/04/341029804.db2.gz RWAODLNWRJPGIH-LSDHHAIUSA-N 1 2 319.408 4.683 20 0 DJADLO C[C@H](c1ccc(Cl)cc1)[N@H+](C)Cc1nc(C2CC2)cs1 ZINC000543139515 341033804 /nfs/dbraw/zinc/03/38/04/341033804.db2.gz NLQOKEVJZDICAQ-LLVKDONJSA-N 1 2 306.862 4.867 20 0 DJADLO C[C@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1nc(C2CC2)cs1 ZINC000543139515 341033805 /nfs/dbraw/zinc/03/38/05/341033805.db2.gz NLQOKEVJZDICAQ-LLVKDONJSA-N 1 2 306.862 4.867 20 0 DJADLO CCc1cnc(C[NH2+][C@@H](C)c2ccc(-c3ccccc3)o2)s1 ZINC000130649606 341036907 /nfs/dbraw/zinc/03/69/07/341036907.db2.gz IVJFHDMULSIUNH-ZDUSSCGKSA-N 1 2 312.438 4.816 20 0 DJADLO COc1ccc(C)cc1C[NH2+][C@@H](C)c1ncc(-c2ccccc2)o1 ZINC000543498115 341047597 /nfs/dbraw/zinc/04/75/97/341047597.db2.gz VVEVOMYOIYHPCE-HNNXBMFYSA-N 1 2 322.408 4.509 20 0 DJADLO CC[C@H]([NH2+][C@@H](C)c1cccc(Cl)c1Cl)c1ccn(C)n1 ZINC000543591984 341049633 /nfs/dbraw/zinc/04/96/33/341049633.db2.gz RSDUMWLUJKPERF-GWCFXTLKSA-N 1 2 312.244 4.529 20 0 DJADLO CC(C)Oc1ccccc1[C@H](C)[NH2+]Cc1nc(C2CC2)cs1 ZINC000544122580 341071137 /nfs/dbraw/zinc/07/11/37/341071137.db2.gz XKTQERLOPRBRPN-ZDUSSCGKSA-N 1 2 316.470 4.659 20 0 DJADLO Fc1ccc([C@@H]2CCCC[N@@H+]2Cc2nc(C3CC3)cs2)cc1 ZINC000544147019 341072257 /nfs/dbraw/zinc/07/22/57/341072257.db2.gz YPFQZKIFHJLWDB-KRWDZBQOSA-N 1 2 316.445 4.887 20 0 DJADLO Fc1ccc([C@@H]2CCCC[N@H+]2Cc2nc(C3CC3)cs2)cc1 ZINC000544147019 341072258 /nfs/dbraw/zinc/07/22/58/341072258.db2.gz YPFQZKIFHJLWDB-KRWDZBQOSA-N 1 2 316.445 4.887 20 0 DJADLO CC(C)CCc1noc(C[NH2+][C@@H](CC(C)C)c2cccs2)n1 ZINC000544451580 341082806 /nfs/dbraw/zinc/08/28/06/341082806.db2.gz GZXIDLAHYGGNFG-AWEZNQCLSA-N 1 2 321.490 4.597 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1cccc(OCc2ccccc2)c1)c1ccon1 ZINC000544606703 341088487 /nfs/dbraw/zinc/08/84/87/341088487.db2.gz VPKSOGIXSSHYHH-HOTGVXAUSA-N 1 2 322.408 4.665 20 0 DJADLO CC(C)c1ccc([C@H](C)[NH2+][C@H](C)c2nc(C(C)(C)C)no2)cc1 ZINC000073984269 341124593 /nfs/dbraw/zinc/12/45/93/341124593.db2.gz CZTFHEQTDBNRRV-UONOGXRCSA-N 1 2 315.461 4.902 20 0 DJADLO CC[C@@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1ccc(F)cc1F ZINC000133539701 341177804 /nfs/dbraw/zinc/17/78/04/341177804.db2.gz FJGBBKBIKZIRAE-CQSZACIVSA-N 1 2 324.440 4.960 20 0 DJADLO C[C@@H]([NH2+]Cc1ccc(Cl)s1)c1ncc(-c2ccccc2)o1 ZINC000547469583 341215540 /nfs/dbraw/zinc/21/55/40/341215540.db2.gz YKCFQCXXDBSLRY-LLVKDONJSA-N 1 2 318.829 4.907 20 0 DJADLO c1c[nH]c([C@@H]2CCC[N@H+]2Cc2csc(-c3ccsc3)n2)c1 ZINC000077170984 341219747 /nfs/dbraw/zinc/21/97/47/341219747.db2.gz SSAYNPZEYVYXOU-HNNXBMFYSA-N 1 2 315.467 4.537 20 0 DJADLO c1c[nH]c([C@@H]2CCC[N@@H+]2Cc2csc(-c3ccsc3)n2)c1 ZINC000077170984 341219748 /nfs/dbraw/zinc/21/97/48/341219748.db2.gz SSAYNPZEYVYXOU-HNNXBMFYSA-N 1 2 315.467 4.537 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1Cl)c1nc2c(s1)CCC2 ZINC000134978854 341227783 /nfs/dbraw/zinc/22/77/83/341227783.db2.gz XQNKYEOHQUBQJP-UWVGGRQHSA-N 1 2 324.852 4.836 20 0 DJADLO CC[C@H]([NH2+]Cc1ccc(Cl)cc1Cl)c1nccs1 ZINC000078004315 341233546 /nfs/dbraw/zinc/23/35/46/341233546.db2.gz ZXXGCTTVRCVSEH-LBPRGKRZSA-N 1 2 301.242 4.691 20 0 DJADLO CC[C@H]([NH2+]Cc1ccc(-c2ccc(F)cc2)o1)c1nccs1 ZINC000078004158 341233629 /nfs/dbraw/zinc/23/36/29/341233629.db2.gz DMEQFWBJNSDBEW-HNNXBMFYSA-N 1 2 316.401 4.783 20 0 DJADLO C[C@H](C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1)c1cccs1 ZINC000078092760 341235650 /nfs/dbraw/zinc/23/56/50/341235650.db2.gz PLULNYINJFONFP-ZDUSSCGKSA-N 1 2 324.405 4.678 20 0 DJADLO C[C@H]1CC[N@H+](Cc2csc(C3CC3)n2)[C@H](c2ccco2)C1 ZINC000135656642 341243427 /nfs/dbraw/zinc/24/34/27/341243427.db2.gz YXYZLHCVZADKOM-WFASDCNBSA-N 1 2 302.443 4.587 20 0 DJADLO C[C@H]1CC[N@@H+](Cc2csc(C3CC3)n2)[C@H](c2ccco2)C1 ZINC000135656642 341243428 /nfs/dbraw/zinc/24/34/28/341243428.db2.gz YXYZLHCVZADKOM-WFASDCNBSA-N 1 2 302.443 4.587 20 0 DJADLO C[C@@H]1CC[N@H+](Cc2csc(C3CC3)n2)[C@H](c2ccco2)C1 ZINC000135656606 341243444 /nfs/dbraw/zinc/24/34/44/341243444.db2.gz YXYZLHCVZADKOM-DOMZBBRYSA-N 1 2 302.443 4.587 20 0 DJADLO C[C@@H]1CC[N@@H+](Cc2csc(C3CC3)n2)[C@H](c2ccco2)C1 ZINC000135656606 341243445 /nfs/dbraw/zinc/24/34/45/341243445.db2.gz YXYZLHCVZADKOM-DOMZBBRYSA-N 1 2 302.443 4.587 20 0 DJADLO CC1(C)CC(CC(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)C1 ZINC000549902693 341306116 /nfs/dbraw/zinc/30/61/16/341306116.db2.gz WSCZPRFXAYQGFA-UHFFFAOYSA-N 1 2 310.397 4.639 20 0 DJADLO CC[C@H](C)Oc1cccc(N[C@H](c2[nH]cc[nH+]2)c2ccccc2)c1 ZINC000550855972 341324504 /nfs/dbraw/zinc/32/45/04/341324504.db2.gz GHCDFESFPVCFKD-KXBFYZLASA-N 1 2 321.424 4.789 20 0 DJADLO C[C@@H]([NH2+]CC(C)(F)F)c1ccc2ccccc2c1OC(F)F ZINC000550873450 341325248 /nfs/dbraw/zinc/32/52/48/341325248.db2.gz AKBHPTZFEJVTRP-SNVBAGLBSA-N 1 2 315.310 4.747 20 0 DJADLO CC[C@](C)([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)c1nc(C)cs1 ZINC000246150818 341329754 /nfs/dbraw/zinc/32/97/54/341329754.db2.gz KZQZQTVAMXCNFL-WHCBVINPSA-N 1 2 304.459 4.583 20 0 DJADLO CC[C@](C)([NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1)c1nc(C)cs1 ZINC000246150850 341329906 /nfs/dbraw/zinc/32/99/06/341329906.db2.gz KZQZQTVAMXCNFL-ZLENFMNRSA-N 1 2 304.459 4.583 20 0 DJADLO Cc1cnc(C[N@@H+](CC(C)C)[C@@H](C)c2ccccc2Cl)o1 ZINC000551424489 341341308 /nfs/dbraw/zinc/34/13/08/341341308.db2.gz HZMIWOTUHFJVOW-AWEZNQCLSA-N 1 2 306.837 4.856 20 0 DJADLO Cc1cnc(C[N@H+](CC(C)C)[C@@H](C)c2ccccc2Cl)o1 ZINC000551424489 341341309 /nfs/dbraw/zinc/34/13/09/341341309.db2.gz HZMIWOTUHFJVOW-AWEZNQCLSA-N 1 2 306.837 4.856 20 0 DJADLO Cc1cc(C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)cc2)no1 ZINC000551538563 341344891 /nfs/dbraw/zinc/34/48/91/341344891.db2.gz YSDHJMFCBYMRAT-UHFFFAOYSA-N 1 2 312.800 4.593 20 0 DJADLO CCO[C@@H](C)c1nc(C[N@H+](C)[C@H](C)c2ccc(C)cc2)cs1 ZINC000246825011 341357439 /nfs/dbraw/zinc/35/74/39/341357439.db2.gz SXVLWCPTSCUOSI-CABCVRRESA-N 1 2 318.486 4.742 20 0 DJADLO CCO[C@@H](C)c1nc(C[N@@H+](C)[C@H](C)c2ccc(C)cc2)cs1 ZINC000246825011 341357440 /nfs/dbraw/zinc/35/74/40/341357440.db2.gz SXVLWCPTSCUOSI-CABCVRRESA-N 1 2 318.486 4.742 20 0 DJADLO C[C@H]1C[C@]1([NH2+]Cc1cc(C(C)(C)C)on1)c1ccc(Cl)cc1 ZINC000564392641 341396970 /nfs/dbraw/zinc/39/69/70/341396970.db2.gz ACIUYKQZXSQSBV-KPZWWZAWSA-N 1 2 318.848 4.650 20 0 DJADLO Cc1ccc2oc(C[NH2+]Cc3coc(-c4ccccc4)n3)cc2c1 ZINC000553800562 341436240 /nfs/dbraw/zinc/43/62/40/341436240.db2.gz OTBCKXXYXVQNRV-UHFFFAOYSA-N 1 2 318.376 4.686 20 0 DJADLO Cc1cc(C[NH2+][C@@H](c2cc3ccccc3o2)c2ccccc2)no1 ZINC000553825853 341436600 /nfs/dbraw/zinc/43/66/00/341436600.db2.gz VSWMZVNCHRAVGR-HXUWFJFHSA-N 1 2 318.376 4.608 20 0 DJADLO Cc1nc([C@@H](C)[NH2+]Cc2ccccc2OCCC(C)C)cs1 ZINC000553859680 341437331 /nfs/dbraw/zinc/43/73/31/341437331.db2.gz VCUOLIZVMRTWRU-CQSZACIVSA-N 1 2 318.486 4.727 20 0 DJADLO Cc1cc(C[NH2+][C@@H](c2ccccc2)c2cccc(Cl)c2)on1 ZINC000566593771 341562739 /nfs/dbraw/zinc/56/27/39/341562739.db2.gz LGHBEZDDCSYTQW-SFHVURJKSA-N 1 2 312.800 4.516 20 0 DJADLO C(=C/c1nc2ccccc2s1)\c1cc(-n2cc[nH+]c2)cs1 ZINC000573955325 341744205 /nfs/dbraw/zinc/74/42/05/341744205.db2.gz PXCIMMAJJQYJSA-AATRIKPKSA-N 1 2 309.419 4.714 20 0 DJADLO C[C@@H]([NH2+]Cc1coc(-c2cccs2)n1)c1ccc(F)cc1F ZINC000171121999 341772016 /nfs/dbraw/zinc/77/20/16/341772016.db2.gz XLDDWIAZLUQNMU-SNVBAGLBSA-N 1 2 320.364 4.532 20 0 DJADLO CC(C)Oc1ccccc1[C@@H](C)[NH2+]Cc1cc(C(C)(C)C)on1 ZINC000576742978 341861001 /nfs/dbraw/zinc/86/10/01/341861001.db2.gz BSWXSCHIJZNIBV-CQSZACIVSA-N 1 2 316.445 4.610 20 0 DJADLO CC(C)OCc1ccc(N[C@@H](c2[nH]cc[nH+]2)c2ccccc2)cc1 ZINC000128600542 519775687 /nfs/dbraw/zinc/77/56/87/519775687.db2.gz VTMFFSQGXCMEGD-LJQANCHMSA-N 1 2 321.424 4.536 20 0 DJADLO CC(C)c1nnc(C[NH2+][C@@H](C)c2ccc(C(C)(C)C)cc2)s1 ZINC000267991054 519887835 /nfs/dbraw/zinc/88/78/35/519887835.db2.gz JIDAHUUJBMDJFS-ZDUSSCGKSA-N 1 2 317.502 4.810 20 0 DJADLO CCCOc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1ncc(C)o1 ZINC000181721045 520486662 /nfs/dbraw/zinc/48/66/62/520486662.db2.gz AXRUQUHQYQWNLJ-QGZVFWFLSA-N 1 2 316.445 4.649 20 0 DJADLO CCC[C@@H](C)N(C)C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000264852132 520640076 /nfs/dbraw/zinc/64/00/76/520640076.db2.gz OZGVOYIQEJJMFT-CQSZACIVSA-N 1 2 313.401 4.526 20 0 DJADLO CCSc1ccc(Cl)cc1C(=O)Nc1cc[nH+]cc1CC ZINC000267770098 521747840 /nfs/dbraw/zinc/74/78/40/521747840.db2.gz SRJHEAXSKMXTSH-UHFFFAOYSA-N 1 2 320.845 4.662 20 0 DJADLO CCc1nc([C@H](C)[NH2+][C@H](C)c2csc(Cl)c2)cs1 ZINC000191280776 522454269 /nfs/dbraw/zinc/45/42/69/522454269.db2.gz XRXYOYBPMZFSCU-BDAKNGLRSA-N 1 2 300.880 4.832 20 0 DJADLO CCc1nnc(C[NH2+][C@H](CCC(C)C)c2ccc(Cl)cc2)o1 ZINC000180024503 522747387 /nfs/dbraw/zinc/74/73/87/522747387.db2.gz ARQDWDUVQXPSCD-OAHLLOKOSA-N 1 2 321.852 4.553 20 0 DJADLO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2ncc(C(C)(C)C)o2)ccc1F ZINC000267606668 525470799 /nfs/dbraw/zinc/47/07/99/525470799.db2.gz GDEHNJIYPCNKEV-OLZOCXBDSA-N 1 2 304.409 4.831 20 0 DJADLO C[C@@H]([NH2+]Cc1nc(C2CCCCC2)cs1)c1ccncc1F ZINC000338356825 525559406 /nfs/dbraw/zinc/55/94/06/525559406.db2.gz MZKRSYGOHICCAV-GFCCVEGCSA-N 1 2 319.449 4.576 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1cc(F)cc(F)c1 ZINC000154631317 525630193 /nfs/dbraw/zinc/63/01/93/525630193.db2.gz XRMKPBUURSHEHO-VLIAUNLRSA-N 1 2 324.374 4.800 20 0 DJADLO Cc1ccc(-c2nc(C[N@@H+](C)[C@@H](C)c3ccccn3)cs2)cc1 ZINC000179639813 525808912 /nfs/dbraw/zinc/80/89/12/525808912.db2.gz BIBBDQPTQDNLLQ-HNNXBMFYSA-N 1 2 323.465 4.707 20 0 DJADLO Cc1ccc(-c2nc(C[N@H+](C)[C@@H](C)c3ccccn3)cs2)cc1 ZINC000179639813 525808925 /nfs/dbraw/zinc/80/89/25/525808925.db2.gz BIBBDQPTQDNLLQ-HNNXBMFYSA-N 1 2 323.465 4.707 20 0 DJADLO Cc1ccc([C@H]([NH2+]Cc2cc(F)ccc2F)c2ccccn2)cc1 ZINC000366341053 525970525 /nfs/dbraw/zinc/97/05/25/525970525.db2.gz RLCGGUHOZZMLHU-FQEVSTJZSA-N 1 2 324.374 4.547 20 0 DJADLO Cc1cnc(C[N@@H+](C)[C@H](C)c2sc(C(C)C)nc2C)s1 ZINC000180683258 526008742 /nfs/dbraw/zinc/00/87/42/526008742.db2.gz ABEMJFDEJANWBD-GFCCVEGCSA-N 1 2 309.504 4.533 20 0 DJADLO Cc1cnc(C[N@H+](C)[C@H](C)c2sc(C(C)C)nc2C)s1 ZINC000180683258 526008744 /nfs/dbraw/zinc/00/87/44/526008744.db2.gz ABEMJFDEJANWBD-GFCCVEGCSA-N 1 2 309.504 4.533 20 0 DJADLO Cc1cnc(C[N@@H+](C)[C@@H](C)c2sc(C(C)C)nc2C)s1 ZINC000180683235 526008760 /nfs/dbraw/zinc/00/87/60/526008760.db2.gz ABEMJFDEJANWBD-LBPRGKRZSA-N 1 2 309.504 4.533 20 0 DJADLO Cc1cnc(C[N@H+](C)[C@@H](C)c2sc(C(C)C)nc2C)s1 ZINC000180683235 526008766 /nfs/dbraw/zinc/00/87/66/526008766.db2.gz ABEMJFDEJANWBD-LBPRGKRZSA-N 1 2 309.504 4.533 20 0 DJADLO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2cc3cc(Cl)ccc3o2)s1 ZINC000338289033 526395631 /nfs/dbraw/zinc/39/56/31/526395631.db2.gz GPDJWWNVTWVDCG-DTWKUNHWSA-N 1 2 321.833 4.658 20 0 DJADLO Cc1nnc([C@H](C)[NH2+][C@H](C)c2cc3cc(Cl)ccc3o2)s1 ZINC000338289029 526406316 /nfs/dbraw/zinc/40/63/16/526406316.db2.gz GPDJWWNVTWVDCG-BDAKNGLRSA-N 1 2 321.833 4.658 20 0 DJADLO Cc1nc(C[N@@H+](C)[C@H](C)c2ccc(C(F)(F)F)cc2)cs1 ZINC000102923932 526845617 /nfs/dbraw/zinc/84/56/17/526845617.db2.gz IYQJHWIONCZBRU-SNVBAGLBSA-N 1 2 314.376 4.663 20 0 DJADLO Cc1nc(C[N@H+](C)[C@H](C)c2ccc(C(F)(F)F)cc2)cs1 ZINC000102923932 526845619 /nfs/dbraw/zinc/84/56/19/526845619.db2.gz IYQJHWIONCZBRU-SNVBAGLBSA-N 1 2 314.376 4.663 20 0 DJADLO Cc1sccc1CNc1ccc(-n2cc[nH+]c2)c(Cl)c1 ZINC000339309162 526921378 /nfs/dbraw/zinc/92/13/78/526921378.db2.gz AFWCDVPWDFBVFA-UHFFFAOYSA-N 1 2 303.818 4.508 20 0 DJADLO FC(F)(F)c1csc(C[N@@H+]2CCC[C@H]2c2cccs2)n1 ZINC000130552622 527690166 /nfs/dbraw/zinc/69/01/66/527690166.db2.gz LUEOEVHWLQSNSU-VIFPVBQESA-N 1 2 318.389 4.561 20 0 DJADLO FC(F)(F)c1csc(C[N@H+]2CCC[C@H]2c2cccs2)n1 ZINC000130552622 527690167 /nfs/dbraw/zinc/69/01/67/527690167.db2.gz LUEOEVHWLQSNSU-VIFPVBQESA-N 1 2 318.389 4.561 20 0 DJADLO CC(C)c1nnc(C[NH2+]C(c2ccccc2)c2ccccc2)s1 ZINC000272362017 534985953 /nfs/dbraw/zinc/98/59/53/534985953.db2.gz FNLQZBDVJDRCFM-UHFFFAOYSA-N 1 2 323.465 4.541 20 0 DJADLO CC[C@H]([NH2+][C@H](C)c1nnc(C(C)C)[nH]1)c1cccc(Cl)c1F ZINC000274092069 535943712 /nfs/dbraw/zinc/94/37/12/535943712.db2.gz UFAJPMJVJMRYQN-MFKMUULPSA-N 1 2 324.831 4.523 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1Cl)c1cccnc1Cl ZINC000090180392 185285534 /nfs/dbraw/zinc/28/55/34/185285534.db2.gz YGTREMOLNCKCLD-UWVGGRQHSA-N 1 2 313.203 4.939 20 0 DJADLO CC[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccc(F)cc1F ZINC000090460497 185297789 /nfs/dbraw/zinc/29/77/89/185297789.db2.gz CITXRGWYOVNIAS-CQSZACIVSA-N 1 2 308.397 4.540 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1Cl)c1nccs1 ZINC000080266463 192018937 /nfs/dbraw/zinc/01/89/37/192018937.db2.gz SNPALJDCTMNOPT-IUCAKERBSA-N 1 2 301.242 4.862 20 0 DJADLO C[C@H]([NH2+][C@@H](c1ccc(F)cc1F)C(C)(C)C)c1nccs1 ZINC000091736520 193098814 /nfs/dbraw/zinc/09/88/14/193098814.db2.gz OVFAPKCHWPZORE-HZMBPMFUSA-N 1 2 310.413 4.859 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1F)c1nc2c(s1)CCCC2 ZINC000093369059 193239863 /nfs/dbraw/zinc/23/98/63/193239863.db2.gz DIIXXZAAMGVLQU-WDEREUQCSA-N 1 2 322.424 4.712 20 0 DJADLO Cc1cccc(C)c1OCCCn1c[nH+]c2cc(C)c(C)cc21 ZINC000040224070 183047177 /nfs/dbraw/zinc/04/71/77/183047177.db2.gz GURWEJMFOGYRAU-UHFFFAOYSA-N 1 2 308.425 4.739 20 0 DJADLO Cc1nc(C[NH2+][C@@H](C)c2cc(F)c(Cl)cc2Cl)cs1 ZINC000040418845 183064740 /nfs/dbraw/zinc/06/47/40/183064740.db2.gz NONRSJHBEOFSLN-ZETCQYMHSA-N 1 2 319.232 4.748 20 0 DJADLO C[C@@H]([NH2+]C1(c2c(Cl)cccc2Cl)CC1)c1cncs1 ZINC000272288666 130017868 /nfs/dbraw/zinc/01/78/68/130017868.db2.gz PQKYECAZHXJOFV-SECBINFHSA-N 1 2 313.253 4.790 20 0 DJADLO Cc1nnc([C@H](C)[NH2+][C@H](C)c2cc3cc(C)c(C)cc3o2)s1 ZINC000274218146 130219268 /nfs/dbraw/zinc/21/92/68/130219268.db2.gz NSUUYYVEBPSLTP-NEPJUHHUSA-N 1 2 315.442 4.621 20 0 DJADLO Cc1cc([C@@H](C)[NH2+][C@H](C)c2nc(C(F)(F)F)cs2)c(C)o1 ZINC000274544218 130243927 /nfs/dbraw/zinc/24/39/27/130243927.db2.gz CGNUYPOCEVOABP-RKDXNWHRSA-N 1 2 318.364 4.784 20 0 DJADLO Cc1ccc(-c2csc(C[N@@H+](C)[C@H](C)c3ccncc3)n2)cc1 ZINC000285683807 131193034 /nfs/dbraw/zinc/19/30/34/131193034.db2.gz QSGOIZNUQJJBTK-OAHLLOKOSA-N 1 2 323.465 4.707 20 0 DJADLO Cc1ccc(-c2csc(C[N@H+](C)[C@H](C)c3ccncc3)n2)cc1 ZINC000285683807 131193036 /nfs/dbraw/zinc/19/30/36/131193036.db2.gz QSGOIZNUQJJBTK-OAHLLOKOSA-N 1 2 323.465 4.707 20 0 DJADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+][C@H](C)c1c(F)cncc1F ZINC000285698666 131194585 /nfs/dbraw/zinc/19/45/85/131194585.db2.gz OSYYCIZQKIAGMO-VXGBXAGGSA-N 1 2 316.351 4.826 20 0 DJADLO Cc1ccc(C)c([C@H]2CCCN2C(=O)Nc2c(C)cc[nH+]c2C)c1 ZINC000287405488 131278773 /nfs/dbraw/zinc/27/87/73/131278773.db2.gz DXEDOZZRVGUZKF-GOSISDBHSA-N 1 2 323.440 4.684 20 0 DJADLO CCCN(C(=O)Nc1c(C)cc[nH+]c1C)[C@H]1CCc2ccccc21 ZINC000287543569 131285720 /nfs/dbraw/zinc/28/57/20/131285720.db2.gz OKZRRBJDDQWDOA-SFHVURJKSA-N 1 2 323.440 4.630 20 0 DJADLO Cc1noc(C)c1C[C@H](C)Nc1cc[nH+]c2c(Cl)cccc12 ZINC000570538559 332770183 /nfs/dbraw/zinc/77/01/83/332770183.db2.gz ITCSAMRRJNQBTG-JTQLQIEISA-N 1 2 315.804 4.536 20 0 DJADLO COc1cccc(F)c1[C@H](C)[NH2+][C@H](C)c1c(F)cccc1F ZINC000174220180 332848053 /nfs/dbraw/zinc/84/80/53/332848053.db2.gz JTUARZFNIAUQQU-MNOVXSKESA-N 1 2 309.331 4.524 20 0 DJADLO COc1cccc(F)c1[C@H](C)[NH2+][C@H](C)c1ccc(F)cc1F ZINC000174231316 332849695 /nfs/dbraw/zinc/84/96/95/332849695.db2.gz XWPZCKXIEUIMPJ-MNOVXSKESA-N 1 2 309.331 4.524 20 0 DJADLO Cc1cnc([C@H](C)[NH2+]Cc2cc(Cl)sc2Cl)s1 ZINC000312554679 331642680 /nfs/dbraw/zinc/64/26/80/331642680.db2.gz GIVWHJQKDHBFPA-ZETCQYMHSA-N 1 2 307.271 4.671 20 0 DJADLO C[C@H]([NH2+]C(c1cccs1)c1cccs1)c1nccs1 ZINC000080268541 331684088 /nfs/dbraw/zinc/68/40/88/331684088.db2.gz RRCVSCIQFRDYHB-JTQLQIEISA-N 1 2 306.481 4.706 20 0 DJADLO Clc1ccc(-c2ccc(CNc3c[nH]c[nH+]3)o2)cc1Cl ZINC000558574826 331925091 /nfs/dbraw/zinc/92/50/91/331925091.db2.gz CYOPBWPDHSRYJT-UHFFFAOYSA-N 1 2 308.168 4.589 20 0 DJADLO Cc1cccc(C[N@@H+](Cc2ccco2)Cc2ccnn2C(C)C)c1 ZINC000410422429 332126009 /nfs/dbraw/zinc/12/60/09/332126009.db2.gz PFBZYTIATSKGLJ-UHFFFAOYSA-N 1 2 323.440 4.568 20 0 DJADLO Cc1cccc(C[N@H+](Cc2ccco2)Cc2ccnn2C(C)C)c1 ZINC000410422429 332126010 /nfs/dbraw/zinc/12/60/10/332126010.db2.gz PFBZYTIATSKGLJ-UHFFFAOYSA-N 1 2 323.440 4.568 20 0 DJADLO CCO[C@@H](C)c1nc(C[NH2+][C@H](C)c2cccc(Cl)c2)cs1 ZINC000181417067 332194010 /nfs/dbraw/zinc/19/40/10/332194010.db2.gz MNMZSNJUGYOIEO-NEPJUHHUSA-N 1 2 324.877 4.745 20 0 DJADLO CCCOCc1ccccc1CNc1cc(C(F)(F)F)cc[nH+]1 ZINC000531071849 332246318 /nfs/dbraw/zinc/24/63/18/332246318.db2.gz ZGCUXZRSXONAKH-UHFFFAOYSA-N 1 2 324.346 4.639 20 0 DJADLO Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]CC(C)(F)F ZINC000559891737 332289781 /nfs/dbraw/zinc/28/97/81/332289781.db2.gz SZAQMYAOVCSXMP-SECBINFHSA-N 1 2 314.376 4.563 20 0 DJADLO FC1=CCC[N@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000560257804 332325342 /nfs/dbraw/zinc/32/53/42/332325342.db2.gz UVJSMLJIYWYHRK-UHFFFAOYSA-N 1 2 308.809 4.523 20 0 DJADLO FC1=CCC[N@@H+](Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000560257804 332325343 /nfs/dbraw/zinc/32/53/43/332325343.db2.gz UVJSMLJIYWYHRK-UHFFFAOYSA-N 1 2 308.809 4.523 20 0 DJADLO CC(C)(C)c1ccc(C(=O)Nc2cccc(-c3[nH]cc[nH+]3)c2)cc1 ZINC000560584324 332365288 /nfs/dbraw/zinc/36/52/88/332365288.db2.gz BBTFYJYKAWMGLP-UHFFFAOYSA-N 1 2 319.408 4.627 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)CCCCCc1cccs1 ZINC000425585024 335107020 /nfs/dbraw/zinc/10/70/20/335107020.db2.gz GZONOKRRMQPDFW-UHFFFAOYSA-N 1 2 302.443 4.502 20 0 DJADLO Cc1cnc([C@@H](C)[NH2+][C@H](C)c2cccc(Cl)c2Cl)cn1 ZINC000427818156 332526115 /nfs/dbraw/zinc/52/61/15/332526115.db2.gz NWYLALQBSGAJJX-GHMZBOCLSA-N 1 2 310.228 4.504 20 0 DJADLO CCSCc1ccccc1C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000448124833 332532767 /nfs/dbraw/zinc/53/27/67/332532767.db2.gz JGBZCFUTLVUHJM-UHFFFAOYSA-N 1 2 314.454 4.512 20 0 DJADLO CC[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1Cl)c1ccn(C)n1 ZINC000427883407 332554957 /nfs/dbraw/zinc/55/49/57/332554957.db2.gz QOJDCNJKDLGMPN-IINYFYTJSA-N 1 2 312.244 4.529 20 0 DJADLO COc1cccc(Cl)c1C[NH2+][C@H](C)c1ccccc1Cl ZINC000169274749 332625786 /nfs/dbraw/zinc/62/57/86/332625786.db2.gz PRILZHCYJAVBSN-LLVKDONJSA-N 1 2 310.224 4.853 20 0 DJADLO C[C@@H]([NH2+]Cc1ncc(Cl)s1)c1cccc(C(F)(F)F)c1 ZINC000225293732 332666153 /nfs/dbraw/zinc/66/61/53/332666153.db2.gz BUUIOYKMYOZWEP-MRVPVSSYSA-N 1 2 320.767 4.666 20 0 DJADLO C[C@@H]([NH2+]Cc1nc2cc(F)ccc2o1)c1cc2ccccc2o1 ZINC000182633056 333043764 /nfs/dbraw/zinc/04/37/64/333043764.db2.gz UHZHWTKLENVQQB-LLVKDONJSA-N 1 2 310.328 4.564 20 0 DJADLO Cc1nc([C@H](C)[NH2+][C@@H](C)c2cc3cccc(F)c3o2)cs1 ZINC000462821570 333119445 /nfs/dbraw/zinc/11/94/45/333119445.db2.gz ZTRXVRPRGXALCV-UWVGGRQHSA-N 1 2 304.390 4.749 20 0 DJADLO FC(F)c1ccc(CSCc2cn3ccccc3[nH+]2)cc1 ZINC000460756534 333136305 /nfs/dbraw/zinc/13/63/05/333136305.db2.gz NWLFWXSHSAZBGL-UHFFFAOYSA-N 1 2 304.365 4.705 20 0 DJADLO COc1ccc([C@@H](C)[NH2+][C@H](C)c2c(F)cccc2F)c(F)c1 ZINC000314530142 333138130 /nfs/dbraw/zinc/13/81/30/333138130.db2.gz HBBBGHSDJQEQRM-GHMZBOCLSA-N 1 2 309.331 4.524 20 0 DJADLO c1cn(Cc2ccccc2)c(CSc2ccc3c(c2)CCC3)[nH+]1 ZINC000497323176 333236248 /nfs/dbraw/zinc/23/62/48/333236248.db2.gz QYECYMLXSFMEGR-UHFFFAOYSA-N 1 2 320.461 4.712 20 0 DJADLO CCn1ccnc1C[N@H+](C)[C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000525779143 333299863 /nfs/dbraw/zinc/29/98/63/333299863.db2.gz CGQHXPDUTDRLOX-KRWDZBQOSA-N 1 2 319.452 4.763 20 0 DJADLO CCn1ccnc1C[N@@H+](C)[C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000525779143 333299865 /nfs/dbraw/zinc/29/98/65/333299865.db2.gz CGQHXPDUTDRLOX-KRWDZBQOSA-N 1 2 319.452 4.763 20 0 DJADLO C[C@@H]([NH2+]Cc1csc(C(C)(C)C)n1)c1ccc(F)c(F)c1 ZINC000098161598 333507592 /nfs/dbraw/zinc/50/75/92/333507592.db2.gz CUYSAWGKEQRZMC-SNVBAGLBSA-N 1 2 310.413 4.570 20 0 DJADLO Cc1ccc(NC(=O)N(C)[C@@H](C)c2cccc(Cl)c2)c(C)[nH+]1 ZINC000152150721 333626345 /nfs/dbraw/zinc/62/63/45/333626345.db2.gz FGKVFBONJOWDHI-ZDUSSCGKSA-N 1 2 317.820 4.577 20 0 DJADLO Cc1ccc(NC(=O)N(C)[C@@H](C)c2ccc(Cl)cc2)c(C)[nH+]1 ZINC000152153569 333632966 /nfs/dbraw/zinc/63/29/66/333632966.db2.gz PCMNRCFUGHTESY-ZDUSSCGKSA-N 1 2 317.820 4.577 20 0 DJADLO CC(C)n1c[nH+]cc1CNc1ccc(-c2cnc(C3CC3)o2)cc1 ZINC000571194654 333680334 /nfs/dbraw/zinc/68/03/34/333680334.db2.gz AHLXFYVPMQCLJD-UHFFFAOYSA-N 1 2 322.412 4.609 20 0 DJADLO CC[C@H]([NH2+][C@H](C)c1csc(C(C)C)n1)c1c(C)noc1C ZINC000186434635 335157883 /nfs/dbraw/zinc/15/78/83/335157883.db2.gz AISXFCOYUBJDNF-MFKMUULPSA-N 1 2 307.463 4.673 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1Cl)c1cc2n(n1)CCC2 ZINC000414059526 333888817 /nfs/dbraw/zinc/88/88/17/333888817.db2.gz WLCHRGXLAKOOKH-GHMZBOCLSA-N 1 2 324.255 4.548 20 0 DJADLO CCn1ccc(C[NH2+][C@H](C)c2cc3c(ccc4ccccc34)o2)n1 ZINC000414207425 333921566 /nfs/dbraw/zinc/92/15/66/333921566.db2.gz JXXOZIJMBPABLT-CQSZACIVSA-N 1 2 319.408 4.653 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1ccc(-c2cccs2)cc1)c1csnn1 ZINC000414294079 333934790 /nfs/dbraw/zinc/93/47/90/333934790.db2.gz DEFDGYWLLSPAEF-RYUDHWBXSA-N 1 2 315.467 4.678 20 0 DJADLO Cc1cc(C)cc(-c2ccc(C[NH2+][C@@H](C)c3csnn3)cc2)c1 ZINC000414553104 334016197 /nfs/dbraw/zinc/01/61/97/334016197.db2.gz SJCHJZRSLIILSO-HNNXBMFYSA-N 1 2 323.465 4.673 20 0 DJADLO FC(F)(F)c1ccc(CNc2ccc3c(c2)CCC[NH2+]3)s1 ZINC000414852093 334126239 /nfs/dbraw/zinc/12/62/39/334126239.db2.gz PBKKJBXQOGIDDP-UHFFFAOYSA-N 1 2 312.360 4.737 20 0 DJADLO CC(C)c1ccc([C@@H]2CCC[N@@H+]2Cc2nccn2C(F)F)cc1 ZINC000534666040 334318851 /nfs/dbraw/zinc/31/88/51/334318851.db2.gz XTJYKGUWTYPFDQ-INIZCTEOSA-N 1 2 319.399 4.739 20 0 DJADLO CC(C)c1ccc([C@@H]2CCC[N@H+]2Cc2nccn2C(F)F)cc1 ZINC000534666040 334318853 /nfs/dbraw/zinc/31/88/53/334318853.db2.gz XTJYKGUWTYPFDQ-INIZCTEOSA-N 1 2 319.399 4.739 20 0 DJADLO CC[N@H+](Cc1nc(C)c(C)o1)Cc1ccc(Cl)c(Cl)c1 ZINC000064142926 334339147 /nfs/dbraw/zinc/33/91/47/334339147.db2.gz GHSFDLPWBOOUBN-UHFFFAOYSA-N 1 2 313.228 4.620 20 0 DJADLO CC[N@@H+](Cc1nc(C)c(C)o1)Cc1ccc(Cl)c(Cl)c1 ZINC000064142926 334339148 /nfs/dbraw/zinc/33/91/48/334339148.db2.gz GHSFDLPWBOOUBN-UHFFFAOYSA-N 1 2 313.228 4.620 20 0 DJADLO C[C@H]1CCC[C@@H](C(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)C1 ZINC000303897157 334339904 /nfs/dbraw/zinc/33/99/04/334339904.db2.gz PNTRKGRPIRNJOG-LSDHHAIUSA-N 1 2 310.397 4.639 20 0 DJADLO CC[C@@](C)([NH2+]Cc1c(Cl)oc2ccccc21)c1nccs1 ZINC000534899764 334347751 /nfs/dbraw/zinc/34/77/51/334347751.db2.gz DFBMOLDJAWZHCB-MRXNPFEDSA-N 1 2 320.845 4.958 20 0 DJADLO CCC[C@@H]([NH2+]Cc1nc(C)sc1C)c1ccc(F)cc1F ZINC000342294974 334525886 /nfs/dbraw/zinc/52/58/86/334525886.db2.gz OQPYEDRTQCUKRV-OAHLLOKOSA-N 1 2 310.413 4.669 20 0 DJADLO CC(C)c1nnc(C[N@@H+](C)[C@H](c2ccccc2Cl)C(C)C)o1 ZINC000113256342 335283633 /nfs/dbraw/zinc/28/36/33/335283633.db2.gz IKQQINBAROFBDK-INIZCTEOSA-N 1 2 321.852 4.676 20 0 DJADLO CC(C)c1nnc(C[N@H+](C)[C@H](c2ccccc2Cl)C(C)C)o1 ZINC000113256342 335283634 /nfs/dbraw/zinc/28/36/34/335283634.db2.gz IKQQINBAROFBDK-INIZCTEOSA-N 1 2 321.852 4.676 20 0 DJADLO O=C(Nc1ccc(Oc2cc[nH+]cc2)cc1)Nc1ccccc1F ZINC000051236418 335656594 /nfs/dbraw/zinc/65/65/94/335656594.db2.gz FKKARMNLEAHQEW-UHFFFAOYSA-N 1 2 323.327 4.657 20 0 DJADLO CCC[C@H]([NH2+]Cc1ncc(Cl)s1)c1ccc(F)cc1F ZINC000349644568 335688029 /nfs/dbraw/zinc/68/80/29/335688029.db2.gz IEUXAXATJYFSRP-LBPRGKRZSA-N 1 2 316.804 4.706 20 0 DJADLO Cc1ccc(C[NH2+][C@H](C)c2cscn2)c(OCCC(C)C)c1 ZINC000536625664 335845620 /nfs/dbraw/zinc/84/56/20/335845620.db2.gz MAMYLCADJTZEGN-OAHLLOKOSA-N 1 2 318.486 4.727 20 0 DJADLO Clc1ccc(Cl)c(C=C2CC[NH+](Cc3cocn3)CC2)c1 ZINC000191950290 336012655 /nfs/dbraw/zinc/01/26/55/336012655.db2.gz YDECONFCNZZLTH-UHFFFAOYSA-N 1 2 323.223 4.661 20 0 DJADLO Cc1nc(-c2cccc(NCCCc3ccc(C)[nH+]c3)c2)cs1 ZINC000351271650 336025262 /nfs/dbraw/zinc/02/52/62/336025262.db2.gz RJRVGIFXDHMWNZ-UHFFFAOYSA-N 1 2 323.465 4.867 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N[C@H](CC1CCC1)c1ccccc1 ZINC000351931635 336180391 /nfs/dbraw/zinc/18/03/91/336180391.db2.gz SDQUXUGECXIVJD-GOSISDBHSA-N 1 2 323.440 4.751 20 0 DJADLO Cc1nc(C[N@H+]2CC=C(c3ccccc3Cl)CC2)sc1C ZINC000351945648 336182164 /nfs/dbraw/zinc/18/21/64/336182164.db2.gz SHOMGYRTCRQJRS-UHFFFAOYSA-N 1 2 318.873 4.703 20 0 DJADLO Cc1nc(C[N@@H+]2CC=C(c3ccccc3Cl)CC2)sc1C ZINC000351945648 336182166 /nfs/dbraw/zinc/18/21/66/336182166.db2.gz SHOMGYRTCRQJRS-UHFFFAOYSA-N 1 2 318.873 4.703 20 0 DJADLO C[C@H](c1ccc(Cl)cc1)[N@@H+]1CCO[C@@H](c2cccs2)C1 ZINC000532379404 336244108 /nfs/dbraw/zinc/24/41/08/336244108.db2.gz KEFHRLJLMHYGTO-IUODEOHRSA-N 1 2 307.846 4.536 20 0 DJADLO C[C@H](c1ccc(Cl)cc1)[N@H+]1CCO[C@@H](c2cccs2)C1 ZINC000532379404 336244109 /nfs/dbraw/zinc/24/41/09/336244109.db2.gz KEFHRLJLMHYGTO-IUODEOHRSA-N 1 2 307.846 4.536 20 0 DJADLO CCc1ccc([C@@H](COC)[NH2+][C@@H](CC)c2ccc(F)cc2F)o1 ZINC000532524539 336254253 /nfs/dbraw/zinc/25/42/53/336254253.db2.gz DXRMYCLCJGFEEP-DLBZAZTESA-N 1 2 323.383 4.549 20 0 DJADLO C[C@@H]1c2cc(Cl)cc(Cl)c2CC[N@H+]1Cc1ccncc1 ZINC000532646272 336265621 /nfs/dbraw/zinc/26/56/21/336265621.db2.gz AOKFSNUZXPKGGU-LLVKDONJSA-N 1 2 307.224 4.508 20 0 DJADLO C[C@@H]1c2cc(Cl)cc(Cl)c2CC[N@@H+]1Cc1ccncc1 ZINC000532646272 336265622 /nfs/dbraw/zinc/26/56/22/336265622.db2.gz AOKFSNUZXPKGGU-LLVKDONJSA-N 1 2 307.224 4.508 20 0 DJADLO CCCOc1cccc(N[C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000324884422 336270869 /nfs/dbraw/zinc/27/08/69/336270869.db2.gz MVWGZGDSASUYSH-INIZCTEOSA-N 1 2 321.424 4.834 20 0 DJADLO Cc1c[nH]c(-c2ccccc2NC(=O)C[C@@H]2CCCC[C@@H]2C)[nH+]1 ZINC000532862004 336273289 /nfs/dbraw/zinc/27/32/89/336273289.db2.gz KBGWQDVLCLFYID-ZFWWWQNUSA-N 1 2 311.429 4.540 20 0 DJADLO c1ccc2sc([C@H]3CCCN3c3[nH]c4ccccc4[nH+]3)nc2c1 ZINC000301083753 336288986 /nfs/dbraw/zinc/28/89/86/336288986.db2.gz VEXDGIHIPINTPO-OAHLLOKOSA-N 1 2 320.421 4.514 20 0 DJADLO CCCC(=O)Nc1cccc(CNc2ccc3ccccc3[nH+]2)c1 ZINC000301087494 336289210 /nfs/dbraw/zinc/28/92/10/336289210.db2.gz JNXHOMIEGZEFPB-UHFFFAOYSA-N 1 2 319.408 4.586 20 0 DJADLO Cc1cc(N[C@H](c2ccccc2)C(C)C)nc(-c2cccnc2)[nH+]1 ZINC000301128507 336291297 /nfs/dbraw/zinc/29/12/97/336291297.db2.gz RZOQNOKGLSKFLW-IBGZPJMESA-N 1 2 318.424 4.656 20 0 DJADLO CC[C@H](Nc1cc[nH+]c(C2CC2)n1)c1ccccc1OC(F)F ZINC000301232805 336295888 /nfs/dbraw/zinc/29/58/88/336295888.db2.gz BLLXKHKQKNXIEV-ZDUSSCGKSA-N 1 2 319.355 4.519 20 0 DJADLO Cc1cc(N[C@H](C)c2cccc(C)c2C)nc(-c2cccnc2)[nH+]1 ZINC000301266898 336297769 /nfs/dbraw/zinc/29/77/69/336297769.db2.gz GTMRYGBYNAITOW-MRXNPFEDSA-N 1 2 318.424 4.637 20 0 DJADLO C[C@@H](Nc1ccc2ccccc2[nH+]1)c1cccc(-n2cccn2)c1 ZINC000301418290 336305470 /nfs/dbraw/zinc/30/54/70/336305470.db2.gz GRHWZHWEVYKQFA-OAHLLOKOSA-N 1 2 314.392 4.594 20 0 DJADLO C[C@H](Nc1cc[nH+]c(C(C)(C)C)n1)c1ccc(OC(F)F)cc1 ZINC000301461234 336308257 /nfs/dbraw/zinc/30/82/57/336308257.db2.gz ZJAOFHVMLFHFHG-NSHDSACASA-N 1 2 321.371 4.549 20 0 DJADLO C[C@@H](Nc1cc[nH+]c(C(C)(C)C)n1)c1cccc(OC(F)F)c1 ZINC000301536963 336313199 /nfs/dbraw/zinc/31/31/99/336313199.db2.gz RCGKCGFQDACTPA-LLVKDONJSA-N 1 2 321.371 4.549 20 0 DJADLO C[C@H](Nc1cc[nH+]c(C(C)(C)C)n1)c1cccc(N2CCCC2)c1 ZINC000301554703 336314549 /nfs/dbraw/zinc/31/45/49/336314549.db2.gz IAWJAEZAUPSRHY-HNNXBMFYSA-N 1 2 324.472 4.547 20 0 DJADLO O[C@H](CNc1ccc2ccccc2[nH+]1)c1cc2ccccc2s1 ZINC000301611947 336318228 /nfs/dbraw/zinc/31/82/28/336318228.db2.gz FEECRUJBSSCDDX-MRXNPFEDSA-N 1 2 320.417 4.595 20 0 DJADLO Cc1cc(N[C@H](C)c2ncc(-c3ccccc3)o2)nc(C(C)C)[nH+]1 ZINC000301636783 336319730 /nfs/dbraw/zinc/31/97/30/336319730.db2.gz FHUMWZLMXWUOHU-CQSZACIVSA-N 1 2 322.412 4.737 20 0 DJADLO CCc1nc([C@@H](C)Nc2cc(C)[nH+]c3c(F)cccc23)cs1 ZINC000301649201 336320619 /nfs/dbraw/zinc/32/06/19/336320619.db2.gz FNDGTFHGJKDJKZ-LLVKDONJSA-N 1 2 315.417 4.874 20 0 DJADLO Cc1cc(N[C@H](C)c2nc3ccccc3[nH]2)c2cccc(F)c2[nH+]1 ZINC000301688784 336323688 /nfs/dbraw/zinc/32/36/88/336323688.db2.gz VQNDCHFTOUVKFM-GFCCVEGCSA-N 1 2 320.371 4.732 20 0 DJADLO Cc1cc2ccccc2[nH+]c1N1CCC(OCC2CCCC2)CC1 ZINC000301699231 336324240 /nfs/dbraw/zinc/32/42/40/336324240.db2.gz CRQJDVNXXOICLG-UHFFFAOYSA-N 1 2 324.468 4.719 20 0 DJADLO Cc1cc2ccccc2[nH+]c1N1CCC(Nc2ccccc2)CC1 ZINC000301701667 336324353 /nfs/dbraw/zinc/32/43/53/336324353.db2.gz QFZHLKHQGJLDNB-UHFFFAOYSA-N 1 2 317.436 4.624 20 0 DJADLO Cc1cccc([C@@H]2CCCN2c2cc(C)[nH+]c3c(F)cccc23)n1 ZINC000301725637 336325877 /nfs/dbraw/zinc/32/58/77/336325877.db2.gz UUJCLDTZFNHZLK-SFHVURJKSA-N 1 2 321.399 4.727 20 0 DJADLO Fc1cccc([C@H]2CCCN2c2cc(C(F)(F)F)cc[nH+]2)c1 ZINC000301977569 336340954 /nfs/dbraw/zinc/34/09/54/336340954.db2.gz FPKMIEDCJNEWQO-CQSZACIVSA-N 1 2 310.294 4.581 20 0 DJADLO CCc1cc(N2CCCC[C@@H]2c2cc3ccccc3[nH]2)nc(C)[nH+]1 ZINC000302067285 336346579 /nfs/dbraw/zinc/34/65/79/336346579.db2.gz DBKXZRNUCGEHFE-LJQANCHMSA-N 1 2 320.440 4.560 20 0 DJADLO Cc1cc(N2C[C@H](C)C[C@@H]2c2cccnc2)c2cccc(F)c2[nH+]1 ZINC000302134662 336350157 /nfs/dbraw/zinc/35/01/57/336350157.db2.gz LWYGQEMETXNMJB-FZKQIMNGSA-N 1 2 321.399 4.665 20 0 DJADLO CC(C)c1nc(N[C@@H](C)c2nccs2)cc(C(C)(C)C)[nH+]1 ZINC000302873437 336372634 /nfs/dbraw/zinc/37/26/34/336372634.db2.gz CRDJBJSZPRCHIT-NSHDSACASA-N 1 2 304.463 4.527 20 0 DJADLO Cc1cnc([C@@H](C)Nc2cc(C(C)(C)C)[nH+]c(C(C)C)n2)s1 ZINC000302879491 336373018 /nfs/dbraw/zinc/37/30/18/336373018.db2.gz GWTHBIOCSHIISZ-GFCCVEGCSA-N 1 2 318.490 4.836 20 0 DJADLO CC(C)(C)[C@@H]1CCCN1C(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000353114550 336402995 /nfs/dbraw/zinc/40/29/95/336402995.db2.gz PEYJFSVPGZRQTR-SFHVURJKSA-N 1 2 324.424 4.525 20 0 DJADLO CC[C@H]1CC[C@@H](C)N1C(=O)c1ccc(C)c(Oc2cc[nH+]cc2)c1 ZINC000357764344 336597385 /nfs/dbraw/zinc/59/73/85/336597385.db2.gz UEUGMVLOTLWHAV-WBVHZDCISA-N 1 2 324.424 4.585 20 0 DJADLO CN(C(=O)c1cccc(Oc2cc[nH+]cc2)c1)[C@H]1CCC(C)(C)C1 ZINC000358061427 336609288 /nfs/dbraw/zinc/60/92/88/336609288.db2.gz VHKNSYQXPPYUGU-INIZCTEOSA-N 1 2 324.424 4.525 20 0 DJADLO CCC[C@H]([NH2+][C@H](C)c1csc(C)n1)c1ccc(F)cc1F ZINC000360994672 336731497 /nfs/dbraw/zinc/73/14/97/336731497.db2.gz GGOAWPHMMRKQMF-BMIGLBTASA-N 1 2 310.413 4.922 20 0 DJADLO Cc1nc([C@H](C)[NH2+]Cc2ccc(-c3ccco3)cc2F)cs1 ZINC000360999494 336731723 /nfs/dbraw/zinc/73/17/23/336731723.db2.gz UKDMNWLGWIDWFI-NSHDSACASA-N 1 2 316.401 4.701 20 0 DJADLO c1csc([C@@H]([NH2+]Cc2ccc3occc3c2)c2ccccc2)n1 ZINC000367542155 336824724 /nfs/dbraw/zinc/82/47/24/336824724.db2.gz XULYQNFEHGIZFV-SFHVURJKSA-N 1 2 320.417 4.769 20 0 DJADLO C[C@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1cccc(F)c1F ZINC000371509827 336906638 /nfs/dbraw/zinc/90/66/38/336906638.db2.gz QYGNNUMPRKCQSK-XOBRGWDASA-N 1 2 324.374 4.800 20 0 DJADLO Cc1nc([C@@H](C)[NH2+][C@H]2CC(C)(C)Oc3cc(F)ccc32)cs1 ZINC000372059848 336920821 /nfs/dbraw/zinc/92/08/21/336920821.db2.gz BNQMVBNECUXHKS-YGRLFVJLSA-N 1 2 320.433 4.544 20 0 DJADLO Cc1nc([C@H](C)[NH2+][C@H]2CC(C)(C)Oc3cc(F)ccc32)cs1 ZINC000372059845 336920842 /nfs/dbraw/zinc/92/08/42/336920842.db2.gz BNQMVBNECUXHKS-HZMBPMFUSA-N 1 2 320.433 4.544 20 0 DJADLO Cc1cccc([C@H]([NH2+][C@@H](C)c2cc(C)ccn2)c2ccccn2)c1 ZINC000375811378 337020188 /nfs/dbraw/zinc/02/01/88/337020188.db2.gz WGGNVDOXXDFYCR-UWJYYQICSA-N 1 2 317.436 4.534 20 0 DJADLO C[C@H]([NH2+][C@H](c1cccs1)c1ccc(Cl)cc1)c1ncc[nH]1 ZINC000375898426 337022554 /nfs/dbraw/zinc/02/25/54/337022554.db2.gz SKFINIVAHKEYBD-NHYWBVRUSA-N 1 2 317.845 4.565 20 0 DJADLO Cc1ccccc1[C@H](C)[NH2+][C@H](c1nccs1)c1ccccc1 ZINC000123263175 337041617 /nfs/dbraw/zinc/04/16/17/337041617.db2.gz ZWKUCDCEANEHGY-YJBOKZPZSA-N 1 2 308.450 4.892 20 0 DJADLO Cc1nc([C@H](C)[NH2+][C@@H]2CCCOc3c(Cl)cccc32)cs1 ZINC000378449049 337073103 /nfs/dbraw/zinc/07/31/03/337073103.db2.gz FFFHOGDNTWMSOY-IINYFYTJSA-N 1 2 322.861 4.669 20 0 DJADLO CCCc1cccc(C(C)C)c1NC(=O)C[C@@H](C)n1cc[nH+]c1 ZINC000582610454 337113635 /nfs/dbraw/zinc/11/36/35/337113635.db2.gz XOVRBWMFAQNPSE-OAHLLOKOSA-N 1 2 313.445 4.549 20 0 DJADLO C[C@@H]([NH2+][C@H](c1cccc(Cl)c1)c1ccccn1)c1ccoc1 ZINC000178488612 337163090 /nfs/dbraw/zinc/16/30/90/337163090.db2.gz DAAPYCDIFAXSAU-FZKQIMNGSA-N 1 2 312.800 4.768 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1cccc(Cl)c1)c1ccccn1)c1ccoc1 ZINC000178488580 337163127 /nfs/dbraw/zinc/16/31/27/337163127.db2.gz DAAPYCDIFAXSAU-ACJLOTCBSA-N 1 2 312.800 4.768 20 0 DJADLO Cc1c([C@H](C)[NH2+][C@H](c2ccco2)c2ccccc2)cnn1C(C)C ZINC000191134073 337294443 /nfs/dbraw/zinc/29/44/43/337294443.db2.gz QYGRSYFUZINNKC-YWZLYKJASA-N 1 2 323.440 4.806 20 0 DJADLO C[C@H]([NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1)c1nc2c(s1)CCCC2 ZINC000584486157 337349794 /nfs/dbraw/zinc/34/97/94/337349794.db2.gz RSTIJZDNFWVMPD-MBNYWOFBSA-N 1 2 316.470 4.589 20 0 DJADLO Cc1cc([C@H](C)[NH2+][C@@H](COCC(C)C)c2ccco2)c(C)o1 ZINC000584569554 337363581 /nfs/dbraw/zinc/36/35/81/337363581.db2.gz LHEMXUJIGOHNJV-YOEHRIQHSA-N 1 2 305.418 4.554 20 0 DJADLO C/C=C/c1ccc(NCc2[nH+]ccn2Cc2ccccc2)cc1 ZINC000520783015 337390467 /nfs/dbraw/zinc/39/04/67/337390467.db2.gz PTLQLURJQAXNCZ-QHHAFSJGSA-N 1 2 303.409 4.577 20 0 DJADLO C[C@H]([NH2+][C@H](c1nccs1)c1ccccc1)c1ccccc1F ZINC000195069783 337464756 /nfs/dbraw/zinc/46/47/56/337464756.db2.gz LKXANAFDHQXESC-GUYCJALGSA-N 1 2 312.413 4.722 20 0 DJADLO CCCCc1noc([C@@H](C)[NH2+][C@H](C)c2ccc(C3CC3)cc2)n1 ZINC000419332783 337479967 /nfs/dbraw/zinc/47/99/67/337479967.db2.gz DZNUMXYHPBBSCN-ZIAGYGMSSA-N 1 2 313.445 4.701 20 0 DJADLO c1csc(-c2cccc(N[C@@H]3CCc4ccc[nH+]c4CC3)c2)n1 ZINC000421842003 337653506 /nfs/dbraw/zinc/65/35/06/337653506.db2.gz MNDPALIQEWOSSM-MRXNPFEDSA-N 1 2 321.449 4.565 20 0 DJADLO C[C@@H]([NH2+]Cc1cc(Cl)sc1Cl)c1ccncc1Cl ZINC000421845664 337654331 /nfs/dbraw/zinc/65/43/31/337654331.db2.gz QMXXJRXOIBTKNB-SSDOTTSWSA-N 1 2 321.660 4.954 20 0 DJADLO C[C@H](Nc1ccc2c(c1)CC[NH2+]2)c1ccc(Br)s1 ZINC000423209851 337704264 /nfs/dbraw/zinc/70/42/64/337704264.db2.gz FLONANJGSRBBMR-VIFPVBQESA-N 1 2 323.259 4.652 20 0 DJADLO Clc1cccc2c1OCCC[C@H]2Nc1ccc2c(c1)CC[NH2+]2 ZINC000423214672 337704804 /nfs/dbraw/zinc/70/48/04/337704804.db2.gz LSEGEUDIACXYKN-QGZVFWFLSA-N 1 2 314.816 4.634 20 0 DJADLO CC[C@@]1(C)CCCN(C(=O)c2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000081322720 337712255 /nfs/dbraw/zinc/71/22/55/337712255.db2.gz XZIMRBXGZARNOH-FQEVSTJZSA-N 1 2 324.424 4.526 20 0 DJADLO c1ccc2c(c1)cc[nH+]c2N1CCC(OC2CCCCC2)CC1 ZINC000527862325 337766002 /nfs/dbraw/zinc/76/60/02/337766002.db2.gz FNOWOHZHOLTOLA-UHFFFAOYSA-N 1 2 310.441 4.553 20 0 DJADLO CC[C@H]([NH2+][C@@H](C)c1ncccc1F)c1cc(Cl)ccc1OC ZINC000528036267 337782618 /nfs/dbraw/zinc/78/26/18/337782618.db2.gz QRELISHQHNIEPZ-NHYWBVRUSA-N 1 2 322.811 4.685 20 0 DJADLO COc1ccccc1[C@@H]([NH2+]Cc1cc(C)cc(C)c1)c1ccco1 ZINC000533187526 337833802 /nfs/dbraw/zinc/83/38/02/337833802.db2.gz KDSSTGIFMOJQAE-OAQYLSRUSA-N 1 2 321.420 4.784 20 0 DJADLO COc1ccccc1[C@@H]([NH2+][C@@H](C)c1cccs1)c1ccccn1 ZINC000090913494 337887158 /nfs/dbraw/zinc/88/71/58/337887158.db2.gz FGJNPBCUXXRPAU-IFXJQAMLSA-N 1 2 324.449 4.592 20 0 DJADLO Cc1ncc([C@H](C)[NH2+][C@@H](c2cccc(C)c2)c2ccccn2)s1 ZINC000090947094 337887523 /nfs/dbraw/zinc/88/75/23/337887523.db2.gz GGOUBSNMUROOPM-LIRRHRJNSA-N 1 2 323.465 4.595 20 0 DJADLO Cc1ncc([C@H](C)[NH2+][C@H](c2cccc(C)c2)c2ccccn2)s1 ZINC000090947096 337887525 /nfs/dbraw/zinc/88/75/25/337887525.db2.gz GGOUBSNMUROOPM-IFXJQAMLSA-N 1 2 323.465 4.595 20 0 DJADLO CCC[C@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccc(F)cc1F ZINC000537123635 337893447 /nfs/dbraw/zinc/89/34/47/337893447.db2.gz ARTGHEWMAXYSPD-HNNXBMFYSA-N 1 2 322.399 4.881 20 0 DJADLO C[C@@H]([NH2+]Cc1nc2ccc(F)cc2o1)c1c(F)cccc1Cl ZINC000537175688 337907232 /nfs/dbraw/zinc/90/72/32/337907232.db2.gz WLEGKUHLRAFVBD-SECBINFHSA-N 1 2 322.742 4.610 20 0 DJADLO COc1ccc(F)cc1[C@@H](C)[NH2+][C@@H](C)c1c(F)cccc1F ZINC000122335276 337914340 /nfs/dbraw/zinc/91/43/40/337914340.db2.gz WJAIWJUVRCEMSA-MNOVXSKESA-N 1 2 309.331 4.524 20 0 DJADLO CC[C@@H](Nc1ccc(-c2cnc(C3CC3)o2)cc1)c1[nH+]ccn1C ZINC000537538392 337941568 /nfs/dbraw/zinc/94/15/68/337941568.db2.gz FPADCGRQBMQIQS-MRXNPFEDSA-N 1 2 322.412 4.516 20 0 DJADLO Cc1cccn2cc(CS[C@@H](C)c3nc4ccccc4o3)[nH+]c12 ZINC000537600370 337945067 /nfs/dbraw/zinc/94/50/67/337945067.db2.gz IJIQASHOHXITLJ-ZDUSSCGKSA-N 1 2 323.421 4.778 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1cc(Cl)sc1Cl)c1cscn1 ZINC000514799322 337971823 /nfs/dbraw/zinc/97/18/23/337971823.db2.gz QUOZUFGKTPLAHT-RNFRBKRXSA-N 1 2 307.271 4.923 20 0 DJADLO CCCc1csc(C[N@@H+]2CC[C@H](C(F)(F)F)C(C)(C)C2)n1 ZINC000426367173 338028971 /nfs/dbraw/zinc/02/89/71/338028971.db2.gz SMCSTACCAGOERS-LBPRGKRZSA-N 1 2 320.424 4.506 20 0 DJADLO CCCc1csc(C[N@H+]2CC[C@H](C(F)(F)F)C(C)(C)C2)n1 ZINC000426367173 338028972 /nfs/dbraw/zinc/02/89/72/338028972.db2.gz SMCSTACCAGOERS-LBPRGKRZSA-N 1 2 320.424 4.506 20 0 DJADLO Cc1cccc(C[N@@H+](C)[C@H](C)c2noc(-c3ccccc3)n2)c1C ZINC000428715933 338059355 /nfs/dbraw/zinc/05/93/55/338059355.db2.gz ACWFOSJBKUAVKC-MRXNPFEDSA-N 1 2 321.424 4.546 20 0 DJADLO Cc1cccc(C[N@H+](C)[C@H](C)c2noc(-c3ccccc3)n2)c1C ZINC000428715933 338059356 /nfs/dbraw/zinc/05/93/56/338059356.db2.gz ACWFOSJBKUAVKC-MRXNPFEDSA-N 1 2 321.424 4.546 20 0 DJADLO Cc1oc(-c2ccccc2)nc1C[NH2+]C(C)(C)c1ccccc1F ZINC000429257440 338075025 /nfs/dbraw/zinc/07/50/25/338075025.db2.gz DEWWGGHXIRHPFO-UHFFFAOYSA-N 1 2 324.399 4.814 20 0 DJADLO CC1(C)C[N@H+](Cc2ccccc2C(F)(F)F)[C@@H]1c1cccnc1 ZINC000430110326 338097399 /nfs/dbraw/zinc/09/73/99/338097399.db2.gz YKFBVHZXAQKQCM-MRXNPFEDSA-N 1 2 320.358 4.684 20 0 DJADLO CC1(C)C[N@@H+](Cc2ccccc2C(F)(F)F)[C@@H]1c1cccnc1 ZINC000430110326 338097400 /nfs/dbraw/zinc/09/74/00/338097400.db2.gz YKFBVHZXAQKQCM-MRXNPFEDSA-N 1 2 320.358 4.684 20 0 DJADLO C[C@@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1csc(Cl)c1 ZINC000430732866 338112729 /nfs/dbraw/zinc/11/27/29/338112729.db2.gz HOTUTZMSYQWYRL-ZCFIWIBFSA-N 1 2 323.742 4.809 20 0 DJADLO Clc1scc(CNc2ccc(-n3cc[nH+]c3)cc2)c1Cl ZINC000432228925 338149183 /nfs/dbraw/zinc/14/91/83/338149183.db2.gz NPHUVGMDHXIEEF-UHFFFAOYSA-N 1 2 324.236 4.853 20 0 DJADLO C[C@H]([NH2+]Cc1cc(F)c(Cl)cc1F)c1ccc(F)cc1F ZINC000432512845 338157991 /nfs/dbraw/zinc/15/79/91/338157991.db2.gz XZJLFPZTKPASSN-QMMMGPOBSA-N 1 2 317.713 4.747 20 0 DJADLO C[C@H]([NH2+]Cc1cc(F)c(Cl)cc1F)c1cc(F)ccc1F ZINC000432509877 338158025 /nfs/dbraw/zinc/15/80/25/338158025.db2.gz OSAWCLHORUNRTC-QMMMGPOBSA-N 1 2 317.713 4.747 20 0 DJADLO Cc1ccn2c(CNc3ccccc3OC3CCCC3)c[nH+]c2c1 ZINC000432626530 338161129 /nfs/dbraw/zinc/16/11/29/338161129.db2.gz JZZFBZWRDAGAMZ-UHFFFAOYSA-N 1 2 321.424 4.576 20 0 DJADLO Cc1ncsc1C[N@@H+](C)Cc1ccc(F)c(Cl)c1Cl ZINC000432736835 338165117 /nfs/dbraw/zinc/16/51/17/338165117.db2.gz GYKBGEGCPSRHGH-UHFFFAOYSA-N 1 2 319.232 4.529 20 0 DJADLO Cc1ncsc1C[N@H+](C)Cc1ccc(F)c(Cl)c1Cl ZINC000432736835 338165118 /nfs/dbraw/zinc/16/51/18/338165118.db2.gz GYKBGEGCPSRHGH-UHFFFAOYSA-N 1 2 319.232 4.529 20 0 DJADLO FC(F)C1CC[NH+](Cc2csc(Cl)c2Cl)CC1 ZINC000432754923 338166686 /nfs/dbraw/zinc/16/66/86/338166686.db2.gz PVNKKPROYAWERT-UHFFFAOYSA-N 1 2 300.201 4.532 20 0 DJADLO C[C@H](CC[NH2+][C@H](c1ccccc1)C(F)F)OCc1ccccc1 ZINC000433055711 338178966 /nfs/dbraw/zinc/17/89/66/338178966.db2.gz BKGXNJQQTNJUEU-CRAIPNDOSA-N 1 2 319.395 4.578 20 0 DJADLO CC(F)(F)c1cccc(NCc2cc(-n3cc[nH+]c3)cs2)c1 ZINC000436402942 338271001 /nfs/dbraw/zinc/27/10/01/338271001.db2.gz DCICGDZFGCPBLH-UHFFFAOYSA-N 1 2 319.380 4.658 20 0 DJADLO Oc1cccc2c1CCC[C@H]2Nc1[nH+]ccc2ccc(F)cc21 ZINC000436904052 338292838 /nfs/dbraw/zinc/29/28/38/338292838.db2.gz PMGPKPDJTHPQHM-QGZVFWFLSA-N 1 2 308.356 4.569 20 0 DJADLO CCc1ccc(-c2ccc(C[N@@H+]3CCC[C@@H]3c3ncc[nH]3)o2)cc1 ZINC000437966319 338326792 /nfs/dbraw/zinc/32/67/92/338326792.db2.gz VZMYBSAMXMAAIQ-GOSISDBHSA-N 1 2 321.424 4.569 20 0 DJADLO CCc1ccc(-c2ccc(C[N@H+]3CCC[C@@H]3c3ncc[nH]3)o2)cc1 ZINC000437966319 338326793 /nfs/dbraw/zinc/32/67/93/338326793.db2.gz VZMYBSAMXMAAIQ-GOSISDBHSA-N 1 2 321.424 4.569 20 0 DJADLO Cc1cccc(Cl)c1NCc1c[nH+]cn1Cc1ccccc1 ZINC000438315177 338339304 /nfs/dbraw/zinc/33/93/04/338339304.db2.gz KVYLOAUYLOQFDF-UHFFFAOYSA-N 1 2 311.816 4.505 20 0 DJADLO Fc1cc(-c2ccccc2)ccc1C[N@@H+]1CCc2ncsc2C1 ZINC000438357207 338341104 /nfs/dbraw/zinc/34/11/04/338341104.db2.gz LHEUERWPOXTHNQ-UHFFFAOYSA-N 1 2 324.424 4.508 20 0 DJADLO Fc1cc(-c2ccccc2)ccc1C[N@H+]1CCc2ncsc2C1 ZINC000438357207 338341105 /nfs/dbraw/zinc/34/11/05/338341105.db2.gz LHEUERWPOXTHNQ-UHFFFAOYSA-N 1 2 324.424 4.508 20 0 DJADLO Cc1cnc(C[N@@H+]2CCCC[C@@H]2c2ccccc2C(F)(F)F)o1 ZINC000439806881 338378822 /nfs/dbraw/zinc/37/88/22/338378822.db2.gz SBSJMKFPMUHRKV-OAHLLOKOSA-N 1 2 324.346 4.729 20 0 DJADLO Cc1cnc(C[N@H+]2CCCC[C@@H]2c2ccccc2C(F)(F)F)o1 ZINC000439806881 338378823 /nfs/dbraw/zinc/37/88/23/338378823.db2.gz SBSJMKFPMUHRKV-OAHLLOKOSA-N 1 2 324.346 4.729 20 0 DJADLO CC[C@@H](F)C[N@@H+]1CCC[C@@H]1c1nc(-c2ccc(Cl)cc2)c[nH]1 ZINC000440795296 338397749 /nfs/dbraw/zinc/39/77/49/338397749.db2.gz ICTBYFHEPCFXFT-GDBMZVCRSA-N 1 2 321.827 4.615 20 0 DJADLO CC[C@@H](F)C[N@H+]1CCC[C@@H]1c1nc(-c2ccc(Cl)cc2)c[nH]1 ZINC000440795296 338397750 /nfs/dbraw/zinc/39/77/50/338397750.db2.gz ICTBYFHEPCFXFT-GDBMZVCRSA-N 1 2 321.827 4.615 20 0 DJADLO CCSCc1cc[nH+]c(NC2CCC(C(F)F)CC2)c1 ZINC000442834788 338433959 /nfs/dbraw/zinc/43/39/59/338433959.db2.gz XGYPCMRDUCHQGG-UHFFFAOYSA-N 1 2 300.418 4.571 20 0 DJADLO Cc1ccccc1[C@@H](CC(F)(F)F)[NH2+][C@@H](C)c1nccs1 ZINC000447564839 338557229 /nfs/dbraw/zinc/55/72/29/338557229.db2.gz HMVIYDWCRYMTNB-WCQYABFASA-N 1 2 314.376 4.796 20 0 DJADLO Cc1ccc([C@H](C)Nc2cccc(-c3[nH+]cc4n3CCCC4)c2)o1 ZINC000447570303 338557610 /nfs/dbraw/zinc/55/76/10/338557610.db2.gz SMRCRNMEOCAESR-HNNXBMFYSA-N 1 2 321.424 4.961 20 0 DJADLO CC(C)(C)Oc1cc[nH+]cc1NCc1ncc(C(C)(C)C)s1 ZINC000447899792 338571137 /nfs/dbraw/zinc/57/11/37/338571137.db2.gz WXVZAHTUUFFVNB-UHFFFAOYSA-N 1 2 319.474 4.625 20 0 DJADLO c1cc(N[C@@H]2CCOC3(CCC3)C2)cc([NH+]2CCCCCC2)c1 ZINC000449057182 338588969 /nfs/dbraw/zinc/58/89/69/338588969.db2.gz WIRMNDXCKZUVMW-GOSISDBHSA-N 1 2 314.473 4.581 20 0 DJADLO Fc1cc2c(c(F)c1F)[C@@H]([NH2+]Cc1ccsc1Cl)CC2 ZINC000449584733 338639947 /nfs/dbraw/zinc/63/99/47/338639947.db2.gz JZPRQQZGALLVBS-JTQLQIEISA-N 1 2 317.763 4.596 20 0 DJADLO C[C@H]([NH2+][C@H]1C[C@H](C)n2ccnc21)c1cc(Cl)ccc1Cl ZINC000453078118 338791014 /nfs/dbraw/zinc/79/10/14/338791014.db2.gz BPMQTKGWUCJHID-BHDSKKPTSA-N 1 2 310.228 4.547 20 0 DJADLO Cc1c(COC(C)(C)C)cccc1N[C@@H]1C[C@H](C)n2cc[nH+]c21 ZINC000453165572 338801718 /nfs/dbraw/zinc/80/17/18/338801718.db2.gz MZIMOAOUDCSTSQ-SUMWQHHRSA-N 1 2 313.445 4.625 20 0 DJADLO COc1ccc([C@H]([NH2+][C@H](C)c2ccc(C)o2)c2ccco2)cc1 ZINC000453383698 338835605 /nfs/dbraw/zinc/83/56/05/338835605.db2.gz ADLGDKBOTFSCQN-KUHUBIRLSA-N 1 2 311.381 4.630 20 0 DJADLO CC(C)n1ccnc1C[N@@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC000459583689 339037316 /nfs/dbraw/zinc/03/73/16/339037316.db2.gz TUNQKAKIGPSWSE-LJQANCHMSA-N 1 2 309.457 4.581 20 0 DJADLO CC(C)n1ccnc1C[N@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC000459583689 339037317 /nfs/dbraw/zinc/03/73/17/339037317.db2.gz TUNQKAKIGPSWSE-LJQANCHMSA-N 1 2 309.457 4.581 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1cccc(Cl)c1F)c1nc2c(s1)CCC2 ZINC000459631899 339039462 /nfs/dbraw/zinc/03/94/62/339039462.db2.gz LXXLTSGHUSSJBP-NXEZZACHSA-N 1 2 324.852 4.836 20 0 DJADLO CCC[C@@H](C)C(=O)Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000498181653 339061699 /nfs/dbraw/zinc/06/16/99/339061699.db2.gz IAAJOPKPTIWJEF-GFCCVEGCSA-N 1 2 318.804 4.902 20 0 DJADLO Cc1nc(N[C@H](c2cccc(C(F)(F)F)c2)C(C)C)cc[nH+]1 ZINC000462802945 339089859 /nfs/dbraw/zinc/08/98/59/339089859.db2.gz OOTALGJOQNLKIO-HNNXBMFYSA-N 1 2 309.335 4.613 20 0 DJADLO Cc1nc([C@H](C)[NH2+][C@@H](c2ccc(F)cc2F)C(C)C)cs1 ZINC000462806433 339090268 /nfs/dbraw/zinc/09/02/68/339090268.db2.gz PJUOZGCRQYZBEE-MGPLVRAMSA-N 1 2 310.413 4.778 20 0 DJADLO COc1cccc([C@@H](Nc2cccc[nH+]2)c2ccccc2Cl)c1 ZINC000462895654 339096673 /nfs/dbraw/zinc/09/66/73/339096673.db2.gz RHTZHSNAUZCVAQ-LJQANCHMSA-N 1 2 324.811 4.945 20 0 DJADLO Fc1ccccc1C1C[NH+](Cc2nc(-c3ccccc3)cs2)C1 ZINC000463032421 339101948 /nfs/dbraw/zinc/10/19/48/339101948.db2.gz GVFYLKMZPZYNRV-UHFFFAOYSA-N 1 2 324.424 4.549 20 0 DJADLO Cc1cc(C[N@H+](Cc2ccccc2)[C@@H](C)c2ccccc2)no1 ZINC000463219204 339110139 /nfs/dbraw/zinc/11/01/39/339110139.db2.gz ARXWAIIMBITUSS-KRWDZBQOSA-N 1 2 306.409 4.746 20 0 DJADLO Cc1cc(C[N@@H+](Cc2ccccc2)[C@@H](C)c2ccccc2)no1 ZINC000463219204 339110140 /nfs/dbraw/zinc/11/01/40/339110140.db2.gz ARXWAIIMBITUSS-KRWDZBQOSA-N 1 2 306.409 4.746 20 0 DJADLO C[C@H]1C[C@H]1CC(=O)Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000463605012 339122681 /nfs/dbraw/zinc/12/26/81/339122681.db2.gz UVZTWWOAUQCJGG-RYUDHWBXSA-N 1 2 316.788 4.512 20 0 DJADLO CC(C)c1nc(C[N@@H+]2C[C@@H](C)C[C@H]2c2ccccc2F)cs1 ZINC000464731970 339150287 /nfs/dbraw/zinc/15/02/87/339150287.db2.gz HRDZZARPJFGSCJ-GUYCJALGSA-N 1 2 318.461 4.989 20 0 DJADLO CC(C)c1nc(C[N@H+]2C[C@@H](C)C[C@H]2c2ccccc2F)cs1 ZINC000464731970 339150288 /nfs/dbraw/zinc/15/02/88/339150288.db2.gz HRDZZARPJFGSCJ-GUYCJALGSA-N 1 2 318.461 4.989 20 0 DJADLO C[C@H]1C[C@@H](c2ccccc2F)[N@H+](Cc2ncc(C(C)(C)C)o2)C1 ZINC000464727973 339150296 /nfs/dbraw/zinc/15/02/96/339150296.db2.gz BYWOSWDGOZNPBC-BBRMVZONSA-N 1 2 316.420 4.694 20 0 DJADLO C[C@H]1C[C@@H](c2ccccc2F)[N@@H+](Cc2ncc(C(C)(C)C)o2)C1 ZINC000464727973 339150297 /nfs/dbraw/zinc/15/02/97/339150297.db2.gz BYWOSWDGOZNPBC-BBRMVZONSA-N 1 2 316.420 4.694 20 0 DJADLO FC(F)(F)C1CC[NH+](Cc2cc(Cl)ccc2Cl)CC1 ZINC000464767056 339151724 /nfs/dbraw/zinc/15/17/24/339151724.db2.gz BYWICGGCDGPIJX-UHFFFAOYSA-N 1 2 312.162 4.768 20 0 DJADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2ccn(C(C)C)n2)o1 ZINC000464851671 339157868 /nfs/dbraw/zinc/15/78/68/339157868.db2.gz QLEGFLAPYOERFW-YJBOKZPZSA-N 1 2 315.461 4.593 20 0 DJADLO CCc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2ccn(C(C)C)n2)o1 ZINC000464851671 339157869 /nfs/dbraw/zinc/15/78/69/339157869.db2.gz QLEGFLAPYOERFW-YJBOKZPZSA-N 1 2 315.461 4.593 20 0 DJADLO CC[N@H+](Cc1nc2cc(F)ccc2o1)Cc1ccccc1Cl ZINC000464869466 339159370 /nfs/dbraw/zinc/15/93/70/339159370.db2.gz PFIRVMJQGNHTHN-UHFFFAOYSA-N 1 2 318.779 4.642 20 0 DJADLO CC[N@@H+](Cc1nc2cc(F)ccc2o1)Cc1ccccc1Cl ZINC000464869466 339159371 /nfs/dbraw/zinc/15/93/71/339159371.db2.gz PFIRVMJQGNHTHN-UHFFFAOYSA-N 1 2 318.779 4.642 20 0 DJADLO c1ccc(-c2ccc[nH+]c2NCc2cccc3cccnc32)cc1 ZINC000466637886 339211479 /nfs/dbraw/zinc/21/14/79/339211479.db2.gz RJOQOGBFIRNUSZ-UHFFFAOYSA-N 1 2 311.388 4.909 20 0 DJADLO CC[N@H+](Cc1nc2ccc(F)cc2o1)Cc1ccccc1Cl ZINC000466805878 339217411 /nfs/dbraw/zinc/21/74/11/339217411.db2.gz JYMBUBQXKHMTIK-UHFFFAOYSA-N 1 2 318.779 4.642 20 0 DJADLO CC[N@@H+](Cc1nc2ccc(F)cc2o1)Cc1ccccc1Cl ZINC000466805878 339217412 /nfs/dbraw/zinc/21/74/12/339217412.db2.gz JYMBUBQXKHMTIK-UHFFFAOYSA-N 1 2 318.779 4.642 20 0 DJADLO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(F)cc2Cl)o1 ZINC000467019417 339224695 /nfs/dbraw/zinc/22/46/95/339224695.db2.gz YDRXEFFMHJHXLN-INIZCTEOSA-N 1 2 323.795 4.556 20 0 DJADLO COCc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(F)cc2Cl)o1 ZINC000467019417 339224696 /nfs/dbraw/zinc/22/46/96/339224696.db2.gz YDRXEFFMHJHXLN-INIZCTEOSA-N 1 2 323.795 4.556 20 0 DJADLO C(=C/c1ccccc1)\CSCc1[nH+]ccn1Cc1ccccc1 ZINC000467222579 339228768 /nfs/dbraw/zinc/22/87/68/339228768.db2.gz AFDHLJGLKFENBS-KPKJPENVSA-N 1 2 320.461 4.878 20 0 DJADLO C[C@H]([NH2+]Cc1nc2ccc(F)cc2o1)c1cc2ccccc2o1 ZINC000467274773 339229613 /nfs/dbraw/zinc/22/96/13/339229613.db2.gz ITYXPERBKWPZOX-NSHDSACASA-N 1 2 310.328 4.564 20 0 DJADLO COCCc1ccccc1N[C@@H]1CCC[C@H](c2[nH+]cccc2C)C1 ZINC000467360689 339234038 /nfs/dbraw/zinc/23/40/38/339234038.db2.gz ZFCJZEDFQFQIRW-RBUKOAKNSA-N 1 2 324.468 4.717 20 0 DJADLO COc1cc(N[C@@H]2CCC[C@@H](c3[nH+]cccc3C)C2)ccc1F ZINC000467368375 339234496 /nfs/dbraw/zinc/23/44/96/339234496.db2.gz VDHAKVSDSCKHQS-HUUCEWRRSA-N 1 2 314.404 4.676 20 0 DJADLO COCc1cccc(N[C@@H]2CCC[C@H](c3[nH+]cccc3C)C2)c1 ZINC000467374640 339235117 /nfs/dbraw/zinc/23/51/17/339235117.db2.gz ZFZQCTLNODOGGD-PKOBYXMFSA-N 1 2 310.441 4.675 20 0 DJADLO C[N@H+](Cc1csnn1)[C@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000467514368 339240700 /nfs/dbraw/zinc/24/07/00/339240700.db2.gz RIKUZMBZTNJUCE-INIZCTEOSA-N 1 2 321.877 4.555 20 0 DJADLO C[N@@H+](Cc1csnn1)[C@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000467514368 339240701 /nfs/dbraw/zinc/24/07/01/339240701.db2.gz RIKUZMBZTNJUCE-INIZCTEOSA-N 1 2 321.877 4.555 20 0 DJADLO C[N@H+](Cc1csnn1)[C@@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000467514369 339240712 /nfs/dbraw/zinc/24/07/12/339240712.db2.gz RIKUZMBZTNJUCE-MRXNPFEDSA-N 1 2 321.877 4.555 20 0 DJADLO C[N@@H+](Cc1csnn1)[C@@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000467514369 339240713 /nfs/dbraw/zinc/24/07/13/339240713.db2.gz RIKUZMBZTNJUCE-MRXNPFEDSA-N 1 2 321.877 4.555 20 0 DJADLO C[C@H](c1ccccc1Cl)[N@H+](Cc1cncc(F)c1)C1CC1 ZINC000468490974 339264094 /nfs/dbraw/zinc/26/40/94/339264094.db2.gz CETUKQCGKLXYFE-GFCCVEGCSA-N 1 2 304.796 4.600 20 0 DJADLO C[C@H](c1ccccc1Cl)[N@@H+](Cc1cncc(F)c1)C1CC1 ZINC000468490974 339264095 /nfs/dbraw/zinc/26/40/95/339264095.db2.gz CETUKQCGKLXYFE-GFCCVEGCSA-N 1 2 304.796 4.600 20 0 DJADLO C[C@@H]1CC[C@@H](CC(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000468842337 339272476 /nfs/dbraw/zinc/27/24/76/339272476.db2.gz GRFQHGIOWVZYRB-HUUCEWRRSA-N 1 2 310.397 4.639 20 0 DJADLO CC[C@H]([NH2+]C1CCC(c2ccc(OC)cc2)CC1)C(F)(F)F ZINC000469153267 339281516 /nfs/dbraw/zinc/28/15/16/339281516.db2.gz XYGMYSLRTBUFBX-PXCJXSSVSA-N 1 2 315.379 4.652 20 0 DJADLO Cc1cnc([C@H](C)[NH+]2CCC(=Cc3ccc(F)c(F)c3)CC2)o1 ZINC000469445657 339289476 /nfs/dbraw/zinc/28/94/76/339289476.db2.gz FLDXEJULVHFQHJ-ZDUSSCGKSA-N 1 2 318.367 4.502 20 0 DJADLO C[C@@H]([NH2+]Cc1ccc(F)cn1)c1cc(F)c(Cl)cc1Cl ZINC000469759473 339297846 /nfs/dbraw/zinc/29/78/46/339297846.db2.gz ZMDQQXWLUFBKKE-MRVPVSSYSA-N 1 2 317.166 4.517 20 0 DJADLO Cc1ccc2c(c1C)OC[C@@H]2[NH2+][C@H](C)c1csc(C(C)C)n1 ZINC000469789388 339300118 /nfs/dbraw/zinc/30/01/18/339300118.db2.gz YIWNKTOQVFJLAE-HIFRSBDPSA-N 1 2 316.470 4.668 20 0 DJADLO C[C@@H]1C[N@H+](Cc2cccc(C(F)F)c2)C[C@H](c2ccsc2)O1 ZINC000470782448 339327864 /nfs/dbraw/zinc/32/78/64/339327864.db2.gz WJTBUWPJQJLVIY-MLGOLLRUSA-N 1 2 323.408 4.648 20 0 DJADLO C[C@@H]1C[N@@H+](Cc2cccc(C(F)F)c2)C[C@H](c2ccsc2)O1 ZINC000470782448 339327865 /nfs/dbraw/zinc/32/78/65/339327865.db2.gz WJTBUWPJQJLVIY-MLGOLLRUSA-N 1 2 323.408 4.648 20 0 DJADLO C[C@@H]1C[N@H+](Cc2cccc(C(F)F)c2)C[C@@H](c2ccsc2)O1 ZINC000470782449 339327957 /nfs/dbraw/zinc/32/79/57/339327957.db2.gz WJTBUWPJQJLVIY-WBMJQRKESA-N 1 2 323.408 4.648 20 0 DJADLO C[C@@H]1C[N@@H+](Cc2cccc(C(F)F)c2)C[C@@H](c2ccsc2)O1 ZINC000470782449 339327958 /nfs/dbraw/zinc/32/79/58/339327958.db2.gz WJTBUWPJQJLVIY-WBMJQRKESA-N 1 2 323.408 4.648 20 0 DJADLO CC(C)CCc1nc(C[N@@H+]2CC[C@H](C(F)(F)F)[C@@H]2C)cs1 ZINC000470960383 339333110 /nfs/dbraw/zinc/33/31/10/339333110.db2.gz RTKSSGAAEVVPGO-AAEUAGOBSA-N 1 2 320.424 4.504 20 0 DJADLO CC(C)CCc1nc(C[N@H+]2CC[C@H](C(F)(F)F)[C@@H]2C)cs1 ZINC000470960383 339333111 /nfs/dbraw/zinc/33/31/11/339333111.db2.gz RTKSSGAAEVVPGO-AAEUAGOBSA-N 1 2 320.424 4.504 20 0 DJADLO CSc1ccccc1C[N@H+](C)[C@@H](C)c1ncc(C(C)(C)C)o1 ZINC000471003622 339334208 /nfs/dbraw/zinc/33/42/08/339334208.db2.gz FSDVFLDQPVZRFD-ZDUSSCGKSA-N 1 2 318.486 4.887 20 0 DJADLO CSc1ccccc1C[N@@H+](C)[C@@H](C)c1ncc(C(C)(C)C)o1 ZINC000471003622 339334209 /nfs/dbraw/zinc/33/42/09/339334209.db2.gz FSDVFLDQPVZRFD-ZDUSSCGKSA-N 1 2 318.486 4.887 20 0 DJADLO CSc1ccccc1C[N@H+](C)Cc1ncc(-c2ccccc2)o1 ZINC000471002243 339334212 /nfs/dbraw/zinc/33/42/12/339334212.db2.gz XOXZZNPUWXAGAS-UHFFFAOYSA-N 1 2 324.449 4.696 20 0 DJADLO CSc1ccccc1C[N@@H+](C)Cc1ncc(-c2ccccc2)o1 ZINC000471002243 339334213 /nfs/dbraw/zinc/33/42/13/339334213.db2.gz XOXZZNPUWXAGAS-UHFFFAOYSA-N 1 2 324.449 4.696 20 0 DJADLO Fc1ccccc1-c1nc(C[N@@H+]2CC[C@@H]2c2ccccc2)cs1 ZINC000471167536 339339262 /nfs/dbraw/zinc/33/92/62/339339262.db2.gz CSKTZILVWLZUPT-GOSISDBHSA-N 1 2 324.424 4.896 20 0 DJADLO Fc1ccccc1-c1nc(C[N@H+]2CC[C@@H]2c2ccccc2)cs1 ZINC000471167536 339339263 /nfs/dbraw/zinc/33/92/63/339339263.db2.gz CSKTZILVWLZUPT-GOSISDBHSA-N 1 2 324.424 4.896 20 0 DJADLO c1cc(-c2nc(C[N@@H+]3CC[C@H]3c3ccccc3)cs2)cs1 ZINC000471172122 339339445 /nfs/dbraw/zinc/33/94/45/339339445.db2.gz DHMBHQVMEVUSHX-INIZCTEOSA-N 1 2 312.463 4.819 20 0 DJADLO c1cc(-c2nc(C[N@H+]3CC[C@H]3c3ccccc3)cs2)cs1 ZINC000471172122 339339446 /nfs/dbraw/zinc/33/94/46/339339446.db2.gz DHMBHQVMEVUSHX-INIZCTEOSA-N 1 2 312.463 4.819 20 0 DJADLO Cc1ccc(-c2nc(C[N@@H+]3CC[C@H]3c3ccccc3)cs2)o1 ZINC000471180741 339339738 /nfs/dbraw/zinc/33/97/38/339339738.db2.gz HZTMAJJZDDRPGW-INIZCTEOSA-N 1 2 310.422 4.659 20 0 DJADLO Cc1ccc(-c2nc(C[N@H+]3CC[C@H]3c3ccccc3)cs2)o1 ZINC000471180741 339339739 /nfs/dbraw/zinc/33/97/39/339339739.db2.gz HZTMAJJZDDRPGW-INIZCTEOSA-N 1 2 310.422 4.659 20 0 DJADLO CC(C)[C@H]([NH2+]Cc1ncc(Cl)s1)c1ccccc1Cl ZINC000472040590 339360309 /nfs/dbraw/zinc/36/03/09/339360309.db2.gz GMLFGCGRIZLIJW-AWEZNQCLSA-N 1 2 315.269 4.937 20 0 DJADLO Clc1cnc(C[N@H+](C2CC2)[C@H]2CCCc3ccccc32)s1 ZINC000473138660 339382103 /nfs/dbraw/zinc/38/21/03/339382103.db2.gz MXZSNYZQZFIVRK-HNNXBMFYSA-N 1 2 318.873 4.839 20 0 DJADLO Clc1cnc(C[N@@H+](C2CC2)[C@H]2CCCc3ccccc32)s1 ZINC000473138660 339382104 /nfs/dbraw/zinc/38/21/04/339382104.db2.gz MXZSNYZQZFIVRK-HNNXBMFYSA-N 1 2 318.873 4.839 20 0 DJADLO CCc1ccc(C[N@H+](Cc2ncc(Cl)s2)C2CC2)cc1 ZINC000473142276 339382434 /nfs/dbraw/zinc/38/24/34/339382434.db2.gz BUMFYXBHJKIYAZ-UHFFFAOYSA-N 1 2 306.862 4.524 20 0 DJADLO CCc1ccc(C[N@@H+](Cc2ncc(Cl)s2)C2CC2)cc1 ZINC000473142276 339382435 /nfs/dbraw/zinc/38/24/35/339382435.db2.gz BUMFYXBHJKIYAZ-UHFFFAOYSA-N 1 2 306.862 4.524 20 0 DJADLO CCOc1ccc([C@@H]2CCC[N@@H+]2Cc2ncc(Cl)s2)cc1 ZINC000473143374 339382663 /nfs/dbraw/zinc/38/26/63/339382663.db2.gz MNCPNPJUBGRMQK-AWEZNQCLSA-N 1 2 322.861 4.532 20 0 DJADLO CCOc1ccc([C@@H]2CCC[N@H+]2Cc2ncc(Cl)s2)cc1 ZINC000473143374 339382664 /nfs/dbraw/zinc/38/26/64/339382664.db2.gz MNCPNPJUBGRMQK-AWEZNQCLSA-N 1 2 322.861 4.532 20 0 DJADLO Cc1nc(C[NH2+]C(C)(C)c2cccc(Cl)c2F)c(C)s1 ZINC000473456711 339385684 /nfs/dbraw/zinc/38/56/84/339385684.db2.gz XIJCLVWEGRARKC-UHFFFAOYSA-N 1 2 312.841 4.577 20 0 DJADLO C[C@H](Nc1ccc(-n2cc[nH+]c2)c(F)c1)C1CCC(F)(F)CC1 ZINC000474069635 339400541 /nfs/dbraw/zinc/40/05/41/339400541.db2.gz YCHJZUJAVLWQJA-LBPRGKRZSA-N 1 2 323.362 4.637 20 0 DJADLO CCCOc1cccc2c(N[C@@H](C)c3ccccn3)cc[nH+]c12 ZINC000478241449 339511202 /nfs/dbraw/zinc/51/12/02/339511202.db2.gz VXBSFFYAIZJIFW-AWEZNQCLSA-N 1 2 307.397 4.592 20 0 DJADLO Cc1csc(C2([NH2+][C@H](C)c3cccc(Cl)c3F)CCC2)n1 ZINC000478408322 339514903 /nfs/dbraw/zinc/51/49/03/339514903.db2.gz TVRUESRGRAMKQM-LLVKDONJSA-N 1 2 324.852 4.974 20 0 DJADLO Cc1ccc(CSc2ncc(-c3ccc(F)cc3)o2)c(C)[nH+]1 ZINC000479203164 339529091 /nfs/dbraw/zinc/52/90/91/339529091.db2.gz GDSOQEXGJZJBNB-UHFFFAOYSA-N 1 2 314.385 4.785 20 0 DJADLO C[C@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1ccc(Cl)cn1 ZINC000480187078 339562701 /nfs/dbraw/zinc/56/27/01/339562701.db2.gz ZHAZLDMSPYEXIJ-LIRRHRJNSA-N 1 2 323.827 4.570 20 0 DJADLO Clc1sccc1C[NH2+]Cc1csc(-c2ccccc2)n1 ZINC000480249690 339565198 /nfs/dbraw/zinc/56/51/98/339565198.db2.gz GNOVDGPVRPCKNZ-UHFFFAOYSA-N 1 2 320.870 4.815 20 0 DJADLO Fc1ccc(C2([NH2+]Cc3ccsc3Cl)CCC2)c(F)c1 ZINC000480249023 339565245 /nfs/dbraw/zinc/56/52/45/339565245.db2.gz CTZDPSYXHVPNKH-UHFFFAOYSA-N 1 2 313.800 4.849 20 0 DJADLO Cc1ccc(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)cc1F ZINC000482884180 339645749 /nfs/dbraw/zinc/64/57/49/339645749.db2.gz UWLIHQKEKCYJGL-UHFFFAOYSA-N 1 2 322.339 4.574 20 0 DJADLO CCC[C@H](CC)NC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000485354458 339701863 /nfs/dbraw/zinc/70/18/63/339701863.db2.gz GHTBYOUJLXKABN-AWEZNQCLSA-N 1 2 313.401 4.574 20 0 DJADLO Cc1ccc([C@H](C)N(C)C(=O)Nc2c(C)cc[nH+]c2C)c(C)c1 ZINC000485450302 339703522 /nfs/dbraw/zinc/70/35/22/339703522.db2.gz ICEZYRASXYKRHW-INIZCTEOSA-N 1 2 311.429 4.540 20 0 DJADLO CCCCCOc1ccc(C(=O)Nc2c(C)cc[nH+]c2C)cc1 ZINC000485488181 339704377 /nfs/dbraw/zinc/70/43/77/339704377.db2.gz IGQDPHAHOWZBNW-UHFFFAOYSA-N 1 2 312.413 4.520 20 0 DJADLO Cc1ccc(C(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)c(F)c1 ZINC000486872662 339736838 /nfs/dbraw/zinc/73/68/38/339736838.db2.gz JLGWBPCGARCXKK-UHFFFAOYSA-N 1 2 322.339 4.574 20 0 DJADLO c1cc(N2CCCC2)[nH+]cc1CNc1ccc(C2CCC2)cc1 ZINC000487215974 339746617 /nfs/dbraw/zinc/74/66/17/339746617.db2.gz NQANTGXKMWUWSD-UHFFFAOYSA-N 1 2 307.441 4.561 20 0 DJADLO CC1CCC(C)(NC(=O)c2cccc(Oc3cc[nH+]cc3)c2)CC1 ZINC000496427748 340005265 /nfs/dbraw/zinc/00/52/65/340005265.db2.gz JHVDVOHSQSETFC-UHFFFAOYSA-N 1 2 324.424 4.573 20 0 DJADLO Cc1cc([C@H](C)[NH2+]Cc2ccc(Sc3ccccc3)cc2)no1 ZINC000500568097 340062599 /nfs/dbraw/zinc/06/25/99/340062599.db2.gz GBEUQVGCONYXQO-HNNXBMFYSA-N 1 2 324.449 4.985 20 0 DJADLO Cc1cccc2[nH+]c(CSc3ccc(F)c(Cl)c3)cn21 ZINC000502005235 340092601 /nfs/dbraw/zinc/09/26/01/340092601.db2.gz NBWWOIVIYDKGKK-UHFFFAOYSA-N 1 2 306.793 4.728 20 0 DJADLO CC[C@@H]1C[C@@]1([NH2+]Cc1ncc(C(C)(C)C)o1)c1cccc(C)c1 ZINC000502483809 340105670 /nfs/dbraw/zinc/10/56/70/340105670.db2.gz KNYRCSGVZSXZKH-QRWLVFNGSA-N 1 2 312.457 4.696 20 0 DJADLO CCCCc1noc([C@H](C)[NH2+][C@H](c2ccc(F)cc2)C(C)C)n1 ZINC000502543084 340107292 /nfs/dbraw/zinc/10/72/92/340107292.db2.gz PBVNUGIAYMXLGU-GUYCJALGSA-N 1 2 319.424 4.599 20 0 DJADLO CCCCc1noc([C@H](C)[NH2+][C@@H](c2ccc(F)cc2)C(C)C)n1 ZINC000502543085 340107377 /nfs/dbraw/zinc/10/73/77/340107377.db2.gz PBVNUGIAYMXLGU-SUMWQHHRSA-N 1 2 319.424 4.599 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1cnn(C2CCCC2)c1 ZINC000502696782 340111148 /nfs/dbraw/zinc/11/11/48/340111148.db2.gz FZZACTUUULBPRA-OLZOCXBDSA-N 1 2 319.399 4.688 20 0 DJADLO C[C@@H]1C[C@]1([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccc(Cl)cc1 ZINC000503413023 340127692 /nfs/dbraw/zinc/12/76/92/340127692.db2.gz QYYWXJQWBPUISS-KZULUSFZSA-N 1 2 318.848 4.650 20 0 DJADLO C[C@H]1C[C@@]1([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccc(Cl)cc1 ZINC000503413024 340127695 /nfs/dbraw/zinc/12/76/95/340127695.db2.gz QYYWXJQWBPUISS-SGTLLEGYSA-N 1 2 318.848 4.650 20 0 DJADLO Fc1ccc(C[NH2+]Cc2ccc(Oc3ccccc3)o2)c(F)c1 ZINC000503602404 340132303 /nfs/dbraw/zinc/13/23/03/340132303.db2.gz LWCNWIMTOMVXQT-UHFFFAOYSA-N 1 2 315.319 4.640 20 0 DJADLO CC[C@@H](C)C(=O)Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000504744921 340151882 /nfs/dbraw/zinc/15/18/82/340151882.db2.gz HNEWZXFNYNDCCS-LLVKDONJSA-N 1 2 304.777 4.512 20 0 DJADLO Fc1cc(C[N@@H+]2CCCCC[C@@H]2c2ccncc2)cc(F)c1F ZINC000505252887 340164870 /nfs/dbraw/zinc/16/48/70/340164870.db2.gz AKYYOANKHZGDCD-QGZVFWFLSA-N 1 2 320.358 4.616 20 0 DJADLO Fc1cc(C[N@H+]2CCCCC[C@@H]2c2ccncc2)cc(F)c1F ZINC000505252887 340164871 /nfs/dbraw/zinc/16/48/71/340164871.db2.gz AKYYOANKHZGDCD-QGZVFWFLSA-N 1 2 320.358 4.616 20 0 DJADLO C[N@H+](Cc1cnc(-c2ccsc2)s1)Cc1ccccc1F ZINC000505610731 340172898 /nfs/dbraw/zinc/17/28/98/340172898.db2.gz OTTXZOOCUPAJPP-UHFFFAOYSA-N 1 2 318.442 4.643 20 0 DJADLO C[N@@H+](Cc1cnc(-c2ccsc2)s1)Cc1ccccc1F ZINC000505610731 340172899 /nfs/dbraw/zinc/17/28/99/340172899.db2.gz OTTXZOOCUPAJPP-UHFFFAOYSA-N 1 2 318.442 4.643 20 0 DJADLO C[N@H+](Cc1cnc(-c2cccs2)s1)Cc1ccccc1F ZINC000505610721 340172991 /nfs/dbraw/zinc/17/29/91/340172991.db2.gz KPIFEZSGGZBOOI-UHFFFAOYSA-N 1 2 318.442 4.643 20 0 DJADLO C[N@@H+](Cc1cnc(-c2cccs2)s1)Cc1ccccc1F ZINC000505610721 340172992 /nfs/dbraw/zinc/17/29/92/340172992.db2.gz KPIFEZSGGZBOOI-UHFFFAOYSA-N 1 2 318.442 4.643 20 0 DJADLO CC[N@H+](Cc1ccc(Cl)s1)Cc1ncc(C(C)(C)C)o1 ZINC000506103086 340185837 /nfs/dbraw/zinc/18/58/37/340185837.db2.gz QBNBDOHADHTVGX-UHFFFAOYSA-N 1 2 312.866 4.709 20 0 DJADLO CC[N@@H+](Cc1ccc(Cl)s1)Cc1ncc(C(C)(C)C)o1 ZINC000506103086 340185838 /nfs/dbraw/zinc/18/58/38/340185838.db2.gz QBNBDOHADHTVGX-UHFFFAOYSA-N 1 2 312.866 4.709 20 0 DJADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2ncccc2C(F)(F)F)cc1 ZINC000506634372 340198128 /nfs/dbraw/zinc/19/81/28/340198128.db2.gz SBSSKYMZXNUFHX-INIZCTEOSA-N 1 2 324.321 4.577 20 0 DJADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2ncccc2C(F)(F)F)cc1 ZINC000506634372 340198129 /nfs/dbraw/zinc/19/81/29/340198129.db2.gz SBSSKYMZXNUFHX-INIZCTEOSA-N 1 2 324.321 4.577 20 0 DJADLO CCc1nc(C[N@H+](C)Cc2ccc(Cl)c(Cl)c2)cs1 ZINC000506751830 340201045 /nfs/dbraw/zinc/20/10/45/340201045.db2.gz JYKYATTWDAOIPD-UHFFFAOYSA-N 1 2 315.269 4.644 20 0 DJADLO CCc1nc(C[N@@H+](C)Cc2ccc(Cl)c(Cl)c2)cs1 ZINC000506751830 340201046 /nfs/dbraw/zinc/20/10/46/340201046.db2.gz JYKYATTWDAOIPD-UHFFFAOYSA-N 1 2 315.269 4.644 20 0 DJADLO CCn1cc(C[N@@H+]2CCC[C@H]2c2ccc(Cl)c(Cl)c2)cn1 ZINC000507133502 340208907 /nfs/dbraw/zinc/20/89/07/340208907.db2.gz ZLHDBODTKVKFDL-INIZCTEOSA-N 1 2 324.255 4.547 20 0 DJADLO CCn1cc(C[N@H+]2CCC[C@H]2c2ccc(Cl)c(Cl)c2)cn1 ZINC000507133502 340208908 /nfs/dbraw/zinc/20/89/08/340208908.db2.gz ZLHDBODTKVKFDL-INIZCTEOSA-N 1 2 324.255 4.547 20 0 DJADLO Fc1cccc([C@@H]2CCC[N@@H+]2Cc2cnc(-c3ccccc3)[nH]2)c1 ZINC000507186452 340211671 /nfs/dbraw/zinc/21/16/71/340211671.db2.gz DUVHYLVWCOYPQL-IBGZPJMESA-N 1 2 321.399 4.553 20 0 DJADLO Fc1cccc([C@@H]2CCC[N@H+]2Cc2cnc(-c3ccccc3)[nH]2)c1 ZINC000507186452 340211672 /nfs/dbraw/zinc/21/16/72/340211672.db2.gz DUVHYLVWCOYPQL-IBGZPJMESA-N 1 2 321.399 4.553 20 0 DJADLO C[C@H](c1ccco1)[N@H+](C)Cc1cc(C(F)(F)F)ccc1F ZINC000507210245 340213579 /nfs/dbraw/zinc/21/35/79/340213579.db2.gz KCCPOSQXIIHHLP-SNVBAGLBSA-N 1 2 301.283 4.631 20 0 DJADLO C[C@H](c1ccco1)[N@@H+](C)Cc1cc(C(F)(F)F)ccc1F ZINC000507210245 340213580 /nfs/dbraw/zinc/21/35/80/340213580.db2.gz KCCPOSQXIIHHLP-SNVBAGLBSA-N 1 2 301.283 4.631 20 0 DJADLO C[C@@H]([NH2+][C@H]1CCc2c1c(F)ccc2F)c1c(F)cccc1F ZINC000507850438 340234080 /nfs/dbraw/zinc/23/40/80/340234080.db2.gz GYVKBGGOVPYKLG-PSLIRLAXSA-N 1 2 309.306 4.581 20 0 DJADLO C[C@@H](c1ccccc1F)[N@@H+]1CCO[C@@H](c2ccccc2Cl)C1 ZINC000507860198 340234399 /nfs/dbraw/zinc/23/43/99/340234399.db2.gz ONEMIULQEMUXBJ-SCLBCKFNSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@@H](c1ccccc1F)[N@H+]1CCO[C@@H](c2ccccc2Cl)C1 ZINC000507860198 340234400 /nfs/dbraw/zinc/23/44/00/340234400.db2.gz ONEMIULQEMUXBJ-SCLBCKFNSA-N 1 2 319.807 4.614 20 0 DJADLO CCC[N@H+](Cc1scnc1C)Cc1c(F)cccc1Cl ZINC000508623835 340248645 /nfs/dbraw/zinc/24/86/45/340248645.db2.gz CETLLNRZPAONQB-UHFFFAOYSA-N 1 2 312.841 4.656 20 0 DJADLO CCC[N@@H+](Cc1scnc1C)Cc1c(F)cccc1Cl ZINC000508623835 340248646 /nfs/dbraw/zinc/24/86/46/340248646.db2.gz CETLLNRZPAONQB-UHFFFAOYSA-N 1 2 312.841 4.656 20 0 DJADLO Cc1ccc([C@@H](C)[NH2+]Cc2nc(-c3ccc(C)cc3)cs2)o1 ZINC000508992533 340257527 /nfs/dbraw/zinc/25/75/27/340257527.db2.gz VOGBOXUKNWJOQT-CQSZACIVSA-N 1 2 312.438 4.871 20 0 DJADLO CCc1cccc(NC(=O)c2ccccc2Oc2cc[nH+]cc2)c1 ZINC000509009840 340258087 /nfs/dbraw/zinc/25/80/87/340258087.db2.gz BTFFAWXDCKTZOE-UHFFFAOYSA-N 1 2 318.376 4.689 20 0 DJADLO C[N@H+](Cc1csc(C(C)(C)C)n1)Cc1cccc(Cl)c1 ZINC000509056094 340259818 /nfs/dbraw/zinc/25/98/18/340259818.db2.gz HTYNWFOOLZHGTI-UHFFFAOYSA-N 1 2 308.878 4.726 20 0 DJADLO C[N@@H+](Cc1csc(C(C)(C)C)n1)Cc1cccc(Cl)c1 ZINC000509056094 340259819 /nfs/dbraw/zinc/25/98/19/340259819.db2.gz HTYNWFOOLZHGTI-UHFFFAOYSA-N 1 2 308.878 4.726 20 0 DJADLO Cc1cc(NC(=O)c2ccccc2Oc2cc[nH+]cc2)ccc1F ZINC000509531482 340272507 /nfs/dbraw/zinc/27/25/07/340272507.db2.gz DHNOEGQFFXOKCQ-UHFFFAOYSA-N 1 2 322.339 4.574 20 0 DJADLO Cc1cc([C@H]2CCC[N@@H+]2Cc2cccc(Cl)c2Cl)on1 ZINC000509828330 340280790 /nfs/dbraw/zinc/28/07/90/340280790.db2.gz TUMHVUCJLLOWTR-CYBMUJFWSA-N 1 2 311.212 4.627 20 0 DJADLO Cc1cc([C@H]2CCC[N@H+]2Cc2cccc(Cl)c2Cl)on1 ZINC000509828330 340280791 /nfs/dbraw/zinc/28/07/91/340280791.db2.gz TUMHVUCJLLOWTR-CYBMUJFWSA-N 1 2 311.212 4.627 20 0 DJADLO c1c(CNc2ccc3c(c2)Cc2ccccc2-3)[nH+]c2ccccn12 ZINC000302754808 340281326 /nfs/dbraw/zinc/28/13/26/340281326.db2.gz PGGNFCDZNZBDPU-UHFFFAOYSA-N 1 2 311.388 4.518 20 0 DJADLO C[C@H](CC(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1)C1CCCCC1 ZINC000303194070 340311511 /nfs/dbraw/zinc/31/15/11/340311511.db2.gz ZUIXAEOVOXWBRP-CQSZACIVSA-N 1 2 311.429 4.622 20 0 DJADLO c1ccc(-c2noc(-c3ccccc3Oc3cc[nH+]cc3)n2)cc1 ZINC000511182805 340323456 /nfs/dbraw/zinc/32/34/56/340323456.db2.gz BGVGFOWWXQMRNU-UHFFFAOYSA-N 1 2 315.332 4.591 20 0 DJADLO C[C@@H](c1nc2ccccc2o1)[N@@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000511546257 340330237 /nfs/dbraw/zinc/33/02/37/340330237.db2.gz PHYFUNDXMKIXFL-LRDDRELGSA-N 1 2 312.800 4.989 20 0 DJADLO C[C@@H](c1nc2ccccc2o1)[N@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000511546257 340330238 /nfs/dbraw/zinc/33/02/38/340330238.db2.gz PHYFUNDXMKIXFL-LRDDRELGSA-N 1 2 312.800 4.989 20 0 DJADLO Clc1ccc([C@@H]2CC[N@@H+]2Cc2coc(-c3ccccc3)n2)cc1 ZINC000511575408 340331038 /nfs/dbraw/zinc/33/10/38/340331038.db2.gz MVQIHPHWXAQHBX-SFHVURJKSA-N 1 2 324.811 4.942 20 0 DJADLO Clc1ccc([C@@H]2CC[N@H+]2Cc2coc(-c3ccccc3)n2)cc1 ZINC000511575408 340331039 /nfs/dbraw/zinc/33/10/39/340331039.db2.gz MVQIHPHWXAQHBX-SFHVURJKSA-N 1 2 324.811 4.942 20 0 DJADLO Cc1ccc([C@H](C)[N@H+](C)Cc2noc(-c3ccccc3)n2)c(C)c1 ZINC000511599747 340331976 /nfs/dbraw/zinc/33/19/76/340331976.db2.gz OUAMOMPOWXAHGE-INIZCTEOSA-N 1 2 321.424 4.546 20 0 DJADLO Cc1ccc([C@H](C)[N@@H+](C)Cc2noc(-c3ccccc3)n2)c(C)c1 ZINC000511599747 340331977 /nfs/dbraw/zinc/33/19/77/340331977.db2.gz OUAMOMPOWXAHGE-INIZCTEOSA-N 1 2 321.424 4.546 20 0 DJADLO Cc1nc([C@H]2CCC[N@@H+]2Cc2cc(C)cc(Cl)c2)cs1 ZINC000512658353 340371480 /nfs/dbraw/zinc/37/14/80/340371480.db2.gz RZUPHVWEFWPXJA-MRXNPFEDSA-N 1 2 306.862 4.750 20 0 DJADLO Cc1nc([C@H]2CCC[N@H+]2Cc2cc(C)cc(Cl)c2)cs1 ZINC000512658353 340371481 /nfs/dbraw/zinc/37/14/81/340371481.db2.gz RZUPHVWEFWPXJA-MRXNPFEDSA-N 1 2 306.862 4.750 20 0 DJADLO C[C@@H]([NH2+]Cc1cc(Cl)ccc1Cl)c1c(F)cncc1F ZINC000513046146 340390574 /nfs/dbraw/zinc/39/05/74/340390574.db2.gz JPXZZDMEGNQXCV-MRVPVSSYSA-N 1 2 317.166 4.517 20 0 DJADLO C[C@@H]([NH2+]Cc1cc(Cl)cc(Cl)c1)c1c(F)cncc1F ZINC000513091301 340392895 /nfs/dbraw/zinc/39/28/95/340392895.db2.gz ZMSPXFTVPMQUAJ-MRVPVSSYSA-N 1 2 317.166 4.517 20 0 DJADLO COc1ccc([C@H](Nc2cccc[nH+]2)c2ccc(C)cc2)cc1 ZINC000513202024 340396849 /nfs/dbraw/zinc/39/68/49/340396849.db2.gz SHFYHYCIGHSBHG-HXUWFJFHSA-N 1 2 304.393 4.600 20 0 DJADLO CSCc1cnc(C[N@H+](C)C/C(C)=C/c2ccccc2)s1 ZINC000513232862 340398605 /nfs/dbraw/zinc/39/86/05/340398605.db2.gz SQMDLFYBOYTFBT-NTEUORMPSA-N 1 2 318.511 4.541 20 0 DJADLO CSCc1cnc(C[N@@H+](C)C/C(C)=C/c2ccccc2)s1 ZINC000513232862 340398606 /nfs/dbraw/zinc/39/86/06/340398606.db2.gz SQMDLFYBOYTFBT-NTEUORMPSA-N 1 2 318.511 4.541 20 0 DJADLO CCC(CC)c1cc(C[NH2+][C@@H]2CCc3c2c(F)ccc3F)on1 ZINC000513358166 340403695 /nfs/dbraw/zinc/40/36/95/340403695.db2.gz GMCYZSHVJIYSRP-MRXNPFEDSA-N 1 2 320.383 4.634 20 0 DJADLO CC(C)c1csc(C[NH2+][C@@H](C)c2csc(C(C)C)n2)n1 ZINC000186390379 340512195 /nfs/dbraw/zinc/51/21/95/340512195.db2.gz LKKLSMUJYNKOMK-NSHDSACASA-N 1 2 309.504 4.697 20 0 DJADLO CCCc1cccc(C[NH2+][C@@H](C)c2noc(-c3ccccc3)n2)c1 ZINC000187301461 340519032 /nfs/dbraw/zinc/51/90/32/340519032.db2.gz JTYZOYRRENSQRK-HNNXBMFYSA-N 1 2 321.424 4.540 20 0 DJADLO Cc1[nH+]cc(CNc2ccccc2OC(C)C)n1-c1ccccc1 ZINC000236689082 340663870 /nfs/dbraw/zinc/66/38/70/340663870.db2.gz MFYGOIHIPKEKDM-UHFFFAOYSA-N 1 2 321.424 4.580 20 0 DJADLO CC[C@H]([NH2+]Cc1nc2cc(C)ccc2s1)c1nc(C)cs1 ZINC000528441367 340719247 /nfs/dbraw/zinc/71/92/47/340719247.db2.gz NBJOIBHZVVRZSN-LBPRGKRZSA-N 1 2 317.483 4.611 20 0 DJADLO C[C@@H](Nc1ccc(N2CCCC2)[nH+]c1)c1cccc(Cl)c1 ZINC000036982167 340726077 /nfs/dbraw/zinc/72/60/77/340726077.db2.gz XZRVFSSERSSXDT-CYBMUJFWSA-N 1 2 301.821 4.508 20 0 DJADLO CC[C@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)no1)c1cc(C)ccc1C ZINC000528802463 340735160 /nfs/dbraw/zinc/73/51/60/340735160.db2.gz SZDXPOMQBZMWTF-HOCLYGCPSA-N 1 2 315.461 4.786 20 0 DJADLO C[C@@H]([NH2+]Cc1cccc(O)c1Cl)c1cc2ccccc2o1 ZINC000328251130 340757080 /nfs/dbraw/zinc/75/70/80/340757080.db2.gz SPCYDHYFFMAQBS-LLVKDONJSA-N 1 2 301.773 4.643 20 0 DJADLO C[C@@H]([NH2+]Cc1coc(-c2cccs2)n1)c1c(F)cccc1F ZINC000538129500 340810756 /nfs/dbraw/zinc/81/07/56/340810756.db2.gz FRLDEFVOGIOWAL-SNVBAGLBSA-N 1 2 320.364 4.532 20 0 DJADLO Clc1ccc([C@@H]([NH2+]Cc2ccco2)c2ccsc2)cc1 ZINC000067253672 340856199 /nfs/dbraw/zinc/85/61/99/340856199.db2.gz SETDICNJGBHWSO-MRXNPFEDSA-N 1 2 303.814 4.874 20 0 DJADLO CCCCc1noc(C[NH2+][C@@H](CC(C)(C)C)c2ccccc2)n1 ZINC000540380062 340928874 /nfs/dbraw/zinc/92/88/74/340928874.db2.gz SLPUIQCMEPZYHN-INIZCTEOSA-N 1 2 315.461 4.679 20 0 DJADLO CCCCc1nc(C[NH2+][C@@H](c2cccs2)C(CC)CC)no1 ZINC000540381711 340928964 /nfs/dbraw/zinc/92/89/64/340928964.db2.gz WLLXXCOGJGMFDJ-QGZVFWFLSA-N 1 2 321.490 4.741 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1F)c1nc2ccccc2o1 ZINC000540854708 340948754 /nfs/dbraw/zinc/94/87/54/340948754.db2.gz RUTWREKMEFNQSJ-GHMZBOCLSA-N 1 2 302.324 4.518 20 0 DJADLO CC(C)COC[C@H]([NH2+][C@H](C)c1c(F)cccc1F)c1ccco1 ZINC000152613640 340960057 /nfs/dbraw/zinc/96/00/57/340960057.db2.gz HMSOFSKPDSDDAG-CJNGLKHVSA-N 1 2 323.383 4.622 20 0 DJADLO CSc1ccc(C)c(NCc2cc(-n3cc[nH+]c3)cs2)c1 ZINC000542309529 341003891 /nfs/dbraw/zinc/00/38/91/341003891.db2.gz RPNJUFXAIHWVIQ-UHFFFAOYSA-N 1 2 315.467 4.576 20 0 DJADLO CC(C)c1cnc(C[NH2+]Cc2ccc(-c3ccccc3)o2)s1 ZINC000542318469 341004568 /nfs/dbraw/zinc/00/45/68/341004568.db2.gz ZOCKOPBZUPFHQM-UHFFFAOYSA-N 1 2 312.438 4.816 20 0 DJADLO CCc1cnc(C[N@@H+]2CCCC[C@@H]2c2ccc(F)cc2)s1 ZINC000542466643 341008534 /nfs/dbraw/zinc/00/85/34/341008534.db2.gz OPDZROZBDPDNOZ-MRXNPFEDSA-N 1 2 304.434 4.572 20 0 DJADLO CCc1cnc(C[N@H+]2CCCC[C@@H]2c2ccc(F)cc2)s1 ZINC000542466643 341008535 /nfs/dbraw/zinc/00/85/35/341008535.db2.gz OPDZROZBDPDNOZ-MRXNPFEDSA-N 1 2 304.434 4.572 20 0 DJADLO Fc1cccc(C=C2CC[NH+](Cc3ccncc3Cl)CC2)c1 ZINC000542519117 341011782 /nfs/dbraw/zinc/01/17/82/341011782.db2.gz SBTPKHANJQJQPM-UHFFFAOYSA-N 1 2 316.807 4.554 20 0 DJADLO CC(C)C[C@H]([NH2+][C@H](C)c1nc(C(C)C)no1)c1cccs1 ZINC000542557628 341013558 /nfs/dbraw/zinc/01/35/58/341013558.db2.gz WYQLKBIZCKIEDX-OLZOCXBDSA-N 1 2 307.463 4.693 20 0 DJADLO C[C@@H]([NH2+]Cc1cc2ccccc2o1)c1ncc(-c2ccccc2)o1 ZINC000542574478 341014158 /nfs/dbraw/zinc/01/41/58/341014158.db2.gz OEGIGGRBIUIIME-CQSZACIVSA-N 1 2 318.376 4.939 20 0 DJADLO CC(C)c1ncc(C[NH2+][C@H](c2ccco2)c2ccccc2)s1 ZINC000130799079 341045786 /nfs/dbraw/zinc/04/57/86/341045786.db2.gz SMOSSQRPTXLCFK-KRWDZBQOSA-N 1 2 312.438 4.739 20 0 DJADLO CC[C@H]([NH2+][C@H](C)c1cccc(Cl)c1Cl)c1ccn(C)n1 ZINC000543591992 341049694 /nfs/dbraw/zinc/04/96/94/341049694.db2.gz RSDUMWLUJKPERF-MFKMUULPSA-N 1 2 312.244 4.529 20 0 DJADLO Cc1cnc([C@@H](C)[NH2+][C@@H](c2ccc(Cl)cc2F)C(C)C)o1 ZINC000543847665 341061422 /nfs/dbraw/zinc/06/14/22/341061422.db2.gz YGYQKXUKNOHCBQ-IAQYHMDHSA-N 1 2 310.800 4.823 20 0 DJADLO Cc1cccc(C(C)C)c1NC(=O)C[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000543987575 341065052 /nfs/dbraw/zinc/06/50/52/341065052.db2.gz CZJJAERJRIYCMQ-INIZCTEOSA-N 1 2 322.452 4.634 20 0 DJADLO Cc1cccc(C(C)C)c1NC(=O)C[N@H+]1Cc2ccccc2[C@@H]1C ZINC000543987575 341065053 /nfs/dbraw/zinc/06/50/53/341065053.db2.gz CZJJAERJRIYCMQ-INIZCTEOSA-N 1 2 322.452 4.634 20 0 DJADLO C[C@H](c1cc2ccccc2o1)[N@H+](C)Cc1nc(C2CC2)cs1 ZINC000544072661 341069296 /nfs/dbraw/zinc/06/92/96/341069296.db2.gz ZYWKZMIALRKZDM-GFCCVEGCSA-N 1 2 312.438 4.960 20 0 DJADLO C[C@H](c1cc2ccccc2o1)[N@@H+](C)Cc1nc(C2CC2)cs1 ZINC000544072661 341069297 /nfs/dbraw/zinc/06/92/97/341069297.db2.gz ZYWKZMIALRKZDM-GFCCVEGCSA-N 1 2 312.438 4.960 20 0 DJADLO CCOc1cc(C)ccc1C[NH2+][C@@H](c1ccco1)c1ccccc1 ZINC000544358178 341077989 /nfs/dbraw/zinc/07/79/89/341077989.db2.gz BZTHPWGRKLQWEQ-OAQYLSRUSA-N 1 2 321.420 4.866 20 0 DJADLO CC[C@](C)([NH2+]Cc1cc(Cl)ccc1Cl)c1nccs1 ZINC000072685002 341098082 /nfs/dbraw/zinc/09/80/82/341098082.db2.gz AQZAWWNHRUFIOM-AWEZNQCLSA-N 1 2 315.269 4.865 20 0 DJADLO CC(C)c1ccc([C@@H](C)[NH2+][C@@H](C)c2nc(C(C)(C)C)no2)cc1 ZINC000073984261 341124571 /nfs/dbraw/zinc/12/45/71/341124571.db2.gz CZTFHEQTDBNRRV-KGLIPLIRSA-N 1 2 315.461 4.902 20 0 DJADLO CC(C)CCc1noc(-c2cccc(Oc3cc[nH+]cc3)c2)n1 ZINC000545697826 341136894 /nfs/dbraw/zinc/13/68/94/341136894.db2.gz KNUCLOACZVJRLG-UHFFFAOYSA-N 1 2 309.369 4.513 20 0 DJADLO Cc1ccc(N[C@@H](Cc2cccnc2)c2ccc(Cl)cc2)c[nH+]1 ZINC000546167425 341155686 /nfs/dbraw/zinc/15/56/86/341155686.db2.gz VLEBHQKIPAIKJC-IBGZPJMESA-N 1 2 323.827 4.834 20 0 DJADLO CC[N@H+](Cc1ncc(C)o1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000075674652 341180680 /nfs/dbraw/zinc/18/06/80/341180680.db2.gz RIHKMJSAZWZEEM-GFCCVEGCSA-N 1 2 312.335 4.585 20 0 DJADLO CC[N@@H+](Cc1ncc(C)o1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000075674652 341180681 /nfs/dbraw/zinc/18/06/81/341180681.db2.gz RIHKMJSAZWZEEM-GFCCVEGCSA-N 1 2 312.335 4.585 20 0 DJADLO Cc1cccc([C@@H]2CCCC[N@@H+]2Cc2nccn2C(F)F)c1C ZINC000075999527 341195287 /nfs/dbraw/zinc/19/52/87/341195287.db2.gz SETDUKWDICHUOP-INIZCTEOSA-N 1 2 319.399 4.622 20 0 DJADLO Cc1cccc([C@@H]2CCCC[N@H+]2Cc2nccn2C(F)F)c1C ZINC000075999527 341195288 /nfs/dbraw/zinc/19/52/88/341195288.db2.gz SETDUKWDICHUOP-INIZCTEOSA-N 1 2 319.399 4.622 20 0 DJADLO CC[N@H+](Cc1nccs1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000135009140 341228748 /nfs/dbraw/zinc/22/87/48/341228748.db2.gz TWAOGFJDFOZBNK-NSHDSACASA-N 1 2 314.376 4.745 20 0 DJADLO CC[N@@H+](Cc1nccs1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000135009140 341228749 /nfs/dbraw/zinc/22/87/49/341228749.db2.gz TWAOGFJDFOZBNK-NSHDSACASA-N 1 2 314.376 4.745 20 0 DJADLO c1coc(C[NH2+][C@@H](c2cc3ccccc3o2)c2ccccc2)c1 ZINC000078268954 341239281 /nfs/dbraw/zinc/23/92/81/341239281.db2.gz DIONBUGAWIAGTA-HXUWFJFHSA-N 1 2 303.361 4.905 20 0 DJADLO Cc1cnc([C@H](C)[NH2+]Cc2cc(Cl)ccc2Cl)s1 ZINC000135441777 341239685 /nfs/dbraw/zinc/23/96/85/341239685.db2.gz CNVBYWPZPXPNEX-VIFPVBQESA-N 1 2 301.242 4.609 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1ccco1)c1ccccc1)c1ccc(F)cc1F ZINC000078970921 341250804 /nfs/dbraw/zinc/25/08/04/341250804.db2.gz DRVCKEKRAOTPIW-BFUOFWGJSA-N 1 2 313.347 4.998 20 0 DJADLO C[C@@H]([NH2+][C@H](c1ccco1)c1ccccc1)c1ccc(F)c(F)c1 ZINC000078971170 341250937 /nfs/dbraw/zinc/25/09/37/341250937.db2.gz JZRJSUVGUJHABJ-YJYMSZOUSA-N 1 2 313.347 4.998 20 0 DJADLO Cc1ccccc1[C@@H]1C[N@H+](Cc2cccc(C(F)F)c2)CCO1 ZINC000548423926 341259880 /nfs/dbraw/zinc/25/98/80/341259880.db2.gz WPRMQVSOPXJBCY-SFHVURJKSA-N 1 2 317.379 4.506 20 0 DJADLO Cc1ccccc1[C@@H]1C[N@@H+](Cc2cccc(C(F)F)c2)CCO1 ZINC000548423926 341259881 /nfs/dbraw/zinc/25/98/81/341259881.db2.gz WPRMQVSOPXJBCY-SFHVURJKSA-N 1 2 317.379 4.506 20 0 DJADLO Cc1csc([C@H](C)[NH2+]Cc2c(Cl)cccc2Cl)n1 ZINC000080273409 341271951 /nfs/dbraw/zinc/27/19/51/341271951.db2.gz PAYIEGNAPNFGCE-VIFPVBQESA-N 1 2 301.242 4.609 20 0 DJADLO CO[C@@H](C)c1nc(C[N@H+](C)[C@@H](C)c2cccc(Cl)c2)cs1 ZINC000245470234 341295920 /nfs/dbraw/zinc/29/59/20/341295920.db2.gz MQACJLKYOUZXCR-RYUDHWBXSA-N 1 2 324.877 4.697 20 0 DJADLO CO[C@@H](C)c1nc(C[N@@H+](C)[C@@H](C)c2cccc(Cl)c2)cs1 ZINC000245470234 341295921 /nfs/dbraw/zinc/29/59/21/341295921.db2.gz MQACJLKYOUZXCR-RYUDHWBXSA-N 1 2 324.877 4.697 20 0 DJADLO CCCCn1cc[nH+]c1-c1cccc(NCc2conc2CC)c1 ZINC000549780811 341303036 /nfs/dbraw/zinc/30/30/36/341303036.db2.gz SAXJEJRSHYDJRR-UHFFFAOYSA-N 1 2 324.428 4.513 20 0 DJADLO Cc1nocc1C[NH2+][C@@H](c1ccsc1)c1ccc(Cl)cc1 ZINC000550110808 341310162 /nfs/dbraw/zinc/31/01/62/341310162.db2.gz SSVFQANYLQFOGC-MRXNPFEDSA-N 1 2 318.829 4.577 20 0 DJADLO C[C@H](Nc1cccc([NH+]2CCCCCC2)c1)c1ccncc1F ZINC000550784038 341322831 /nfs/dbraw/zinc/32/28/31/341322831.db2.gz BRDZMHHRINXOQJ-HNNXBMFYSA-N 1 2 313.420 4.774 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1Cl)c1cn2ccccc2n1 ZINC000551315317 341338390 /nfs/dbraw/zinc/33/83/90/341338390.db2.gz RBXKFEHPLYIDMZ-RYUDHWBXSA-N 1 2 317.795 4.539 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1Cl)c1cn2ccccc2n1 ZINC000551315314 341338415 /nfs/dbraw/zinc/33/84/15/341338415.db2.gz RBXKFEHPLYIDMZ-NEPJUHHUSA-N 1 2 317.795 4.539 20 0 DJADLO Cc1cnc(C[N@@H+](C)[C@@H](C)c2ccc(-c3ccccc3)cc2)nc1 ZINC000551420177 341341275 /nfs/dbraw/zinc/34/12/75/341341275.db2.gz QCXILQZJGSLQBN-KRWDZBQOSA-N 1 2 317.436 4.645 20 0 DJADLO Cc1cnc(C[N@H+](C)[C@@H](C)c2ccc(-c3ccccc3)cc2)nc1 ZINC000551420177 341341276 /nfs/dbraw/zinc/34/12/76/341341276.db2.gz QCXILQZJGSLQBN-KRWDZBQOSA-N 1 2 317.436 4.645 20 0 DJADLO CCn1ncc2ccc(N[C@@H](c3[nH]cc[nH+]3)C3CCCCC3)cc21 ZINC000552071123 341367372 /nfs/dbraw/zinc/36/73/72/341367372.db2.gz QPWCTMXLRIGLOF-GOSISDBHSA-N 1 2 323.444 4.513 20 0 DJADLO C[C@@H]([NH2+][C@H](c1nccn1C)C1CC1)c1cccc(Cl)c1Cl ZINC000552319938 341386272 /nfs/dbraw/zinc/38/62/72/341386272.db2.gz UMZBXWYGKKLJLA-BMIGLBTASA-N 1 2 324.255 4.529 20 0 DJADLO COc1ccccc1[C@H]([NH2+][C@H](C)c1nccs1)c1ccccc1 ZINC000089554916 341405620 /nfs/dbraw/zinc/40/56/20/341405620.db2.gz PFSFJWYAMMEDDU-RDTXWAMCSA-N 1 2 324.449 4.592 20 0 DJADLO COC[C@@H](Nc1cc[nH+]c2c(Cl)cccc12)c1ccc(C)o1 ZINC000553152542 341417936 /nfs/dbraw/zinc/41/79/36/341417936.db2.gz VYYRRWPXEMNFSQ-OAHLLOKOSA-N 1 2 316.788 4.589 20 0 DJADLO Clc1ccccc1SCc1ccc(-n2cc[nH+]c2)cc1 ZINC000553166826 341418553 /nfs/dbraw/zinc/41/85/53/341418553.db2.gz YZUDDLXFYWFFSV-UHFFFAOYSA-N 1 2 300.814 4.818 20 0 DJADLO CCc1ccc([C@@H](C)[NH2+][C@H](c2cccc(C)c2)c2ccccn2)o1 ZINC000090946488 341420572 /nfs/dbraw/zinc/42/05/72/341420572.db2.gz RXAAITYTHLXBCQ-IIBYNOLFSA-N 1 2 320.436 4.986 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)cs1)c1ccccc1F ZINC000153938039 341581893 /nfs/dbraw/zinc/58/18/93/341581893.db2.gz KKZIPQRXNQWPQM-NEPJUHHUSA-N 1 2 306.450 4.992 20 0 DJADLO Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1cc(C(C)(C)C)on1 ZINC000572650708 341699039 /nfs/dbraw/zinc/69/90/39/341699039.db2.gz RXDFKYWEBMLBLC-CYBMUJFWSA-N 1 2 312.413 4.878 20 0 DJADLO Cc1cc(C[NH2+][C@@H](c2c(Cl)cccc2Cl)C2CC2)no1 ZINC000577802311 341937652 /nfs/dbraw/zinc/93/76/52/341937652.db2.gz RETZIXSLNWSZJF-OAHLLOKOSA-N 1 2 311.212 4.531 20 0 DJADLO CCO[C@H](C)c1nc(C[N@H+](Cc2cccs2)C(C)C)cs1 ZINC000336839376 520474632 /nfs/dbraw/zinc/47/46/32/520474632.db2.gz SUEITERTJYPKPK-CYBMUJFWSA-N 1 2 324.515 4.713 20 0 DJADLO CCO[C@H](C)c1nc(C[N@@H+](Cc2cccs2)C(C)C)cs1 ZINC000336839376 520474640 /nfs/dbraw/zinc/47/46/40/520474640.db2.gz SUEITERTJYPKPK-CYBMUJFWSA-N 1 2 324.515 4.713 20 0 DJADLO CCCCc1noc([C@@H](C)[NH2+][C@@H](C)c2cc3ccccc3o2)n1 ZINC000182631868 521345105 /nfs/dbraw/zinc/34/51/05/521345105.db2.gz QHQGPTNASBSQFC-QWHCGFSZSA-N 1 2 313.401 4.570 20 0 DJADLO CCOc1cccc([C@H](C)[NH2+]Cc2ncc(-c3ccccc3)o2)c1 ZINC000180707419 521422520 /nfs/dbraw/zinc/42/25/20/521422520.db2.gz ZMSKHNLTXQVTQF-HNNXBMFYSA-N 1 2 322.408 4.591 20 0 DJADLO CCOc1ccccc1[C@H](CC(C)C)[NH2+]Cc1nc(C)c(C)o1 ZINC000181266437 521585951 /nfs/dbraw/zinc/58/59/51/521585951.db2.gz LPDYIPTUQDRFFV-KRWDZBQOSA-N 1 2 316.445 4.567 20 0 DJADLO CC[C@H]([NH2+][C@@H](C)c1nc(C(C)C)no1)c1cccc(Cl)c1 ZINC000182598032 522702138 /nfs/dbraw/zinc/70/21/38/522702138.db2.gz POKXCXDSQOVSJT-FZMZJTMJSA-N 1 2 307.825 4.648 20 0 DJADLO CC[C@H]([NH2+][C@H](C)c1nc(C(C)C)no1)c1cccc(Cl)c1 ZINC000182598074 522744756 /nfs/dbraw/zinc/74/47/56/522744756.db2.gz POKXCXDSQOVSJT-RISCZKNCSA-N 1 2 307.825 4.648 20 0 DJADLO COc1ccc(C)cc1[C@@H](C)[NH2+][C@@H](C)c1ncc(C(C)(C)C)o1 ZINC000267050072 523853589 /nfs/dbraw/zinc/85/35/89/523853589.db2.gz OWKOSWAFMILIQF-KGLIPLIRSA-N 1 2 316.445 4.701 20 0 DJADLO C[C@H]([NH2+]Cc1ccc(Cl)cn1)c1cc(Cl)sc1Cl ZINC000182125193 525441951 /nfs/dbraw/zinc/44/19/51/525441951.db2.gz VTLKKWHRFQUZKX-ZETCQYMHSA-N 1 2 321.660 4.954 20 0 DJADLO C[C@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1cccc(F)c1F ZINC000181993956 525485479 /nfs/dbraw/zinc/48/54/79/525485479.db2.gz HASAGZZZWLQXNG-JTQLQIEISA-N 1 2 310.413 4.570 20 0 DJADLO C[C@@H]([NH2+]Cc1csc(C2CCCCC2)n1)c1cccc(O)c1 ZINC000181553372 525556215 /nfs/dbraw/zinc/55/62/15/525556215.db2.gz YXYYDWRFLIDGJL-CYBMUJFWSA-N 1 2 316.470 4.747 20 0 DJADLO Cc1c[nH+]ccc1NC(=O)N1CCCCC[C@H]1c1ccccc1 ZINC000179854989 526238697 /nfs/dbraw/zinc/23/86/97/526238697.db2.gz CKEYRSCKGHMKTC-SFHVURJKSA-N 1 2 309.413 4.539 20 0 DJADLO Cc1csc(C2([NH2+][C@@H](C)c3ccccc3Cl)CCC2)n1 ZINC000264839140 526329100 /nfs/dbraw/zinc/32/91/00/526329100.db2.gz GKFFPIDNZVGRGQ-LBPRGKRZSA-N 1 2 306.862 4.835 20 0 DJADLO Cc1nc([C@H]2CCC[N@@H+]2Cc2cnc(C(C)(C)C)s2)cs1 ZINC000189937058 527081773 /nfs/dbraw/zinc/08/17/73/527081773.db2.gz AYYPIPXSGUFHRX-CQSZACIVSA-N 1 2 321.515 4.543 20 0 DJADLO Cc1nc([C@H]2CCC[N@H+]2Cc2cnc(C(C)(C)C)s2)cs1 ZINC000189937058 527081777 /nfs/dbraw/zinc/08/17/77/527081777.db2.gz AYYPIPXSGUFHRX-CQSZACIVSA-N 1 2 321.515 4.543 20 0 DJADLO Cn1c[nH+]cc1CS[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000338398317 527511039 /nfs/dbraw/zinc/51/10/39/527511039.db2.gz JOHDBTAZGBFYQO-SFHVURJKSA-N 1 2 312.413 4.582 20 0 DJADLO CC(C)[N@H+](Cc1csc(C2CC2)n1)Cc1cccc(F)c1 ZINC000340179985 535118253 /nfs/dbraw/zinc/11/82/53/535118253.db2.gz DNLTZBGBLRBBKM-UHFFFAOYSA-N 1 2 304.434 4.570 20 0 DJADLO CC(C)[N@@H+](Cc1csc(C2CC2)n1)Cc1cccc(F)c1 ZINC000340179985 535118254 /nfs/dbraw/zinc/11/82/54/535118254.db2.gz DNLTZBGBLRBBKM-UHFFFAOYSA-N 1 2 304.434 4.570 20 0 DJADLO C[C@H]([NH2+]Cc1coc(-c2ccccc2)n1)c1ccccc1Cl ZINC000096955179 185393773 /nfs/dbraw/zinc/39/37/73/185393773.db2.gz XWULTPHHMARQAL-ZDUSSCGKSA-N 1 2 312.800 4.846 20 0 DJADLO CC(C)c1nc([C@H](C)[NH2+][C@@H]2CCOc3ccc(F)cc32)cs1 ZINC000090048811 185279851 /nfs/dbraw/zinc/27/98/51/185279851.db2.gz CGLVFQVJRCRZAY-SMDDNHRTSA-N 1 2 320.433 4.580 20 0 DJADLO COc1ccccc1[C@@H]([NH2+][C@@H](C)c1ccc(C)o1)c1ccco1 ZINC000090534414 185301229 /nfs/dbraw/zinc/30/12/29/185301229.db2.gz RNRMVDCFHMIVDQ-IFXJQAMLSA-N 1 2 311.381 4.630 20 0 DJADLO CC[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1cc(F)ccc1F ZINC000090458846 185297533 /nfs/dbraw/zinc/29/75/33/185297533.db2.gz MKRSWFDGJSOFCS-CQSZACIVSA-N 1 2 308.397 4.540 20 0 DJADLO CCCCc1nc(C[NH2+][C@@](C)(CC)c2nc(C)cs2)cs1 ZINC000072863575 191244554 /nfs/dbraw/zinc/24/45/54/191244554.db2.gz JLZGEWOUALFXSM-INIZCTEOSA-N 1 2 323.531 4.666 20 0 DJADLO CCc1c2ccccc2oc1[C@H](C)[NH2+][C@@H](C)c1cscn1 ZINC000563827400 335033469 /nfs/dbraw/zinc/03/34/69/335033469.db2.gz WKQRMACPWGQRLW-RYUDHWBXSA-N 1 2 300.427 4.864 20 0 DJADLO Cc1nc(C[NH2+][C@H](C)c2cc(F)c(Cl)cc2Cl)cs1 ZINC000040418846 183064091 /nfs/dbraw/zinc/06/40/91/183064091.db2.gz NONRSJHBEOFSLN-SSDOTTSWSA-N 1 2 319.232 4.748 20 0 DJADLO C[C@H]([NH2+][C@H](CC(F)(F)F)c1ccc(F)cc1)c1cscn1 ZINC000271529757 129930067 /nfs/dbraw/zinc/93/00/67/129930067.db2.gz PKLLZNAABLOBFE-JOYOIKCWSA-N 1 2 318.339 4.627 20 0 DJADLO C[C@H]([NH2+]C1(c2ccc(Cl)c(Cl)c2)CC1)c1cscn1 ZINC000272009571 129990276 /nfs/dbraw/zinc/99/02/76/129990276.db2.gz VWAIVGOSZYIEKA-VIFPVBQESA-N 1 2 313.253 4.790 20 0 DJADLO COc1ccc(C)cc1[C@H](C)[NH2+][C@@H](C)c1nc2ccccc2o1 ZINC000272139602 130002272 /nfs/dbraw/zinc/00/22/72/130002272.db2.gz ZLERYLLDUNWNBM-KBPBESRZSA-N 1 2 310.397 4.557 20 0 DJADLO CCc1nnc(C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cc2)s1 ZINC000273244737 130099896 /nfs/dbraw/zinc/09/98/96/130099896.db2.gz XUGDAJOOUBCHCU-AWEZNQCLSA-N 1 2 323.465 4.618 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cn1)c1c(F)cccc1Cl ZINC000274914361 130273762 /nfs/dbraw/zinc/27/37/62/130273762.db2.gz NVNUVEBDXJWTOZ-VHSXEESVSA-N 1 2 313.203 4.939 20 0 DJADLO C[C@@H]([NH2+]Cc1ncc(C2CC2)o1)c1cc(Cl)ccc1Cl ZINC000275062574 130288378 /nfs/dbraw/zinc/28/83/78/130288378.db2.gz QIQSTGVVAZHOJS-SECBINFHSA-N 1 2 311.212 4.710 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1Cl)c1cscn1 ZINC000275145608 130295234 /nfs/dbraw/zinc/29/52/34/130295234.db2.gz UHDYRZUEGRWQTI-DTWKUNHWSA-N 1 2 301.242 4.862 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1cc(Cl)ccc1Cl)c1cscn1 ZINC000275364072 130308081 /nfs/dbraw/zinc/30/80/81/130308081.db2.gz UHDYRZUEGRWQTI-RKDXNWHRSA-N 1 2 301.242 4.862 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1cscn1)c1cc(Cl)ccc1Cl ZINC000275364071 130308627 /nfs/dbraw/zinc/30/86/27/130308627.db2.gz UHDYRZUEGRWQTI-BDAKNGLRSA-N 1 2 301.242 4.862 20 0 DJADLO C[C@@H]([NH2+][C@H](c1ccccc1)C1CC1)c1noc(-c2ccccc2)n1 ZINC000283959807 131036467 /nfs/dbraw/zinc/03/64/67/131036467.db2.gz DWKWKIZVSBWPBV-RDTXWAMCSA-N 1 2 319.408 4.539 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1c(F)cncc1F)c1ccc(F)cc1Cl ZINC000285587044 131183409 /nfs/dbraw/zinc/18/34/09/131183409.db2.gz HOTUVTOKNIHLDT-RKDXNWHRSA-N 1 2 314.738 4.564 20 0 DJADLO Cc1ccc(-c2csc(C[N@@H+](C)[C@@H](C)c3cccnc3)n2)cc1 ZINC000285661205 131190842 /nfs/dbraw/zinc/19/08/42/131190842.db2.gz PDWYIBOLTMHGBW-HNNXBMFYSA-N 1 2 323.465 4.707 20 0 DJADLO Cc1ccc(-c2csc(C[N@H+](C)[C@@H](C)c3cccnc3)n2)cc1 ZINC000285661205 131190843 /nfs/dbraw/zinc/19/08/43/131190843.db2.gz PDWYIBOLTMHGBW-HNNXBMFYSA-N 1 2 323.465 4.707 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N1C[C@H](C)CC[C@H]1c1ccccc1 ZINC000286963999 131258147 /nfs/dbraw/zinc/25/81/47/131258147.db2.gz AYBNYUPXWJPJOD-KDOFPFPSSA-N 1 2 323.440 4.704 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N(Cc1ccccc1)[C@@H](C)C1CC1 ZINC000287625355 131291667 /nfs/dbraw/zinc/29/16/67/131291667.db2.gz UKTUNHHUEZLQSW-INIZCTEOSA-N 1 2 323.440 4.531 20 0 DJADLO Cc1nc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)c3ccccc32)no1 ZINC000289307871 131372308 /nfs/dbraw/zinc/37/23/08/131372308.db2.gz CIVFVPYBPFUNRQ-MNOVXSKESA-N 1 2 315.804 4.596 20 0 DJADLO Cc1cnc(C[NH2+][C@@H](c2c(Cl)cccc2Cl)C2CC2)o1 ZINC000289597376 131399427 /nfs/dbraw/zinc/39/94/27/131399427.db2.gz DDQZMWVCOJXOCL-OAHLLOKOSA-N 1 2 311.212 4.531 20 0 DJADLO CC[N@H+](Cc1c(Cl)oc2ccccc21)Cc1ccccn1 ZINC000353588760 132012796 /nfs/dbraw/zinc/01/27/96/132012796.db2.gz NLLXJOIBHCGRKF-UHFFFAOYSA-N 1 2 300.789 4.503 20 0 DJADLO CC[N@@H+](Cc1c(Cl)oc2ccccc21)Cc1ccccn1 ZINC000353588760 132012798 /nfs/dbraw/zinc/01/27/98/132012798.db2.gz NLLXJOIBHCGRKF-UHFFFAOYSA-N 1 2 300.789 4.503 20 0 DJADLO C[C@@H]1C[C@@H]([NH2+][C@H](c2ccc(F)cc2F)C(C)(C)C)c2nccn21 ZINC000297948331 132041242 /nfs/dbraw/zinc/04/12/42/132041242.db2.gz YMQPRCVHGUQJJK-HFBAOOFYSA-N 1 2 319.399 4.544 20 0 DJADLO Cc1nc(N[C@@H](c2ccccc2)c2cccc(Cl)c2)cc[nH+]1 ZINC000462371154 332865966 /nfs/dbraw/zinc/86/59/66/332865966.db2.gz PQTJYGHHVDMZED-SFHVURJKSA-N 1 2 309.800 4.640 20 0 DJADLO CC(C)([NH2+]Cc1cc(Cl)sc1Cl)c1nccs1 ZINC000312552873 331642666 /nfs/dbraw/zinc/64/26/66/331642666.db2.gz CWXYBPLMLWOYSP-UHFFFAOYSA-N 1 2 307.271 4.536 20 0 DJADLO CCOc1ccccc1C[NH2+]Cc1c(Cl)cccc1Cl ZINC000518263426 332002586 /nfs/dbraw/zinc/00/25/86/332002586.db2.gz PRFYPOMQKHVDLH-UHFFFAOYSA-N 1 2 310.224 4.682 20 0 DJADLO CCCc1occc1C(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000409606491 332040331 /nfs/dbraw/zinc/04/03/31/332040331.db2.gz AAIXDDKTYWJBPO-UHFFFAOYSA-N 1 2 322.364 4.672 20 0 DJADLO C[C@]12CC[N@H+](Cc3cc(Cl)sc3Cl)C[C@H]1C2(F)F ZINC000449339881 332052567 /nfs/dbraw/zinc/05/25/67/332052567.db2.gz ZRSDBODBDGVPFY-KCJUWKMLSA-N 1 2 312.212 4.532 20 0 DJADLO C[C@]12CC[N@@H+](Cc3cc(Cl)sc3Cl)C[C@H]1C2(F)F ZINC000449339881 332052569 /nfs/dbraw/zinc/05/25/69/332052569.db2.gz ZRSDBODBDGVPFY-KCJUWKMLSA-N 1 2 312.212 4.532 20 0 DJADLO C[N@H+](Cc1cnc2ccccc2c1)Cc1ccc(F)cc1Cl ZINC000410367783 332117610 /nfs/dbraw/zinc/11/76/10/332117610.db2.gz KYYLIJNCNVFXKD-UHFFFAOYSA-N 1 2 314.791 4.659 20 0 DJADLO C[N@@H+](Cc1cnc2ccccc2c1)Cc1ccc(F)cc1Cl ZINC000410367783 332117612 /nfs/dbraw/zinc/11/76/12/332117612.db2.gz KYYLIJNCNVFXKD-UHFFFAOYSA-N 1 2 314.791 4.659 20 0 DJADLO CCCc1csc(C[N@@H+]2CCC[C@@H]2c2ccc(CC)o2)n1 ZINC000426417876 332147370 /nfs/dbraw/zinc/14/73/70/332147370.db2.gz UOVJGKONMPGNAQ-OAHLLOKOSA-N 1 2 304.459 4.588 20 0 DJADLO CCCc1csc(C[N@H+]2CCC[C@@H]2c2ccc(CC)o2)n1 ZINC000426417876 332147371 /nfs/dbraw/zinc/14/73/71/332147371.db2.gz UOVJGKONMPGNAQ-OAHLLOKOSA-N 1 2 304.459 4.588 20 0 DJADLO C[N@H+](Cc1sc2ccccc2c1Cl)Cc1cccnc1 ZINC000533851338 332220312 /nfs/dbraw/zinc/22/03/12/332220312.db2.gz XUCQCOBJRVTXRO-UHFFFAOYSA-N 1 2 302.830 4.582 20 0 DJADLO C[N@@H+](Cc1sc2ccccc2c1Cl)Cc1cccnc1 ZINC000533851338 332220313 /nfs/dbraw/zinc/22/03/13/332220313.db2.gz XUCQCOBJRVTXRO-UHFFFAOYSA-N 1 2 302.830 4.582 20 0 DJADLO Cc1cnc(C[N@@H+]2CCCCC[C@H]2c2ccc(Cl)cc2)nc1 ZINC000536367916 332233293 /nfs/dbraw/zinc/23/32/93/332233293.db2.gz CMCYTXAJUDLWCS-KRWDZBQOSA-N 1 2 315.848 4.556 20 0 DJADLO Cc1cnc(C[N@H+]2CCCCC[C@H]2c2ccc(Cl)cc2)nc1 ZINC000536367916 332233294 /nfs/dbraw/zinc/23/32/94/332233294.db2.gz CMCYTXAJUDLWCS-KRWDZBQOSA-N 1 2 315.848 4.556 20 0 DJADLO C[C@H](SCCn1cc[nH+]c1)c1cc(Cl)ccc1Cl ZINC000536373180 332234771 /nfs/dbraw/zinc/23/47/71/332234771.db2.gz ARQUROOMBAAQNC-JTQLQIEISA-N 1 2 301.242 4.684 20 0 DJADLO Cc1[nH]ncc1C[NH2+][C@H](C)c1ccc(SC2CCCC2)cc1 ZINC000560904936 332393743 /nfs/dbraw/zinc/39/37/43/332393743.db2.gz XVVUEBNIEZRFRY-CYBMUJFWSA-N 1 2 315.486 4.604 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)CCc1ccc(Cl)c(Cl)c1 ZINC000425585362 335106973 /nfs/dbraw/zinc/10/69/73/335106973.db2.gz HOHZSAGNPBAVLP-UHFFFAOYSA-N 1 2 323.223 4.577 20 0 DJADLO Cc1cc(C)c(NC(=O)N(C)[C@@H]2CCCc3ccccc32)c(C)[nH+]1 ZINC000562892606 332636907 /nfs/dbraw/zinc/63/69/07/332636907.db2.gz NVTKWNVFPFAYBH-GOSISDBHSA-N 1 2 323.440 4.548 20 0 DJADLO Fc1cc(Cl)ccc1C[NH2+][C@@H](c1ccco1)c1ccccc1 ZINC000318411452 332710637 /nfs/dbraw/zinc/71/06/37/332710637.db2.gz GUXVBXROWNXBSU-GOSISDBHSA-N 1 2 315.775 4.951 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1nc2ccccc2o1)c1cc2ccccc2o1 ZINC000182627845 333043670 /nfs/dbraw/zinc/04/36/70/333043670.db2.gz MIBXDUKIHYALEA-OLZOCXBDSA-N 1 2 306.365 4.986 20 0 DJADLO C[C@H]([NH2+][C@@H](c1ccco1)c1ccccc1)c1cccc(F)c1F ZINC000183212592 333053185 /nfs/dbraw/zinc/05/31/85/333053185.db2.gz GWFRMRKUGSFRSK-ORAYPTAESA-N 1 2 313.347 4.998 20 0 DJADLO CCc1cnc(C[N@@H+]2CCCC[C@H]2c2cccc(Cl)c2)o1 ZINC000580278402 333053624 /nfs/dbraw/zinc/05/36/24/333053624.db2.gz DFSSTMZASQIGCP-INIZCTEOSA-N 1 2 304.821 4.618 20 0 DJADLO CCc1cnc(C[N@H+]2CCCC[C@H]2c2cccc(Cl)c2)o1 ZINC000580278402 333053626 /nfs/dbraw/zinc/05/36/26/333053626.db2.gz DFSSTMZASQIGCP-INIZCTEOSA-N 1 2 304.821 4.618 20 0 DJADLO CC[C@@](C)([NH2+]Cc1cc(F)ccc1Cl)c1nc(C)cs1 ZINC000189200632 333066036 /nfs/dbraw/zinc/06/60/36/333066036.db2.gz RNLHEHHSTIFGAG-OAHLLOKOSA-N 1 2 312.841 4.659 20 0 DJADLO CC(C)Oc1ccccc1C[NH2+][C@@H](C)c1c(F)cccc1F ZINC000314407598 333109024 /nfs/dbraw/zinc/10/90/24/333109024.db2.gz APENXXLYXVTFAK-ZDUSSCGKSA-N 1 2 305.368 4.603 20 0 DJADLO Cc1nc([C@@H](C)[NH2+][C@@H](C)c2cc3cccc(F)c3o2)cs1 ZINC000462821572 333119363 /nfs/dbraw/zinc/11/93/63/333119363.db2.gz ZTRXVRPRGXALCV-ZJUUUORDSA-N 1 2 304.390 4.749 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1)c1nc(C2CCCCC2)no1 ZINC000185270956 335124484 /nfs/dbraw/zinc/12/44/84/335124484.db2.gz GZIKMJZFYCVAIR-CHWSQXEVSA-N 1 2 317.408 4.668 20 0 DJADLO CC(C)c1nc(C[N@H+](C)Cc2cc3ccccc3o2)cs1 ZINC000570951288 333177720 /nfs/dbraw/zinc/17/77/20/333177720.db2.gz ZGIUKVRIENFKKG-UHFFFAOYSA-N 1 2 300.427 4.645 20 0 DJADLO CC(C)c1nc(C[N@@H+](C)Cc2cc3ccccc3o2)cs1 ZINC000570951288 333177722 /nfs/dbraw/zinc/17/77/22/333177722.db2.gz ZGIUKVRIENFKKG-UHFFFAOYSA-N 1 2 300.427 4.645 20 0 DJADLO Clc1ccc(SCc2[nH+]ccn2Cc2ccccc2)cc1 ZINC000497313893 333234522 /nfs/dbraw/zinc/23/45/22/333234522.db2.gz WFMPONLCEQFUNP-UHFFFAOYSA-N 1 2 314.841 4.877 20 0 DJADLO Cc1nc([C@H](C)[N@@H+]2CC[C@](C)(F)C2)oc1-c1ccc(Cl)cc1 ZINC000501422752 333273403 /nfs/dbraw/zinc/27/34/03/333273403.db2.gz NJCACWOSCGRVDD-SJCJKPOMSA-N 1 2 322.811 4.798 20 0 DJADLO Cc1nc([C@H](C)[N@H+]2CC[C@](C)(F)C2)oc1-c1ccc(Cl)cc1 ZINC000501422752 333273405 /nfs/dbraw/zinc/27/34/05/333273405.db2.gz NJCACWOSCGRVDD-SJCJKPOMSA-N 1 2 322.811 4.798 20 0 DJADLO COc1ccccc1[C@H](C)[NH2+][C@@H](c1ccco1)c1ccccc1 ZINC000120217519 333276212 /nfs/dbraw/zinc/27/62/12/333276212.db2.gz YMOUWFSKHHDDNF-MGPUTAFESA-N 1 2 307.393 4.728 20 0 DJADLO Cc1nc(C[N@H+](Cc2ccccc2)Cc2ccccc2C)cs1 ZINC000525779914 333303218 /nfs/dbraw/zinc/30/32/18/333303218.db2.gz KZSOVIZRMBEZEX-UHFFFAOYSA-N 1 2 322.477 4.962 20 0 DJADLO Cc1nc(C[N@@H+](Cc2ccccc2)Cc2ccccc2C)cs1 ZINC000525779914 333303219 /nfs/dbraw/zinc/30/32/19/333303219.db2.gz KZSOVIZRMBEZEX-UHFFFAOYSA-N 1 2 322.477 4.962 20 0 DJADLO CC(C)c1nc(C[N@@H+]2CC[C@H](C)C[C@H]2c2ccco2)cs1 ZINC000525781997 333307314 /nfs/dbraw/zinc/30/73/14/333307314.db2.gz NMJDKSFIVMOVHK-ZFWWWQNUSA-N 1 2 304.459 4.833 20 0 DJADLO CC(C)c1nc(C[N@H+]2CC[C@H](C)C[C@H]2c2ccco2)cs1 ZINC000525781997 333307316 /nfs/dbraw/zinc/30/73/16/333307316.db2.gz NMJDKSFIVMOVHK-ZFWWWQNUSA-N 1 2 304.459 4.833 20 0 DJADLO Cc1cc(F)ccc1C[N@@H+](C)[C@H](C)c1ncc(C(C)(C)C)o1 ZINC000487983804 333334721 /nfs/dbraw/zinc/33/47/21/333334721.db2.gz XBIXFDRHTAUVIA-CYBMUJFWSA-N 1 2 304.409 4.613 20 0 DJADLO Cc1cc(F)ccc1C[N@H+](C)[C@H](C)c1ncc(C(C)(C)C)o1 ZINC000487983804 333334723 /nfs/dbraw/zinc/33/47/23/333334723.db2.gz XBIXFDRHTAUVIA-CYBMUJFWSA-N 1 2 304.409 4.613 20 0 DJADLO C[C@H]1c2ccccc2CC[N@H+]1Cc1coc(-c2cccs2)n1 ZINC000531378416 333347617 /nfs/dbraw/zinc/34/76/17/333347617.db2.gz IWTBODXBCZVZSA-ZDUSSCGKSA-N 1 2 310.422 4.522 20 0 DJADLO C[C@H]1c2ccccc2CC[N@@H+]1Cc1coc(-c2cccs2)n1 ZINC000531378416 333347619 /nfs/dbraw/zinc/34/76/19/333347619.db2.gz IWTBODXBCZVZSA-ZDUSSCGKSA-N 1 2 310.422 4.522 20 0 DJADLO CCOc1cccc2cc([C@H](C)[NH2+][C@@H](C)c3cscn3)oc21 ZINC000534329665 333577694 /nfs/dbraw/zinc/57/76/94/333577694.db2.gz VQUGQURMPWAUMP-RYUDHWBXSA-N 1 2 316.426 4.700 20 0 DJADLO CC[C@H](Sc1ccccc1)C(=O)Nc1c(C)cc(C)[nH+]c1C ZINC000414792882 334098504 /nfs/dbraw/zinc/09/85/04/334098504.db2.gz RVXNSIKVJOOQFV-INIZCTEOSA-N 1 2 314.454 4.516 20 0 DJADLO Cc1cc(CNc2ccc3c(c2)CCC[NH2+]3)cc2cccnc12 ZINC000414826977 334109204 /nfs/dbraw/zinc/10/92/04/334109204.db2.gz AIPIQMHZPODEEC-UHFFFAOYSA-N 1 2 303.409 4.513 20 0 DJADLO Cc1ccc([C@@H]2CCCC[N@@H+]2Cc2nc(C3CC3)cs2)o1 ZINC000343563500 335178050 /nfs/dbraw/zinc/17/80/50/335178050.db2.gz ZKMSWHNTOLGJJZ-HNNXBMFYSA-N 1 2 302.443 4.649 20 0 DJADLO Cc1ccc([C@@H]2CCCC[N@H+]2Cc2nc(C3CC3)cs2)o1 ZINC000343563500 335178052 /nfs/dbraw/zinc/17/80/52/335178052.db2.gz ZKMSWHNTOLGJJZ-HNNXBMFYSA-N 1 2 302.443 4.649 20 0 DJADLO CCn1ccnc1[C@H](C)[NH2+][C@H](C)c1ccc(Cl)cc1Cl ZINC000296081132 334229762 /nfs/dbraw/zinc/22/97/62/334229762.db2.gz SPFVAMZJSIELQI-MNOVXSKESA-N 1 2 312.244 4.622 20 0 DJADLO CCn1cc[nH+]c1[C@H](C)Nc1ccc(OC(C)C)c(Cl)c1 ZINC000297066689 334239201 /nfs/dbraw/zinc/23/92/01/334239201.db2.gz WDKHUYJDCFTNMM-LBPRGKRZSA-N 1 2 307.825 4.517 20 0 DJADLO Cn1cc[nH+]c1-c1cccc(N[C@H]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000187557792 334265002 /nfs/dbraw/zinc/26/50/02/334265002.db2.gz MYAWWANXISQWGD-ZFWWWQNUSA-N 1 2 323.362 4.620 20 0 DJADLO c1ccc(N2Cc3cccc(NCC4CCCCC4)c3C2)[nH+]c1 ZINC000534512866 334278161 /nfs/dbraw/zinc/27/81/61/334278161.db2.gz GWGOBSPCLJLDDV-UHFFFAOYSA-N 1 2 307.441 4.594 20 0 DJADLO CC(C)c1ccc([C@H]2CCC[N@@H+]2Cc2nccn2C(F)F)cc1 ZINC000534666041 334318748 /nfs/dbraw/zinc/31/87/48/334318748.db2.gz XTJYKGUWTYPFDQ-MRXNPFEDSA-N 1 2 319.399 4.739 20 0 DJADLO CC(C)c1ccc([C@H]2CCC[N@H+]2Cc2nccn2C(F)F)cc1 ZINC000534666041 334318749 /nfs/dbraw/zinc/31/87/49/334318749.db2.gz XTJYKGUWTYPFDQ-MRXNPFEDSA-N 1 2 319.399 4.739 20 0 DJADLO CC(C)c1ccc(C[N@H+](Cc2ncc(C3CC3)o2)C2CC2)cc1 ZINC000534808743 334337805 /nfs/dbraw/zinc/33/78/05/334337805.db2.gz KXMHIRFMOMXBOQ-UHFFFAOYSA-N 1 2 310.441 4.840 20 0 DJADLO CC(C)c1ccc(C[N@@H+](Cc2ncc(C3CC3)o2)C2CC2)cc1 ZINC000534808743 334337806 /nfs/dbraw/zinc/33/78/06/334337806.db2.gz KXMHIRFMOMXBOQ-UHFFFAOYSA-N 1 2 310.441 4.840 20 0 DJADLO C[C@H]1CCC[C@H](C(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)C1 ZINC000303897153 334339892 /nfs/dbraw/zinc/33/98/92/334339892.db2.gz PNTRKGRPIRNJOG-GJZGRUSLSA-N 1 2 310.397 4.639 20 0 DJADLO Cc1cccc2[nH+]c(CNc3ccc4c5c(cccc53)CC4)cn21 ZINC000303911906 334345154 /nfs/dbraw/zinc/34/51/54/334345154.db2.gz MXXBHXRSQZITJS-UHFFFAOYSA-N 1 2 313.404 4.507 20 0 DJADLO Clc1ccc(C[N@@H+]2CCC[C@H]2c2ccncc2)cc1Cl ZINC000534939757 334349727 /nfs/dbraw/zinc/34/97/27/334349727.db2.gz INEDSYZNYZIKQH-INIZCTEOSA-N 1 2 307.224 4.726 20 0 DJADLO Clc1ccc(C[N@H+]2CCC[C@H]2c2ccncc2)cc1Cl ZINC000534939757 334349728 /nfs/dbraw/zinc/34/97/28/334349728.db2.gz INEDSYZNYZIKQH-INIZCTEOSA-N 1 2 307.224 4.726 20 0 DJADLO C[C@@H](Nc1ccc2ccn(C)c2c1)c1ccc(-n2cc[nH+]c2)cc1 ZINC000443091010 338444090 /nfs/dbraw/zinc/44/40/90/338444090.db2.gz GPHWXKOBIQKXCF-OAHLLOKOSA-N 1 2 316.408 4.537 20 0 DJADLO CC[N@H+](Cc1cnc(C2CC2)s1)Cc1ccccc1Cl ZINC000535072251 334364558 /nfs/dbraw/zinc/36/45/58/334364558.db2.gz WQGYFFGBNSKOND-UHFFFAOYSA-N 1 2 306.862 4.696 20 0 DJADLO CC[N@@H+](Cc1cnc(C2CC2)s1)Cc1ccccc1Cl ZINC000535072251 334364559 /nfs/dbraw/zinc/36/45/59/334364559.db2.gz WQGYFFGBNSKOND-UHFFFAOYSA-N 1 2 306.862 4.696 20 0 DJADLO CCc1nc(C[N@H+](C)Cc2cc3ccccc3s2)cs1 ZINC000535084256 334366783 /nfs/dbraw/zinc/36/67/83/334366783.db2.gz HKUMSCLVDHCUFZ-UHFFFAOYSA-N 1 2 302.468 4.552 20 0 DJADLO CCc1nc(C[N@@H+](C)Cc2cc3ccccc3s2)cs1 ZINC000535084256 334366785 /nfs/dbraw/zinc/36/67/85/334366785.db2.gz HKUMSCLVDHCUFZ-UHFFFAOYSA-N 1 2 302.468 4.552 20 0 DJADLO Fc1ccc(C[NH2+]Cc2c(Cl)cccc2Cl)c(F)c1 ZINC000050198622 334374063 /nfs/dbraw/zinc/37/40/63/334374063.db2.gz RPAWBDUPAUHIQT-UHFFFAOYSA-N 1 2 302.151 4.561 20 0 DJADLO Fc1cccc([C@H]([NH2+]Cc2ccc(Cl)o2)c2ccccc2)c1 ZINC000532039959 334382112 /nfs/dbraw/zinc/38/21/12/334382112.db2.gz NXQZEHFPKAAFKH-GOSISDBHSA-N 1 2 315.775 4.951 20 0 DJADLO CC(C)[N@@H+](Cc1csc(C2CCCC2)n1)Cc1ccco1 ZINC000344038683 335211306 /nfs/dbraw/zinc/21/13/06/335211306.db2.gz BCAASIYRFOJBCH-UHFFFAOYSA-N 1 2 304.459 4.804 20 0 DJADLO CC(C)[N@H+](Cc1csc(C2CCCC2)n1)Cc1ccco1 ZINC000344038683 335211307 /nfs/dbraw/zinc/21/13/07/335211307.db2.gz BCAASIYRFOJBCH-UHFFFAOYSA-N 1 2 304.459 4.804 20 0 DJADLO Cc1cc([C@@H](C)[NH2+]Cc2nc(-c3ccsc3)oc2C)c(C)o1 ZINC000348104648 335553680 /nfs/dbraw/zinc/55/36/80/335553680.db2.gz CEOHPXNBGZHZRY-LLVKDONJSA-N 1 2 316.426 4.772 20 0 DJADLO C[C@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1cc2ccccc2o1 ZINC000430757316 335732588 /nfs/dbraw/zinc/73/25/88/335732588.db2.gz VZWYNBVQJNXFTL-VIFPVBQESA-N 1 2 323.289 4.840 20 0 DJADLO c1cn2c(cccc2CNc2ccc(Oc3ccccc3)cc2)[nH+]1 ZINC000583656205 336027463 /nfs/dbraw/zinc/02/74/63/336027463.db2.gz KXRFGZPWUCKGEN-UHFFFAOYSA-N 1 2 315.376 4.739 20 0 DJADLO Cc1cc(C)cc(Oc2ccc(C[NH2+]Cc3cocn3)cc2C)c1 ZINC000192299966 336027668 /nfs/dbraw/zinc/02/76/68/336027668.db2.gz YNVOUNJJUHYHLD-UHFFFAOYSA-N 1 2 322.408 4.682 20 0 DJADLO CC(C)COc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1cocn1 ZINC000192321622 336031285 /nfs/dbraw/zinc/03/12/85/336031285.db2.gz LXUHZJIEYRPARS-GOSISDBHSA-N 1 2 316.445 4.586 20 0 DJADLO Cc1occc1C[N@H+](C)Cc1nc(-c2ccc(C)cc2)cs1 ZINC000351885230 336090832 /nfs/dbraw/zinc/09/08/32/336090832.db2.gz BDHOBKYOXXJQEL-UHFFFAOYSA-N 1 2 312.438 4.652 20 0 DJADLO Cc1occc1C[N@@H+](C)Cc1nc(-c2ccc(C)cc2)cs1 ZINC000351885230 336090834 /nfs/dbraw/zinc/09/08/34/336090834.db2.gz BDHOBKYOXXJQEL-UHFFFAOYSA-N 1 2 312.438 4.652 20 0 DJADLO CCSc1ccc([C@@H](C)[NH2+][C@@H](C)c2nc(C(C)C)no2)cc1 ZINC000103499703 336242001 /nfs/dbraw/zinc/24/20/01/336242001.db2.gz UWRRYGPGFGLYNB-OLZOCXBDSA-N 1 2 319.474 4.717 20 0 DJADLO Cc1ccc([C@@H]([NH2+]Cc2nnc(C(C)C)s2)C2CCCC2)o1 ZINC000580364233 336260268 /nfs/dbraw/zinc/26/02/68/336260268.db2.gz GQJAUELFSZKMOE-INIZCTEOSA-N 1 2 319.474 4.584 20 0 DJADLO Cc1cc2[nH+]cn(Cc3sccc3Br)c2cc1C ZINC000043531396 336263971 /nfs/dbraw/zinc/26/39/71/336263971.db2.gz DVCOYNOYDRCUBQ-UHFFFAOYSA-N 1 2 321.243 4.525 20 0 DJADLO Clc1ccc(Cl)c(C=C2CC[NH+](Cc3ccno3)CC2)c1 ZINC000532648283 336265661 /nfs/dbraw/zinc/26/56/61/336265661.db2.gz KMWOVIQNBZAHHO-UHFFFAOYSA-N 1 2 323.223 4.661 20 0 DJADLO Cc1cc(C[N@@H+]2CCCC[C@@H]2c2ccccc2C(F)(F)F)no1 ZINC000532691931 336266884 /nfs/dbraw/zinc/26/68/84/336266884.db2.gz DHGGXUCCFLVFSE-MRXNPFEDSA-N 1 2 324.346 4.729 20 0 DJADLO Cc1cc(C[N@H+]2CCCC[C@@H]2c2ccccc2C(F)(F)F)no1 ZINC000532691931 336266885 /nfs/dbraw/zinc/26/68/85/336266885.db2.gz DHGGXUCCFLVFSE-MRXNPFEDSA-N 1 2 324.346 4.729 20 0 DJADLO CC[N@H+](Cc1cc(C)on1)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000532714179 336267996 /nfs/dbraw/zinc/26/79/96/336267996.db2.gz GAQDDWYLEFPRKN-HXUWFJFHSA-N 1 2 324.399 4.734 20 0 DJADLO CC[N@@H+](Cc1cc(C)on1)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000532714179 336267997 /nfs/dbraw/zinc/26/79/97/336267997.db2.gz GAQDDWYLEFPRKN-HXUWFJFHSA-N 1 2 324.399 4.734 20 0 DJADLO Cc1oc(-c2ccccc2)nc1C[NH2+]C1(c2ccc(F)cc2)CC1 ZINC000532721753 336268386 /nfs/dbraw/zinc/26/83/86/336268386.db2.gz HSGVZWIWSXKZFX-UHFFFAOYSA-N 1 2 322.383 4.568 20 0 DJADLO Cc1nc(C[N@H+](Cc2ccccc2F)C2CCCCC2)oc1C ZINC000532741746 336269065 /nfs/dbraw/zinc/26/90/65/336269065.db2.gz QVJIKAPYSRZBIX-UHFFFAOYSA-N 1 2 316.420 4.765 20 0 DJADLO Cc1nc(C[N@@H+](Cc2ccccc2F)C2CCCCC2)oc1C ZINC000532741746 336269066 /nfs/dbraw/zinc/26/90/66/336269066.db2.gz QVJIKAPYSRZBIX-UHFFFAOYSA-N 1 2 316.420 4.765 20 0 DJADLO FC(F)(F)c1cscc1CNc1ccc(-n2cc[nH+]c2)cc1 ZINC000352836165 336272599 /nfs/dbraw/zinc/27/25/99/336272599.db2.gz RVORFQZAMXKAMH-UHFFFAOYSA-N 1 2 323.343 4.565 20 0 DJADLO COc1ccccc1[C@H]([NH2+]Cc1cccc(C)c1C)c1ccco1 ZINC000532866209 336273494 /nfs/dbraw/zinc/27/34/94/336273494.db2.gz RKKIFKOZDZIIDO-NRFANRHFSA-N 1 2 321.420 4.784 20 0 DJADLO CCc1cnc(C[N@H+](C)C/C=C\c2ccc(Cl)cc2)s1 ZINC000527048433 336281185 /nfs/dbraw/zinc/28/11/85/336281185.db2.gz OJEOQIREULYQKD-PLNGDYQASA-N 1 2 306.862 4.504 20 0 DJADLO CCc1cnc(C[N@@H+](C)C/C=C\c2ccc(Cl)cc2)s1 ZINC000527048433 336281186 /nfs/dbraw/zinc/28/11/86/336281186.db2.gz OJEOQIREULYQKD-PLNGDYQASA-N 1 2 306.862 4.504 20 0 DJADLO CSc1ccc(N[C@H](C)c2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000192901181 336282827 /nfs/dbraw/zinc/28/28/27/336282827.db2.gz DBGHOQLGPDIFLF-CQSZACIVSA-N 1 2 309.438 4.767 20 0 DJADLO Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)Nc1cccc[nH+]1 ZINC000301171781 336293296 /nfs/dbraw/zinc/29/32/96/336293296.db2.gz FHIDNRYXUTVCSJ-NSHDSACASA-N 1 2 313.401 4.826 20 0 DJADLO Cc1cc(N[C@@H](c2nccs2)c2ccccc2)nc(C(C)C)[nH+]1 ZINC000301187865 336294076 /nfs/dbraw/zinc/29/40/76/336294076.db2.gz KNRJRCOTXBCQMM-MRXNPFEDSA-N 1 2 324.453 4.566 20 0 DJADLO Cc1cc(N[C@H](C)c2nc(C(C)(C)C)cs2)nc(C(C)C)[nH+]1 ZINC000301197031 336294371 /nfs/dbraw/zinc/29/43/71/336294371.db2.gz OJHZISWPTXYLGC-GFCCVEGCSA-N 1 2 318.490 4.836 20 0 DJADLO c1ccc2c(c1)cccc2[C@@H]1CCCN1c1cc[nH+]c(C2CC2)n1 ZINC000301233393 336295978 /nfs/dbraw/zinc/29/59/78/336295978.db2.gz KJOJPXICFHGBMZ-IBGZPJMESA-N 1 2 315.420 4.849 20 0 DJADLO C[C@H](Nc1cc[nH+]c(C2CC2)n1)c1ccc(C(F)(F)F)cc1 ZINC000301240445 336296380 /nfs/dbraw/zinc/29/63/80/336296380.db2.gz MCSZSLZMEJUVLJ-JTQLQIEISA-N 1 2 307.319 4.546 20 0 DJADLO CCOc1cccc([C@H](C)Nc2cc(C(F)(F)F)cc[nH+]2)c1 ZINC000301501598 336310676 /nfs/dbraw/zinc/31/06/76/336310676.db2.gz GLELPBNIUWKHBO-NSHDSACASA-N 1 2 310.319 4.672 20 0 DJADLO CCOc1cccc([C@@H](C)Nc2cc(C(F)(F)F)cc[nH+]2)c1 ZINC000301501597 336310745 /nfs/dbraw/zinc/31/07/45/336310745.db2.gz GLELPBNIUWKHBO-LLVKDONJSA-N 1 2 310.319 4.672 20 0 DJADLO C[C@H](Nc1ccc2ccccc2[nH+]1)c1ccccc1-n1cccn1 ZINC000301646534 336320540 /nfs/dbraw/zinc/32/05/40/336320540.db2.gz NZJDAJCGISMZRP-HNNXBMFYSA-N 1 2 314.392 4.594 20 0 DJADLO Cc1cc(N[C@H]2CCOC3(CCCC3)C2)c2cccc(F)c2[nH+]1 ZINC000301694298 336323873 /nfs/dbraw/zinc/32/38/73/336323873.db2.gz MAVXTXIUNKGHOZ-AWEZNQCLSA-N 1 2 314.404 4.586 20 0 DJADLO COc1ccccc1[C@H]1CCN(c2[nH+]c3ccccc3cc2C)C1 ZINC000301707239 336324707 /nfs/dbraw/zinc/32/47/07/336324707.db2.gz GQEGVYJDLIUVSQ-KRWDZBQOSA-N 1 2 318.420 4.546 20 0 DJADLO Cc1cc2ccccc2[nH+]c1N[C@@H](C)C[C@H](O)c1cccs1 ZINC000301788617 336329957 /nfs/dbraw/zinc/32/99/57/336329957.db2.gz MGWBYAVBNVUPHR-BBRMVZONSA-N 1 2 312.438 4.529 20 0 DJADLO Cc1cc2ccccc2[nH+]c1N1C[C@@H](C)C[C@@H]1c1cccnc1 ZINC000302124394 336349720 /nfs/dbraw/zinc/34/97/20/336349720.db2.gz HSOOLLABSZILCA-IFXJQAMLSA-N 1 2 303.409 4.526 20 0 DJADLO Cc1cc2ccccc2[nH+]c1N[C@H]1CCO[C@@H](c2ccccc2)C1 ZINC000302157631 336351364 /nfs/dbraw/zinc/35/13/64/336351364.db2.gz FUQZQBSMGSTKIA-AZUAARDMSA-N 1 2 318.420 4.875 20 0 DJADLO Cc1cc(N[C@@H](C)c2c(C)cccc2C)nc(-c2cccnc2)[nH+]1 ZINC000302244069 336356084 /nfs/dbraw/zinc/35/60/84/336356084.db2.gz ZEZMFIBICGQWSM-INIZCTEOSA-N 1 2 318.424 4.637 20 0 DJADLO Cc1cc(N[C@H](C)c2cccc(Cl)c2)nc(-c2ccncc2)[nH+]1 ZINC000302709784 336365953 /nfs/dbraw/zinc/36/59/53/336365953.db2.gz HUOFAIRUBUAGPQ-CYBMUJFWSA-N 1 2 324.815 4.674 20 0 DJADLO Cc1ccc(NC(=O)C[C@H](C)Cc2ccc(Cl)cc2)c(C)[nH+]1 ZINC000536797703 336399215 /nfs/dbraw/zinc/39/92/15/336399215.db2.gz SOJKVNTVKBXNMR-GFCCVEGCSA-N 1 2 316.832 4.559 20 0 DJADLO C[C@@H]([NH2+]Cc1csc(C2CC2)n1)c1cc2cccc(F)c2o1 ZINC000353202179 336406403 /nfs/dbraw/zinc/40/64/03/336406403.db2.gz BBBFDGUCTOQWDE-SNVBAGLBSA-N 1 2 316.401 4.757 20 0 DJADLO Cc1cnc([C@@H](Nc2[nH+]ccc3ccc(F)cc32)C2CC2)s1 ZINC000354323980 336466752 /nfs/dbraw/zinc/46/67/52/336466752.db2.gz IXNIHFAFJARGSJ-HNNXBMFYSA-N 1 2 313.401 4.702 20 0 DJADLO Fc1ccc2cc[nH+]c(NCc3ncoc3-c3ccccc3)c2c1 ZINC000354549980 336474400 /nfs/dbraw/zinc/47/44/00/336474400.db2.gz XXCVIWDKRRVUCZ-UHFFFAOYSA-N 1 2 319.339 4.641 20 0 DJADLO Fc1ccc2cc[nH+]c(NCc3ccc4ccccc4n3)c2c1 ZINC000357166775 336575678 /nfs/dbraw/zinc/57/56/78/336575678.db2.gz AHFOXDAPRJEJTJ-UHFFFAOYSA-N 1 2 303.340 4.534 20 0 DJADLO Cc1ccc(-c2ccc(C(=O)Nc3ccc(C)[nH+]c3C)s2)o1 ZINC000359070362 336656201 /nfs/dbraw/zinc/65/62/01/336656201.db2.gz YOTQFZYSUHSHEL-UHFFFAOYSA-N 1 2 312.394 4.581 20 0 DJADLO Cc1nc([C@H](C)[NH2+][C@H](CC(F)(F)F)c2ccccc2)cs1 ZINC000361079121 336737538 /nfs/dbraw/zinc/73/75/38/336737538.db2.gz JWWABQNHQWWGOZ-GXFFZTMASA-N 1 2 314.376 4.796 20 0 DJADLO Fc1cc(Cl)ccc1C[NH+]1CCC(CC(F)(F)F)CC1 ZINC000582316439 336916899 /nfs/dbraw/zinc/91/68/99/336916899.db2.gz USAFMRHBHBBIGZ-UHFFFAOYSA-N 1 2 309.734 4.644 20 0 DJADLO C[C@H]([NH2+][C@H](c1ccsc1)c1ccc(Cl)cc1)c1ncc[nH]1 ZINC000375895872 337022453 /nfs/dbraw/zinc/02/24/53/337022453.db2.gz QNWVPZGAPUYTGC-NHYWBVRUSA-N 1 2 317.845 4.565 20 0 DJADLO C[C@H]([NH2+][C@H](c1cc2ccccc2o1)c1ccccc1)c1ncc[nH]1 ZINC000377126775 337047268 /nfs/dbraw/zinc/04/72/68/337047268.db2.gz LGSVFOAKQPWONT-LIRRHRJNSA-N 1 2 317.392 4.596 20 0 DJADLO C[C@H](N[C@H](c1cc2ccccc2o1)c1ccccc1)c1[nH]cc[nH+]1 ZINC000377126775 337047269 /nfs/dbraw/zinc/04/72/69/337047269.db2.gz LGSVFOAKQPWONT-LIRRHRJNSA-N 1 2 317.392 4.596 20 0 DJADLO CSc1ccc(C[N@@H+]2CCc3[nH]c4ccccc4c3C2)s1 ZINC000582578344 337107945 /nfs/dbraw/zinc/10/79/45/337107945.db2.gz WLPCGEPQNQMNMW-UHFFFAOYSA-N 1 2 314.479 4.510 20 0 DJADLO CSc1ccc(C[N@H+]2CCc3[nH]c4ccccc4c3C2)s1 ZINC000582578344 337107946 /nfs/dbraw/zinc/10/79/46/337107946.db2.gz WLPCGEPQNQMNMW-UHFFFAOYSA-N 1 2 314.479 4.510 20 0 DJADLO Cc1ccc(C)c(C[NH2+][C@H](C)c2nc(C3CCCCC3)no2)c1 ZINC000173867845 337138635 /nfs/dbraw/zinc/13/86/35/337138635.db2.gz UNRUAOJABURMQN-OAHLLOKOSA-N 1 2 313.445 4.585 20 0 DJADLO CC[C@H]([NH2+][C@H](C)c1ncc(-c2ccccc2)o1)c1nccs1 ZINC000174116289 337139300 /nfs/dbraw/zinc/13/93/00/337139300.db2.gz QFOKFYROYQVPTN-OCCSQVGLSA-N 1 2 313.426 4.600 20 0 DJADLO CC[C@@H]([NH2+][C@H](C)c1ncc(-c2ccccc2)o1)c1nccs1 ZINC000174116303 337139322 /nfs/dbraw/zinc/13/93/22/337139322.db2.gz QFOKFYROYQVPTN-TZMCWYRMSA-N 1 2 313.426 4.600 20 0 DJADLO Cc1cc(C[NH2+][C@H](C)c2nc(C3CCCCC3)no2)c(C)s1 ZINC000177795384 337157368 /nfs/dbraw/zinc/15/73/68/337157368.db2.gz HXYFPADVQOJSTC-GFCCVEGCSA-N 1 2 319.474 4.646 20 0 DJADLO CC[C@@H]([NH2+]Cc1csc(-c2ccco2)n1)c1ccccc1F ZINC000180787427 337177952 /nfs/dbraw/zinc/17/79/52/337177952.db2.gz CUMQCQSPBCPKGT-OAHLLOKOSA-N 1 2 316.401 4.783 20 0 DJADLO CCO[C@H](C)c1nc(CSCc2ccc(C)[nH+]c2C)cs1 ZINC000184824686 337200453 /nfs/dbraw/zinc/20/04/53/337200453.db2.gz QQIVFKUTIOUXHP-CYBMUJFWSA-N 1 2 322.499 4.686 20 0 DJADLO C[C@@H]([NH2+]Cc1cc(C(F)(F)F)ccc1Cl)c1cscn1 ZINC000583034600 337232033 /nfs/dbraw/zinc/23/20/33/337232033.db2.gz IWSLFAURGLISQI-MRVPVSSYSA-N 1 2 320.767 4.666 20 0 DJADLO COc1cc(C)ccc1[C@H](C)[NH2+]Cc1cc(-c2ccccc2)on1 ZINC000583178802 337255601 /nfs/dbraw/zinc/25/56/01/337255601.db2.gz OVQKAQWOJOTEGP-HNNXBMFYSA-N 1 2 322.408 4.509 20 0 DJADLO Cc1nc([C@@H]2CCC[N@H+]2Cc2ccccc2OC(C)C)cs1 ZINC000189757396 337282604 /nfs/dbraw/zinc/28/26/04/337282604.db2.gz OHIMLSQTTCBODD-KRWDZBQOSA-N 1 2 316.470 4.576 20 0 DJADLO Cc1nc([C@@H]2CCC[N@@H+]2Cc2ccccc2OC(C)C)cs1 ZINC000189757396 337282605 /nfs/dbraw/zinc/28/26/05/337282605.db2.gz OHIMLSQTTCBODD-KRWDZBQOSA-N 1 2 316.470 4.576 20 0 DJADLO Cc1c([C@H](C)[NH2+][C@@H](c2ccco2)c2ccccc2)cnn1C(C)C ZINC000191134108 337294433 /nfs/dbraw/zinc/29/44/33/337294433.db2.gz QYGRSYFUZINNKC-MGPUTAFESA-N 1 2 323.440 4.806 20 0 DJADLO C[C@H]([NH2+][C@@H](c1cccc(Cl)c1)c1ccccn1)c1ccco1 ZINC000124598105 337406215 /nfs/dbraw/zinc/40/62/15/337406215.db2.gz MGVIUJCCADRPQT-UGSOOPFHSA-N 1 2 312.800 4.768 20 0 DJADLO Cc1[nH+]c(C(C)C)ccc1CSCc1nccn1C(F)F ZINC000419410882 337482632 /nfs/dbraw/zinc/48/26/32/337482632.db2.gz ARPVDEZDVQCZHP-UHFFFAOYSA-N 1 2 311.401 4.538 20 0 DJADLO Cc1cc(N[C@@H](C)c2cnn(C(C)C)c2)c2cccc(F)c2[nH+]1 ZINC000514702203 337495821 /nfs/dbraw/zinc/49/58/21/337495821.db2.gz UTCAIBRMHMZVBW-ZDUSSCGKSA-N 1 2 312.392 4.633 20 0 DJADLO Cc1nc(C[NH+](Cc2cccs2)Cc2cccs2)oc1C ZINC000066411559 337541814 /nfs/dbraw/zinc/54/18/14/337541814.db2.gz JDWDVZRUTIVTAG-UHFFFAOYSA-N 1 2 318.467 4.617 20 0 DJADLO CCOc1ccc(Cl)cc1[C@@H](C)[NH2+][C@@H](C)c1nc(C)cs1 ZINC000162339612 337615026 /nfs/dbraw/zinc/61/50/26/337615026.db2.gz MYVLMVUIEFHAKF-NEPJUHHUSA-N 1 2 324.877 4.915 20 0 DJADLO Cc1ccccc1[C@H](CC(F)(F)F)[NH2+][C@@H](C)c1cscn1 ZINC000572469118 337666561 /nfs/dbraw/zinc/66/65/61/337666561.db2.gz XBSNBLLMYCZPES-AAEUAGOBSA-N 1 2 314.376 4.796 20 0 DJADLO C[C@H]1C[C@@H](Nc2ccc3c(c2)CC[NH2+]3)c2ccsc2S1 ZINC000423215248 337704808 /nfs/dbraw/zinc/70/48/08/337704808.db2.gz MRCLKLPHMYQADB-ZUZCIYMTSA-N 1 2 302.468 4.754 20 0 DJADLO CCSCc1cc[nH+]c(NCc2ccc(C(F)F)cc2)c1 ZINC000527232423 337739430 /nfs/dbraw/zinc/73/94/30/337739430.db2.gz QYVXVJMCJZSNFG-UHFFFAOYSA-N 1 2 308.397 4.884 20 0 DJADLO CC(C)c1nc([C@@H](C)[NH2+]Cc2ccc(F)c(Cl)c2)cs1 ZINC000162805036 337757580 /nfs/dbraw/zinc/75/75/80/337757580.db2.gz AORBJFVJDVAZOA-SNVBAGLBSA-N 1 2 312.841 4.910 20 0 DJADLO CCCCc1noc(C[NH2+][C@@H](CC(C)C)c2ccccc2C)n1 ZINC000537058612 337883129 /nfs/dbraw/zinc/88/31/29/337883129.db2.gz MULYHHFVCIFXMB-KRWDZBQOSA-N 1 2 315.461 4.598 20 0 DJADLO Cc1ccccc1-c1nc(C[NH2+][C@@H](c2ccccc2)C(C)C)no1 ZINC000121372791 337890816 /nfs/dbraw/zinc/89/08/16/337890816.db2.gz GWYVZVDOLXSFRB-LJQANCHMSA-N 1 2 321.424 4.532 20 0 DJADLO Cc1cccc([C@@H]2CCCCCN2C(=O)Nc2cc[nH+]cc2C)c1 ZINC000121536121 337895079 /nfs/dbraw/zinc/89/50/79/337895079.db2.gz FHGZORGPIBPOHA-IBGZPJMESA-N 1 2 323.440 4.848 20 0 DJADLO Cc1cccc([C@@H]2CCCCN2C(=O)Nc2cc[nH+]cc2C)c1C ZINC000121860303 337899958 /nfs/dbraw/zinc/89/99/58/337899958.db2.gz GCWOAILHTBGGEL-IBGZPJMESA-N 1 2 323.440 4.766 20 0 DJADLO C[C@@H](Nc1cccc([NH+]2CCCCCC2)c1)c1ccc(F)cn1 ZINC000537537853 337941410 /nfs/dbraw/zinc/94/14/10/337941410.db2.gz UQXONRQAGMJDRK-OAHLLOKOSA-N 1 2 313.420 4.774 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1cscn1)c1cc(Cl)sc1Cl ZINC000514799323 337971781 /nfs/dbraw/zinc/97/17/81/337971781.db2.gz QUOZUFGKTPLAHT-RQJHMYQMSA-N 1 2 307.271 4.923 20 0 DJADLO Fc1cccc(Cl)c1C[NH2+][C@H](c1ncc[nH]1)C1CCCCC1 ZINC000515239424 337983613 /nfs/dbraw/zinc/98/36/13/337983613.db2.gz GDXWPVFVTSTZNQ-INIZCTEOSA-N 1 2 321.827 4.613 20 0 DJADLO Cc1nc([C@H](C)[NH2+]C(c2ccccc2)c2ccccc2)cs1 ZINC000315381561 337985854 /nfs/dbraw/zinc/98/58/54/337985854.db2.gz DNAYDRAPHQCLFS-AWEZNQCLSA-N 1 2 308.450 4.892 20 0 DJADLO c1c[nH]c([C@H]([NH2+]Cc2ccc3sccc3c2)c2ccccc2)n1 ZINC000515493282 337990876 /nfs/dbraw/zinc/99/08/76/337990876.db2.gz PNNFVFLTBVWCOM-GOSISDBHSA-N 1 2 319.433 4.504 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)c1ccc(C(C)C)c(Cl)c1 ZINC000425594801 338015809 /nfs/dbraw/zinc/01/58/09/338015809.db2.gz GWQAVGMDBAKWTI-UHFFFAOYSA-N 1 2 302.805 4.728 20 0 DJADLO CCCc1nc(C)c(C[N@H+](C)[C@@H](C)c2ccccc2Cl)o1 ZINC000428461443 338053415 /nfs/dbraw/zinc/05/34/15/338053415.db2.gz QCROYQQTFHRMGF-ZDUSSCGKSA-N 1 2 306.837 4.782 20 0 DJADLO CCCc1nc(C)c(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)o1 ZINC000428461443 338053416 /nfs/dbraw/zinc/05/34/16/338053416.db2.gz QCROYQQTFHRMGF-ZDUSSCGKSA-N 1 2 306.837 4.782 20 0 DJADLO C[C@H]([NH2+]Cc1nc2ccc(F)cc2s1)c1cccc(F)c1F ZINC000428869488 338063571 /nfs/dbraw/zinc/06/35/71/338063571.db2.gz BBPZMBMHMOJMPZ-VIFPVBQESA-N 1 2 322.355 4.564 20 0 DJADLO Cc1ccoc1C[N@@H+](C)[C@@H](C)c1nc2ccccc2n1C(F)F ZINC000429370603 338078874 /nfs/dbraw/zinc/07/88/74/338078874.db2.gz WKEDXXAKQCWMRM-LBPRGKRZSA-N 1 2 319.355 4.526 20 0 DJADLO Cc1ccoc1C[N@H+](C)[C@@H](C)c1nc2ccccc2n1C(F)F ZINC000429370603 338078875 /nfs/dbraw/zinc/07/88/75/338078875.db2.gz WKEDXXAKQCWMRM-LBPRGKRZSA-N 1 2 319.355 4.526 20 0 DJADLO Cc1ccoc1C[N@H+](C)Cc1nc(-c2ccc(C)cc2)cs1 ZINC000429407474 338079934 /nfs/dbraw/zinc/07/99/34/338079934.db2.gz NZVAUMODIKQEPY-UHFFFAOYSA-N 1 2 312.438 4.652 20 0 DJADLO Cc1ccoc1C[N@@H+](C)Cc1nc(-c2ccc(C)cc2)cs1 ZINC000429407474 338079935 /nfs/dbraw/zinc/07/99/35/338079935.db2.gz NZVAUMODIKQEPY-UHFFFAOYSA-N 1 2 312.438 4.652 20 0 DJADLO CC(C)(C)c1cc(C[NH2+]C(C)(C)c2cccc(Cl)c2)no1 ZINC000429690997 338087551 /nfs/dbraw/zinc/08/75/51/338087551.db2.gz KUGGZNCXGBHEJD-UHFFFAOYSA-N 1 2 306.837 4.650 20 0 DJADLO C[C@@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1ccc(Cl)s1 ZINC000429784691 338089926 /nfs/dbraw/zinc/08/99/26/338089926.db2.gz JYVFWEBRRIONHD-ZCFIWIBFSA-N 1 2 323.742 4.809 20 0 DJADLO COc1cc(C)[nH+]c(CNc2cccc(-c3ccccc3)c2)c1 ZINC000431090279 338122156 /nfs/dbraw/zinc/12/21/56/338122156.db2.gz JVOYHVDRDOUCRR-UHFFFAOYSA-N 1 2 304.393 4.678 20 0 DJADLO Fc1ccc(C[NH2+]Cc2ccc(F)c(Cl)c2Cl)c(F)c1 ZINC000432229949 338149256 /nfs/dbraw/zinc/14/92/56/338149256.db2.gz WJTUQTNXGCDBIK-UHFFFAOYSA-N 1 2 320.141 4.701 20 0 DJADLO CC[C@H]([NH2+]Cc1csc(Cl)c1Cl)c1nccs1 ZINC000432237309 338149693 /nfs/dbraw/zinc/14/96/93/338149693.db2.gz FEAJFEODYFFSBF-QMMMGPOBSA-N 1 2 307.271 4.752 20 0 DJADLO Cc1csc([C@H](C)[NH2+]Cc2csc(Cl)c2Cl)n1 ZINC000432242644 338150111 /nfs/dbraw/zinc/15/01/11/338150111.db2.gz MUULJMCHYFIGMJ-ZETCQYMHSA-N 1 2 307.271 4.671 20 0 DJADLO CC[C@](C)([NH2+]Cc1csc(Cl)c1Cl)c1nccs1 ZINC000432241908 338150119 /nfs/dbraw/zinc/15/01/19/338150119.db2.gz UEKNZWVMSMOXMQ-LBPRGKRZSA-N 1 2 321.298 4.926 20 0 DJADLO CC[C@@](C)([NH2+]Cc1csc(Cl)c1Cl)c1nccs1 ZINC000432241907 338150122 /nfs/dbraw/zinc/15/01/22/338150122.db2.gz UEKNZWVMSMOXMQ-GFCCVEGCSA-N 1 2 321.298 4.926 20 0 DJADLO Cc1cnc([C@@H](C)[NH2+]Cc2csc(Cl)c2Cl)s1 ZINC000432250169 338150840 /nfs/dbraw/zinc/15/08/40/338150840.db2.gz JCCFOXGUCRKAEM-SSDOTTSWSA-N 1 2 307.271 4.671 20 0 DJADLO Cc1csc(C(C)(C)[NH2+]Cc2csc(Cl)c2Cl)n1 ZINC000432250881 338150886 /nfs/dbraw/zinc/15/08/86/338150886.db2.gz OBEPIRRNZZSJGU-UHFFFAOYSA-N 1 2 321.298 4.845 20 0 DJADLO Clc1scc(C[NH2+][C@H]2CSc3ccccc32)c1Cl ZINC000432255472 338151370 /nfs/dbraw/zinc/15/13/70/338151370.db2.gz PVVQNGHDKWCGIV-JTQLQIEISA-N 1 2 316.278 4.992 20 0 DJADLO Cn1cccc1[C@@H]1CCC[N@@H+]1Cc1csc(Cl)c1Cl ZINC000432748554 338166102 /nfs/dbraw/zinc/16/61/02/338166102.db2.gz PMXWNCALBMHUJL-LBPRGKRZSA-N 1 2 315.269 4.731 20 0 DJADLO Cn1cccc1[C@@H]1CCC[N@H+]1Cc1csc(Cl)c1Cl ZINC000432748554 338166103 /nfs/dbraw/zinc/16/61/03/338166103.db2.gz PMXWNCALBMHUJL-LBPRGKRZSA-N 1 2 315.269 4.731 20 0 DJADLO C[C@H](c1cccnc1)[N@H+](C)Cc1csc(Cl)c1Cl ZINC000432916536 338172890 /nfs/dbraw/zinc/17/28/90/338172890.db2.gz IBLQHWYMRACRSW-SECBINFHSA-N 1 2 301.242 4.643 20 0 DJADLO C[C@H](c1cccnc1)[N@@H+](C)Cc1csc(Cl)c1Cl ZINC000432916536 338172891 /nfs/dbraw/zinc/17/28/91/338172891.db2.gz IBLQHWYMRACRSW-SECBINFHSA-N 1 2 301.242 4.643 20 0 DJADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1csc(Cl)c1Cl ZINC000432915977 338172899 /nfs/dbraw/zinc/17/28/99/338172899.db2.gz GJBDREPLTVLUJN-VIFPVBQESA-N 1 2 301.242 4.643 20 0 DJADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1csc(Cl)c1Cl ZINC000432915977 338172900 /nfs/dbraw/zinc/17/29/00/338172900.db2.gz GJBDREPLTVLUJN-VIFPVBQESA-N 1 2 301.242 4.643 20 0 DJADLO CC(C)O[C@@H](C[NH2+][C@@H](c1ccccc1)C(F)F)c1ccccc1 ZINC000433052556 338178848 /nfs/dbraw/zinc/17/88/48/338178848.db2.gz MRJXGWIEUYSTGT-ROUUACIJSA-N 1 2 319.395 4.749 20 0 DJADLO Cc1ccc(C)c([C@H]([NH2+]Cc2nccs2)c2ccccc2)c1 ZINC000194293718 338190546 /nfs/dbraw/zinc/19/05/46/338190546.db2.gz XTCIPPZDCAOKOR-LJQANCHMSA-N 1 2 308.450 4.639 20 0 DJADLO C[C@@H]([NH2+]Cc1ncc(C(F)(F)F)s1)c1ccc(Cl)cc1 ZINC000433325227 338192435 /nfs/dbraw/zinc/19/24/35/338192435.db2.gz HQHWJPLJXROHRS-MRVPVSSYSA-N 1 2 320.767 4.666 20 0 DJADLO Clc1ccc(NCc2cc(-n3cc[nH+]c3)cs2)cc1Cl ZINC000433345107 338193520 /nfs/dbraw/zinc/19/35/20/338193520.db2.gz VRXQOFTTWIXIJV-UHFFFAOYSA-N 1 2 324.236 4.853 20 0 DJADLO Cc1cc(N[C@@H](C)c2cccc(OCc3ccccc3)c2)nc[nH+]1 ZINC000433817925 338202711 /nfs/dbraw/zinc/20/27/11/338202711.db2.gz BSUNWBDSIJNHIL-INIZCTEOSA-N 1 2 319.408 4.537 20 0 DJADLO Cc1cc(F)ccc1C(=O)Nc1ccc2[nH]c(C3CCC3)[nH+]c2c1 ZINC000434179750 338211732 /nfs/dbraw/zinc/21/17/32/338211732.db2.gz NCJYPCFDTNVRLH-UHFFFAOYSA-N 1 2 323.371 4.530 20 0 DJADLO CC(C)(C)c1ccccc1C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000434194969 338212086 /nfs/dbraw/zinc/21/20/86/338212086.db2.gz UNKSCWKWJHINGQ-UHFFFAOYSA-N 1 2 319.408 4.627 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1nccs1)c1cc(Cl)sc1Cl ZINC000153352979 338222955 /nfs/dbraw/zinc/22/29/55/338222955.db2.gz NVHGOVSXORHLKW-RQJHMYQMSA-N 1 2 307.271 4.923 20 0 DJADLO CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)[NH+]1Cc2ccccc2C1 ZINC000155529002 338287760 /nfs/dbraw/zinc/28/77/60/338287760.db2.gz YXBWUNYDQHAYAN-JKSUJKDBSA-N 1 2 322.452 4.543 20 0 DJADLO Cc1cccc([C@H](C)SCc2[nH+]ccn2CC(F)(F)F)c1 ZINC000437418067 338309537 /nfs/dbraw/zinc/30/95/37/338309537.db2.gz LKQFSBXUAZXTIT-LBPRGKRZSA-N 1 2 314.376 4.748 20 0 DJADLO Cc1ccc(NCc2c[nH+]cn2Cc2ccccc2)cc1Cl ZINC000438327623 338339707 /nfs/dbraw/zinc/33/97/07/338339707.db2.gz XZRNTUHNTHVDTH-UHFFFAOYSA-N 1 2 311.816 4.505 20 0 DJADLO CSc1ccccc1[C@H](C)[NH2+][C@@H](C)c1nc(C(C)(C)C)no1 ZINC000440633860 338393333 /nfs/dbraw/zinc/39/33/33/338393333.db2.gz FRFDIIXEQSWEEO-RYUDHWBXSA-N 1 2 319.474 4.501 20 0 DJADLO CCC(CC)n1ccc(C[N@H+]([C@H](C)c2ccco2)C2CC2)n1 ZINC000440907456 338399750 /nfs/dbraw/zinc/39/97/50/338399750.db2.gz KQZHDPSNBOOFIH-CQSZACIVSA-N 1 2 301.434 4.563 20 0 DJADLO CCC(CC)n1ccc(C[N@@H+]([C@H](C)c2ccco2)C2CC2)n1 ZINC000440907456 338399751 /nfs/dbraw/zinc/39/97/51/338399751.db2.gz KQZHDPSNBOOFIH-CQSZACIVSA-N 1 2 301.434 4.563 20 0 DJADLO C[C@H](CCC(=O)Nc1cccc(-c2[nH]cc[nH+]2)c1)c1ccccc1 ZINC000442142672 338421853 /nfs/dbraw/zinc/42/18/53/338421853.db2.gz VUORVOBZXBOEMJ-OAHLLOKOSA-N 1 2 319.408 4.599 20 0 DJADLO Cc1ccc(NC(=O)[C@H]2C[C@H]2c2ccc3ccccc3c2)c(C)[nH+]1 ZINC000446437387 338528198 /nfs/dbraw/zinc/52/81/98/338528198.db2.gz HKQLWYLTCJIVLB-OALUTQOASA-N 1 2 316.404 4.594 20 0 DJADLO CCc1ccc(N[C@@H](c2[nH]cc[nH+]2)c2ccc(F)cc2)cc1C ZINC000446930250 338540966 /nfs/dbraw/zinc/54/09/66/338540966.db2.gz VLGBCWZLADGMDN-GOSISDBHSA-N 1 2 309.388 4.621 20 0 DJADLO Cc1ccc(NC(=O)N[C@H](c2ccccc2)C(C)(C)C)c(C)[nH+]1 ZINC000447196730 338547372 /nfs/dbraw/zinc/54/73/72/338547372.db2.gz WENCIPVGZDUXEC-QGZVFWFLSA-N 1 2 311.429 4.607 20 0 DJADLO CCn1ccnc1[C@H](C)[NH2+]Cc1ccc(-c2ccccc2)cc1F ZINC000449562007 338637841 /nfs/dbraw/zinc/63/78/41/338637841.db2.gz GOAADOFZMURVIL-HNNXBMFYSA-N 1 2 323.415 4.560 20 0 DJADLO C[C@H]1C[C@@H](Nc2ccc(C(C)(C)C(F)(F)F)cc2)c2[nH+]ccn21 ZINC000453201872 338807144 /nfs/dbraw/zinc/80/71/44/338807144.db2.gz CRRJVQSXBYSXMZ-SMDDNHRTSA-N 1 2 323.362 4.841 20 0 DJADLO CCCc1ncc(C[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)o1 ZINC000453384847 338835894 /nfs/dbraw/zinc/83/58/94/338835894.db2.gz NICDCAHWVHVPTE-JTQLQIEISA-N 1 2 313.228 4.785 20 0 DJADLO CCc1ncc(C[NH2+][C@@H](c2cccc(C)c2)c2cccc(F)c2)o1 ZINC000453394088 338837264 /nfs/dbraw/zinc/83/72/64/338837264.db2.gz RXYQXSYZLKWZON-FQEVSTJZSA-N 1 2 324.399 4.564 20 0 DJADLO C[C@H](c1nc(C2CC2)no1)[N@@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC000459578134 339037033 /nfs/dbraw/zinc/03/70/33/339037033.db2.gz XHCNZGJAIHFZSA-RHSMWYFYSA-N 1 2 323.440 4.625 20 0 DJADLO C[C@H](c1nc(C2CC2)no1)[N@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC000459578134 339037034 /nfs/dbraw/zinc/03/70/34/339037034.db2.gz XHCNZGJAIHFZSA-RHSMWYFYSA-N 1 2 323.440 4.625 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1nc2c(s1)CCC2)c1cccc(Cl)c1F ZINC000459631902 339039312 /nfs/dbraw/zinc/03/93/12/339039312.db2.gz LXXLTSGHUSSJBP-ZJUUUORDSA-N 1 2 324.852 4.836 20 0 DJADLO CC1(CC(F)(F)F)C[NH+](Cc2ccc(C(F)(F)F)s2)C1 ZINC000459645097 339040054 /nfs/dbraw/zinc/04/00/54/339040054.db2.gz YFSAYQGJAXGGNH-UHFFFAOYSA-N 1 2 317.298 4.541 20 0 DJADLO CCCC[C@H](C)N(C)C(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000461418560 339063597 /nfs/dbraw/zinc/06/35/97/339063597.db2.gz MMSAKWOEIRZUPS-HNNXBMFYSA-N 1 2 312.413 4.525 20 0 DJADLO Cc1nc(N[C@@H](CCc2ccccc2)c2ccccc2)cc[nH+]1 ZINC000462385988 339077819 /nfs/dbraw/zinc/07/78/19/339077819.db2.gz CAJNVEULYDATSJ-IBGZPJMESA-N 1 2 303.409 4.571 20 0 DJADLO COc1ccccc1[C@H](C)SCc1cn2cccc(C)c2[nH+]1 ZINC000463188582 339108672 /nfs/dbraw/zinc/10/86/72/339108672.db2.gz DAZGSDRRKFZYGP-AWEZNQCLSA-N 1 2 312.438 4.646 20 0 DJADLO Cc1cnc(C[N@@H+](Cc2ccccc2)[C@@H](C)c2ccccc2)nc1 ZINC000463233810 339110725 /nfs/dbraw/zinc/11/07/25/339110725.db2.gz FKYNDPDZOTVWMU-SFHVURJKSA-N 1 2 317.436 4.548 20 0 DJADLO Cc1cnc(C[N@H+](Cc2ccccc2)[C@@H](C)c2ccccc2)nc1 ZINC000463233810 339110726 /nfs/dbraw/zinc/11/07/26/339110726.db2.gz FKYNDPDZOTVWMU-SFHVURJKSA-N 1 2 317.436 4.548 20 0 DJADLO Cc1cc(F)cc(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)c1 ZINC000463836677 339126964 /nfs/dbraw/zinc/12/69/64/339126964.db2.gz NSKUETZJIKIHLT-UHFFFAOYSA-N 1 2 322.339 4.574 20 0 DJADLO FC(F)(F)C1CC[NH+](Cc2c(Cl)cccc2Cl)CC1 ZINC000464769424 339152072 /nfs/dbraw/zinc/15/20/72/339152072.db2.gz HZVPNIZLCNCAEA-UHFFFAOYSA-N 1 2 312.162 4.768 20 0 DJADLO CC[C@H]1C[N@H+](Cc2csc(C3CCCCC3)n2)CCS1 ZINC000464791233 339154051 /nfs/dbraw/zinc/15/40/51/339154051.db2.gz LUBKVJLNWRERDN-HNNXBMFYSA-N 1 2 310.532 4.518 20 0 DJADLO CC[C@H]1C[N@@H+](Cc2csc(C3CCCCC3)n2)CCS1 ZINC000464791233 339154052 /nfs/dbraw/zinc/15/40/52/339154052.db2.gz LUBKVJLNWRERDN-HNNXBMFYSA-N 1 2 310.532 4.518 20 0 DJADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2ccn(C(C)C)n2)o1 ZINC000464851665 339157897 /nfs/dbraw/zinc/15/78/97/339157897.db2.gz QLEGFLAPYOERFW-MAUKXSAKSA-N 1 2 315.461 4.593 20 0 DJADLO CCc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2ccn(C(C)C)n2)o1 ZINC000464851665 339157898 /nfs/dbraw/zinc/15/78/98/339157898.db2.gz QLEGFLAPYOERFW-MAUKXSAKSA-N 1 2 315.461 4.593 20 0 DJADLO CCc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2ccn(C(C)C)n2)o1 ZINC000464851662 339157990 /nfs/dbraw/zinc/15/79/90/339157990.db2.gz QLEGFLAPYOERFW-CRAIPNDOSA-N 1 2 315.461 4.593 20 0 DJADLO CCc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2ccn(C(C)C)n2)o1 ZINC000464851662 339157991 /nfs/dbraw/zinc/15/79/91/339157991.db2.gz QLEGFLAPYOERFW-CRAIPNDOSA-N 1 2 315.461 4.593 20 0 DJADLO CC(C)c1cnc(CNc2ccc(-c3ccccc3)c[nH+]2)s1 ZINC000466617776 339210529 /nfs/dbraw/zinc/21/05/29/339210529.db2.gz RMFZZTPCBRFUMX-UHFFFAOYSA-N 1 2 309.438 4.941 20 0 DJADLO Cc1ccc[nH+]c1[C@@H]1CCC[C@H](Nc2ccccc2N(C)C)C1 ZINC000467334062 339232108 /nfs/dbraw/zinc/23/21/08/339232108.db2.gz MMMAHHZHMGCRNI-SJORKVTESA-N 1 2 309.457 4.594 20 0 DJADLO Cc1ccc[nH+]c1[C@@H]1CCC[C@H](Nc2cnn([C@@H](C)C3CC3)c2)C1 ZINC000467349371 339233207 /nfs/dbraw/zinc/23/32/07/339233207.db2.gz JALOCYBHBQQZMT-JQHSSLGASA-N 1 2 324.472 4.696 20 0 DJADLO COCCc1ccccc1N[C@@H]1CCC[C@@H](c2[nH+]cccc2C)C1 ZINC000467360690 339234046 /nfs/dbraw/zinc/23/40/46/339234046.db2.gz ZFCJZEDFQFQIRW-RTBURBONSA-N 1 2 324.468 4.717 20 0 DJADLO COCc1cccc(N[C@H]2CCC[C@@H](c3[nH+]cccc3C)C2)c1 ZINC000467374639 339235207 /nfs/dbraw/zinc/23/52/07/339235207.db2.gz ZFZQCTLNODOGGD-MJGOQNOKSA-N 1 2 310.441 4.675 20 0 DJADLO C[C@H]1C[C@@H](c2ccccc2)CC[N@@H+]1Cc1ncc(Cl)s1 ZINC000467549821 339241815 /nfs/dbraw/zinc/24/18/15/339241815.db2.gz CWPQKXWIYVXJKM-JSGCOSHPSA-N 1 2 306.862 4.565 20 0 DJADLO C[C@H]1C[C@@H](c2ccccc2)CC[N@H+]1Cc1ncc(Cl)s1 ZINC000467549821 339241816 /nfs/dbraw/zinc/24/18/16/339241816.db2.gz CWPQKXWIYVXJKM-JSGCOSHPSA-N 1 2 306.862 4.565 20 0 DJADLO C[C@@H](Sc1ccccc1)c1ccc(NCc2[nH+]ccn2C)cc1 ZINC000467759141 339245927 /nfs/dbraw/zinc/24/59/27/339245927.db2.gz RHABFANMAJFVOX-OAHLLOKOSA-N 1 2 323.465 4.886 20 0 DJADLO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(Cl)ccc2F)o1 ZINC000468693400 339268812 /nfs/dbraw/zinc/26/88/12/339268812.db2.gz JCARMXAVKMHRHB-INIZCTEOSA-N 1 2 323.795 4.556 20 0 DJADLO COCc1ccc([C@@H]2CCC[N@H+]2Cc2cc(Cl)ccc2F)o1 ZINC000468693400 339268813 /nfs/dbraw/zinc/26/88/13/339268813.db2.gz JCARMXAVKMHRHB-INIZCTEOSA-N 1 2 323.795 4.556 20 0 DJADLO C[C@@H]1CCC[C@H]1CC(=O)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000469485321 339291238 /nfs/dbraw/zinc/29/12/38/339291238.db2.gz FKESQSMADPYXQS-CABCVRRESA-N 1 2 310.397 4.639 20 0 DJADLO C[C@H]1CCC[C@@H]1CC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000469508643 339292119 /nfs/dbraw/zinc/29/21/19/339292119.db2.gz NTMWMGYQILKTDY-LSDHHAIUSA-N 1 2 310.397 4.639 20 0 DJADLO CSc1ccc(F)cc1C[NH2+][C@H](C)c1csc(C(C)C)n1 ZINC000469773852 339298832 /nfs/dbraw/zinc/29/88/32/339298832.db2.gz BVGVVTCDWAWCAE-LLVKDONJSA-N 1 2 324.490 4.978 20 0 DJADLO COc1ccc(C2([NH2+][C@H](C)c3csc(C(C)C)n3)CC2)cc1 ZINC000469804833 339301264 /nfs/dbraw/zinc/30/12/64/339301264.db2.gz SXJOXJJOEMJLQJ-CYBMUJFWSA-N 1 2 316.470 4.615 20 0 DJADLO C[C@H](c1ccc(F)c(F)c1)[N@@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000470191425 339313474 /nfs/dbraw/zinc/31/34/74/339313474.db2.gz WHVRGXWSZYNVTO-QFSBIZTOSA-N 1 2 323.408 4.549 20 0 DJADLO C[C@H](c1ccc(F)c(F)c1)[N@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000470191425 339313475 /nfs/dbraw/zinc/31/34/75/339313475.db2.gz WHVRGXWSZYNVTO-QFSBIZTOSA-N 1 2 323.408 4.549 20 0 DJADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000470191423 339313538 /nfs/dbraw/zinc/31/35/38/339313538.db2.gz WHVRGXWSZYNVTO-PEBVRCNWSA-N 1 2 323.408 4.549 20 0 DJADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000470191423 339313539 /nfs/dbraw/zinc/31/35/39/339313539.db2.gz WHVRGXWSZYNVTO-PEBVRCNWSA-N 1 2 323.408 4.549 20 0 DJADLO C[C@@H](c1cc(F)ccc1F)[N@@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000470209928 339314374 /nfs/dbraw/zinc/31/43/74/339314374.db2.gz PHEQEWPQESRILN-PEBVRCNWSA-N 1 2 323.408 4.549 20 0 DJADLO C[C@@H](c1cc(F)ccc1F)[N@H+]1C[C@@H](C)O[C@H](c2ccsc2)C1 ZINC000470209928 339314375 /nfs/dbraw/zinc/31/43/75/339314375.db2.gz PHEQEWPQESRILN-PEBVRCNWSA-N 1 2 323.408 4.549 20 0 DJADLO CCC(CC)[C@H](c1ccc(Cl)cc1)[N@H+](C)Cc1noc(C)n1 ZINC000470933293 339331546 /nfs/dbraw/zinc/33/15/46/339331546.db2.gz RDMUGCUAHOMZHI-QGZVFWFLSA-N 1 2 321.852 4.641 20 0 DJADLO CCC(CC)[C@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1noc(C)n1 ZINC000470933293 339331547 /nfs/dbraw/zinc/33/15/47/339331547.db2.gz RDMUGCUAHOMZHI-QGZVFWFLSA-N 1 2 321.852 4.641 20 0 DJADLO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1csc(C2CCCC2)n1 ZINC000470952047 339332366 /nfs/dbraw/zinc/33/23/66/339332366.db2.gz ZYWIGODDOOFYRY-GXFFZTMASA-N 1 2 318.408 4.573 20 0 DJADLO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1csc(C2CCCC2)n1 ZINC000470952047 339332367 /nfs/dbraw/zinc/33/23/67/339332367.db2.gz ZYWIGODDOOFYRY-GXFFZTMASA-N 1 2 318.408 4.573 20 0 DJADLO O=C(Nc1ccc(-c2[nH]cc[nH+]2)cc1)c1ccc2sccc2c1 ZINC000471020224 339334595 /nfs/dbraw/zinc/33/45/95/339334595.db2.gz VRANBZKOKWORCF-UHFFFAOYSA-N 1 2 319.389 4.544 20 0 DJADLO Cc1ccc2[nH]c(CNc3ccc(-n4cc[nH+]c4)cc3)cc2c1C ZINC000472067992 339362026 /nfs/dbraw/zinc/36/20/26/339362026.db2.gz LZWSSYWKTNZEGX-UHFFFAOYSA-N 1 2 316.408 4.583 20 0 DJADLO C[C@H]([NH2+]Cc1ncc(Cl)s1)c1cc(Cl)ccc1Cl ZINC000472077547 339362872 /nfs/dbraw/zinc/36/28/72/339362872.db2.gz IHFFVOPUHRMNFV-ZETCQYMHSA-N 1 2 321.660 4.954 20 0 DJADLO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2ncc(Cl)s2)C1 ZINC000473137959 339382026 /nfs/dbraw/zinc/38/20/26/339382026.db2.gz BTDDDCPOJUGDDW-MFKMUULPSA-N 1 2 310.825 4.519 20 0 DJADLO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2ncc(Cl)s2)C1 ZINC000473137959 339382027 /nfs/dbraw/zinc/38/20/27/339382027.db2.gz BTDDDCPOJUGDDW-MFKMUULPSA-N 1 2 310.825 4.519 20 0 DJADLO Clc1cnc(C[N@H+](C2CC2)[C@@H]2CCCc3ccccc32)s1 ZINC000473138661 339382088 /nfs/dbraw/zinc/38/20/88/339382088.db2.gz MXZSNYZQZFIVRK-OAHLLOKOSA-N 1 2 318.873 4.839 20 0 DJADLO Clc1cnc(C[N@@H+](C2CC2)[C@@H]2CCCc3ccccc32)s1 ZINC000473138661 339382089 /nfs/dbraw/zinc/38/20/89/339382089.db2.gz MXZSNYZQZFIVRK-OAHLLOKOSA-N 1 2 318.873 4.839 20 0 DJADLO C[C@H](c1cccc(Cl)c1)[N@H+](C)Cc1ncc(Cl)s1 ZINC000473143781 339382515 /nfs/dbraw/zinc/38/25/15/339382515.db2.gz GLONCVIPLWLRKN-SECBINFHSA-N 1 2 301.242 4.643 20 0 DJADLO C[C@H](c1cccc(Cl)c1)[N@@H+](C)Cc1ncc(Cl)s1 ZINC000473143781 339382516 /nfs/dbraw/zinc/38/25/16/339382516.db2.gz GLONCVIPLWLRKN-SECBINFHSA-N 1 2 301.242 4.643 20 0 DJADLO CCC[C@@]1(C(F)(F)F)CCCN1CCCc1ccc(C)[nH+]c1 ZINC000474270978 339407864 /nfs/dbraw/zinc/40/78/64/339407864.db2.gz QCBJNKHGEXTFRF-INIZCTEOSA-N 1 2 314.395 4.520 20 0 DJADLO C[C@H](Nc1cccc(-c2[nH+]ccn2C)c1)C1CCC(F)(F)CC1 ZINC000474389232 339412019 /nfs/dbraw/zinc/41/20/19/339412019.db2.gz MXECACOOYCWOFK-ZDUSSCGKSA-N 1 2 319.399 4.713 20 0 DJADLO C[C@@H](Nc1cccc(-c2[nH+]ccn2C)c1)C1CCC(F)(F)CC1 ZINC000474389231 339412023 /nfs/dbraw/zinc/41/20/23/339412023.db2.gz MXECACOOYCWOFK-CYBMUJFWSA-N 1 2 319.399 4.713 20 0 DJADLO CCn1cc[nH+]c1CNc1cc(-c2ccccc2)ccc1Cl ZINC000475359417 339449132 /nfs/dbraw/zinc/44/91/32/339449132.db2.gz WKCLWVBNSVOPAZ-UHFFFAOYSA-N 1 2 311.816 4.836 20 0 DJADLO C[C@@H]([NH2+]Cc1nc2ccccc2o1)c1cc2cccc(F)c2o1 ZINC000475720206 339460322 /nfs/dbraw/zinc/46/03/22/339460322.db2.gz JHJODGMCZTWJIO-LLVKDONJSA-N 1 2 310.328 4.564 20 0 DJADLO CC(C)[C@H]([NH2+][C@@H](C)c1noc(-c2ccccc2)n1)c1ccccc1 ZINC000477665098 339498899 /nfs/dbraw/zinc/49/88/99/339498899.db2.gz PUXWGZSWVRORRO-YJBOKZPZSA-N 1 2 321.424 4.785 20 0 DJADLO CC(C)[C@@H]([NH2+][C@H](C)c1noc(-c2ccccc2)n1)c1ccccc1 ZINC000477665093 339498909 /nfs/dbraw/zinc/49/89/09/339498909.db2.gz PUXWGZSWVRORRO-CRAIPNDOSA-N 1 2 321.424 4.785 20 0 DJADLO COc1ccc2oc(C[NH2+]Cc3c(F)cccc3Cl)cc2c1 ZINC000482727406 339640991 /nfs/dbraw/zinc/64/09/91/339640991.db2.gz XETLJOXSUWDOCI-UHFFFAOYSA-N 1 2 319.763 4.524 20 0 DJADLO Cc1cc(C)cc(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)c1 ZINC000482758430 339641792 /nfs/dbraw/zinc/64/17/92/339641792.db2.gz BFFWQHDDTHJPDD-UHFFFAOYSA-N 1 2 318.376 4.743 20 0 DJADLO Cc1cccc(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)c1C ZINC000482910989 339646812 /nfs/dbraw/zinc/64/68/12/339646812.db2.gz KSTGSYWTGFOTBP-UHFFFAOYSA-N 1 2 318.376 4.743 20 0 DJADLO Cc1cc(C)c(NC(=O)c2cc(C)c(Cl)cc2C)c(C)[nH+]1 ZINC000483191241 339655866 /nfs/dbraw/zinc/65/58/66/339655866.db2.gz DRBMRXHLVSVPNG-UHFFFAOYSA-N 1 2 302.805 4.529 20 0 DJADLO Cc1c2ccccc2oc1[C@H](C)[NH2+]Cc1nc2ccc(F)cc2o1 ZINC000484999950 339697017 /nfs/dbraw/zinc/69/70/17/339697017.db2.gz DKOLCZIPILEJJZ-LBPRGKRZSA-N 1 2 324.355 4.872 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)CCc1ccc(Cl)cc1Cl ZINC000485489935 339704361 /nfs/dbraw/zinc/70/43/61/339704361.db2.gz MKQZRHPFTUVGPS-UHFFFAOYSA-N 1 2 323.223 4.577 20 0 DJADLO Clc1cnc(C[NH2+][C@@H]2CCCc3sc(Cl)cc32)s1 ZINC000492277020 339896204 /nfs/dbraw/zinc/89/62/04/339896204.db2.gz RQDAZPWDXMJJSR-MRVPVSSYSA-N 1 2 319.282 4.679 20 0 DJADLO O=C(NCCCC1CCCC1)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000492556352 339903889 /nfs/dbraw/zinc/90/38/89/339903889.db2.gz FCVOQAKPSPBSNM-UHFFFAOYSA-N 1 2 324.424 4.574 20 0 DJADLO Cc1cc(C[NH2+][C@H](c2ccsc2)c2ccc(Cl)cc2)no1 ZINC000495029344 339970664 /nfs/dbraw/zinc/97/06/64/339970664.db2.gz WMQDIJUVEFHVCM-INIZCTEOSA-N 1 2 318.829 4.577 20 0 DJADLO C[C@H](c1cccc(C(F)(F)F)c1)N(C)c1cc[nH+]c(C2CC2)n1 ZINC000498956910 340027040 /nfs/dbraw/zinc/02/70/40/340027040.db2.gz KJJOJEOIUCUQAK-LLVKDONJSA-N 1 2 321.346 4.570 20 0 DJADLO CC(C)c1noc(C[N@@H+](C)[C@@H](c2ccccc2Cl)C(C)C)n1 ZINC000500211850 340053025 /nfs/dbraw/zinc/05/30/25/340053025.db2.gz PIJJTTKALMCVES-MRXNPFEDSA-N 1 2 321.852 4.676 20 0 DJADLO CC(C)c1noc(C[N@H+](C)[C@@H](c2ccccc2Cl)C(C)C)n1 ZINC000500211850 340053026 /nfs/dbraw/zinc/05/30/26/340053026.db2.gz PIJJTTKALMCVES-MRXNPFEDSA-N 1 2 321.852 4.676 20 0 DJADLO CC(C)[C@@H](c1ccccc1Cl)[N@H+](C)Cc1nccn1C(C)C ZINC000500236562 340053575 /nfs/dbraw/zinc/05/35/75/340053575.db2.gz NZLTUMQYLFUHPP-SFHVURJKSA-N 1 2 319.880 4.947 20 0 DJADLO CC(C)[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1nccn1C(C)C ZINC000500236562 340053576 /nfs/dbraw/zinc/05/35/76/340053576.db2.gz NZLTUMQYLFUHPP-SFHVURJKSA-N 1 2 319.880 4.947 20 0 DJADLO Cc1[nH]ncc1C[NH2+][C@@H](c1ccccc1C)[C@H]1CCC[C@H](C)C1 ZINC000500884568 340069175 /nfs/dbraw/zinc/06/91/75/340069175.db2.gz BHXQDPNIWHCRTC-GZRFBZBPSA-N 1 2 311.473 4.684 20 0 DJADLO CC(C)c1nc([C@@H](C)[NH2+][C@@H](C)c2nc3c(s2)CCC3)cs1 ZINC000502042069 340093880 /nfs/dbraw/zinc/09/38/80/340093880.db2.gz JSBXELUNVWQPLY-MNOVXSKESA-N 1 2 321.515 4.624 20 0 DJADLO Cc1cc([C@@H](C)[NH2+]Cc2csc(-c3ccccc3)n2)oc1C ZINC000502408550 340102232 /nfs/dbraw/zinc/10/22/32/340102232.db2.gz UWBCVLJHMBONDT-CYBMUJFWSA-N 1 2 312.438 4.871 20 0 DJADLO CCc1ccc(C(=O)Nc2ccc3[nH]c(C4CCC4)[nH+]c3c2)cc1 ZINC000502472835 340105223 /nfs/dbraw/zinc/10/52/23/340105223.db2.gz MYKGPMYVIIRRQZ-UHFFFAOYSA-N 1 2 319.408 4.645 20 0 DJADLO FC(F)C1([NH2+][C@H]2CCCc3nc(-c4ccccc4)sc32)CC1 ZINC000503919959 340136839 /nfs/dbraw/zinc/13/68/39/340136839.db2.gz JFFWSRBHJWDXBG-ZDUSSCGKSA-N 1 2 320.408 4.575 20 0 DJADLO COc1ccccc1-c1ccc([C@H](C)[NH2+]C2(C(F)F)CC2)cc1 ZINC000503926719 340137084 /nfs/dbraw/zinc/13/70/84/340137084.db2.gz OFCCBWNQNNDSGK-ZDUSSCGKSA-N 1 2 317.379 4.811 20 0 DJADLO CC(C)(C)Oc1cc[nH+]cc1NC(=O)c1ccc2ccccc2c1 ZINC000504635065 340150431 /nfs/dbraw/zinc/15/04/31/340150431.db2.gz JDMBROTXMYERGA-UHFFFAOYSA-N 1 2 320.392 4.664 20 0 DJADLO CCCc1nc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)cs1 ZINC000505471328 340169140 /nfs/dbraw/zinc/16/91/40/340169140.db2.gz JHBMCPAYTYQQBY-INIZCTEOSA-N 1 2 304.434 4.572 20 0 DJADLO CCCc1nc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)cs1 ZINC000505471328 340169141 /nfs/dbraw/zinc/16/91/41/340169141.db2.gz JHBMCPAYTYQQBY-INIZCTEOSA-N 1 2 304.434 4.572 20 0 DJADLO CC(C)n1ccnc1C[N@H+]([C@H](C)c1ccc(Cl)cc1)C1CC1 ZINC000505801079 340178483 /nfs/dbraw/zinc/17/84/83/340178483.db2.gz GLXBVDGZRIJSIU-CQSZACIVSA-N 1 2 317.864 4.843 20 0 DJADLO CC(C)n1ccnc1C[N@@H+]([C@H](C)c1ccc(Cl)cc1)C1CC1 ZINC000505801079 340178484 /nfs/dbraw/zinc/17/84/84/340178484.db2.gz GLXBVDGZRIJSIU-CQSZACIVSA-N 1 2 317.864 4.843 20 0 DJADLO CC(C)CC(=O)Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000505841618 340179373 /nfs/dbraw/zinc/17/93/73/340179373.db2.gz YWTIISNXGPUSHO-UHFFFAOYSA-N 1 2 304.777 4.512 20 0 DJADLO COc1ccsc1C[N@H+](Cc1ccco1)Cc1ccccc1 ZINC000506085667 340185174 /nfs/dbraw/zinc/18/51/74/340185174.db2.gz JIJPPAWMFXFSTB-UHFFFAOYSA-N 1 2 313.422 4.552 20 0 DJADLO COc1ccsc1C[N@@H+](Cc1ccco1)Cc1ccccc1 ZINC000506085667 340185175 /nfs/dbraw/zinc/18/51/75/340185175.db2.gz JIJPPAWMFXFSTB-UHFFFAOYSA-N 1 2 313.422 4.552 20 0 DJADLO c1coc(C[NH+](Cc2ccco2)Cc2cc3ccccc3o2)c1 ZINC000506115653 340186021 /nfs/dbraw/zinc/18/60/21/340186021.db2.gz ZEDAVUHRVBWHNJ-UHFFFAOYSA-N 1 2 307.349 4.821 20 0 DJADLO C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000506258304 340190286 /nfs/dbraw/zinc/19/02/86/340190286.db2.gz HGVHGWNHBTVSJK-LBPRGKRZSA-N 1 2 306.450 4.773 20 0 DJADLO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000506258304 340190287 /nfs/dbraw/zinc/19/02/87/340190287.db2.gz HGVHGWNHBTVSJK-LBPRGKRZSA-N 1 2 306.450 4.773 20 0 DJADLO C[C@H](c1nc2ccccc2s1)[N@H+](C)Cc1ccc(Cl)o1 ZINC000506707321 340199812 /nfs/dbraw/zinc/19/98/12/340199812.db2.gz OUNFSZXFLJNAFZ-SNVBAGLBSA-N 1 2 306.818 4.736 20 0 DJADLO C[C@H](c1nc2ccccc2s1)[N@@H+](C)Cc1ccc(Cl)o1 ZINC000506707321 340199813 /nfs/dbraw/zinc/19/98/13/340199813.db2.gz OUNFSZXFLJNAFZ-SNVBAGLBSA-N 1 2 306.818 4.736 20 0 DJADLO CC(C)n1cc[nH+]c1CN([C@@H](C)c1ccccc1Cl)C1CC1 ZINC000506948951 340204177 /nfs/dbraw/zinc/20/41/77/340204177.db2.gz UXKANBGRVUVBAM-AWEZNQCLSA-N 1 2 317.864 4.843 20 0 DJADLO CCCc1ccc([C@H]([NH2+]Cc2noc(C(C)C)n2)C(C)C)cc1 ZINC000506961532 340204461 /nfs/dbraw/zinc/20/44/61/340204461.db2.gz HRYURPCHKVUTSK-GOSISDBHSA-N 1 2 315.461 4.632 20 0 DJADLO CCn1cc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)cn1 ZINC000507133503 340208988 /nfs/dbraw/zinc/20/89/88/340208988.db2.gz ZLHDBODTKVKFDL-MRXNPFEDSA-N 1 2 324.255 4.547 20 0 DJADLO CCn1cc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)cn1 ZINC000507133503 340208989 /nfs/dbraw/zinc/20/89/89/340208989.db2.gz ZLHDBODTKVKFDL-MRXNPFEDSA-N 1 2 324.255 4.547 20 0 DJADLO CC(C)c1ncc(C[N@H+](C)[C@H](C)c2cc(F)ccc2F)s1 ZINC000507192599 340212390 /nfs/dbraw/zinc/21/23/90/340212390.db2.gz SLKKTOQKAHWMEY-LLVKDONJSA-N 1 2 310.413 4.738 20 0 DJADLO CC(C)c1ncc(C[N@@H+](C)[C@H](C)c2cc(F)ccc2F)s1 ZINC000507192599 340212391 /nfs/dbraw/zinc/21/23/91/340212391.db2.gz SLKKTOQKAHWMEY-LLVKDONJSA-N 1 2 310.413 4.738 20 0 DJADLO C[C@H](c1cc(F)ccc1F)[N@H+](C)Cc1cnc(C2CCC2)s1 ZINC000507205921 340213221 /nfs/dbraw/zinc/21/32/21/340213221.db2.gz AEMKTVAEHSOTQM-LLVKDONJSA-N 1 2 322.424 4.882 20 0 DJADLO C[C@H](c1cc(F)ccc1F)[N@@H+](C)Cc1cnc(C2CCC2)s1 ZINC000507205921 340213222 /nfs/dbraw/zinc/21/32/22/340213222.db2.gz AEMKTVAEHSOTQM-LLVKDONJSA-N 1 2 322.424 4.882 20 0 DJADLO Cc1ncsc1C[N@@H+](C)[C@H](C)c1cc(Cl)ccc1Cl ZINC000507221187 340214147 /nfs/dbraw/zinc/21/41/47/340214147.db2.gz GLVAYANDLNDXFY-SNVBAGLBSA-N 1 2 315.269 4.951 20 0 DJADLO Cc1ncsc1C[N@H+](C)[C@H](C)c1cc(Cl)ccc1Cl ZINC000507221187 340214148 /nfs/dbraw/zinc/21/41/48/340214148.db2.gz GLVAYANDLNDXFY-SNVBAGLBSA-N 1 2 315.269 4.951 20 0 DJADLO Cc1nc2sccn2c1C[N@@H+](C)[C@@H](C)c1ccccc1Cl ZINC000507222150 340214421 /nfs/dbraw/zinc/21/44/21/340214421.db2.gz RMYGQPKQZVOXNT-LBPRGKRZSA-N 1 2 319.861 4.551 20 0 DJADLO Cc1nc2sccn2c1C[N@H+](C)[C@@H](C)c1ccccc1Cl ZINC000507222150 340214422 /nfs/dbraw/zinc/21/44/22/340214422.db2.gz RMYGQPKQZVOXNT-LBPRGKRZSA-N 1 2 319.861 4.551 20 0 DJADLO CCc1cccnc1[C@@H](C)[NH2+][C@@H](c1ccco1)c1ccccc1 ZINC000507520808 340224152 /nfs/dbraw/zinc/22/41/52/340224152.db2.gz UBBCWJGDEIXGIC-FOIQADDNSA-N 1 2 306.409 4.677 20 0 DJADLO Cc1cccn2cc(CSCCCCC(F)(F)F)[nH+]c12 ZINC000507628131 340226853 /nfs/dbraw/zinc/22/68/53/340226853.db2.gz SLUWWJIAMUSYSZ-UHFFFAOYSA-N 1 2 302.365 4.609 20 0 DJADLO C[C@@H](c1ccccc1F)[N@@H+]1CCO[C@H](c2ccccc2Cl)C1 ZINC000507860201 340234464 /nfs/dbraw/zinc/23/44/64/340234464.db2.gz ONEMIULQEMUXBJ-UGSOOPFHSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@@H](c1ccccc1F)[N@H+]1CCO[C@H](c2ccccc2Cl)C1 ZINC000507860201 340234465 /nfs/dbraw/zinc/23/44/65/340234465.db2.gz ONEMIULQEMUXBJ-UGSOOPFHSA-N 1 2 319.807 4.614 20 0 DJADLO Cc1ccc(NC(=O)c2ccccc2Oc2cc[nH+]cc2)c(F)c1 ZINC000509009570 340258179 /nfs/dbraw/zinc/25/81/79/340258179.db2.gz AJYRTQWCSAFORD-UHFFFAOYSA-N 1 2 322.339 4.574 20 0 DJADLO Cc1cc(F)cc(NC(=O)c2ccccc2Oc2cc[nH+]cc2)c1 ZINC000509175474 340263131 /nfs/dbraw/zinc/26/31/31/340263131.db2.gz NHAAGNIBAHSCJE-UHFFFAOYSA-N 1 2 322.339 4.574 20 0 DJADLO Cc1ccc(-c2csc(C[N@@H+](C)[C@@H](C)c3ccco3)n2)cc1 ZINC000509311654 340265862 /nfs/dbraw/zinc/26/58/62/340265862.db2.gz UFDRVYDOHHYLCC-AWEZNQCLSA-N 1 2 312.438 4.905 20 0 DJADLO Cc1ccc(-c2csc(C[N@H+](C)[C@@H](C)c3ccco3)n2)cc1 ZINC000509311654 340265863 /nfs/dbraw/zinc/26/58/63/340265863.db2.gz UFDRVYDOHHYLCC-AWEZNQCLSA-N 1 2 312.438 4.905 20 0 DJADLO Cc1ccc(-c2csc(C[N@@H+](C)[C@H](C)c3ccco3)n2)cc1 ZINC000509311656 340265969 /nfs/dbraw/zinc/26/59/69/340265969.db2.gz UFDRVYDOHHYLCC-CQSZACIVSA-N 1 2 312.438 4.905 20 0 DJADLO Cc1ccc(-c2csc(C[N@H+](C)[C@H](C)c3ccco3)n2)cc1 ZINC000509311656 340265970 /nfs/dbraw/zinc/26/59/70/340265970.db2.gz UFDRVYDOHHYLCC-CQSZACIVSA-N 1 2 312.438 4.905 20 0 DJADLO CC[C@H]1CCCN(C(=O)c2ccccc2Oc2cc[nH+]cc2)CC1 ZINC000509399167 340268314 /nfs/dbraw/zinc/26/83/14/340268314.db2.gz FXTTXEAIHATGIB-INIZCTEOSA-N 1 2 324.424 4.526 20 0 DJADLO Clc1ccccc1C1=CC[N@H+](Cc2ccncc2Cl)CC1 ZINC000509506354 340271751 /nfs/dbraw/zinc/27/17/51/340271751.db2.gz IIIMEOVVJZXGPR-UHFFFAOYSA-N 1 2 319.235 4.678 20 0 DJADLO Clc1ccccc1C1=CC[N@@H+](Cc2ccncc2Cl)CC1 ZINC000509506354 340271752 /nfs/dbraw/zinc/27/17/52/340271752.db2.gz IIIMEOVVJZXGPR-UHFFFAOYSA-N 1 2 319.235 4.678 20 0 DJADLO Cc1cnc(C[N@@H+](Cc2ccc(F)cc2Cl)CC2CC2)s1 ZINC000511105744 340320909 /nfs/dbraw/zinc/32/09/09/340320909.db2.gz KDGBXWVLSVAQAX-UHFFFAOYSA-N 1 2 324.852 4.656 20 0 DJADLO Cc1cnc(C[N@H+](Cc2ccc(F)cc2Cl)CC2CC2)s1 ZINC000511105744 340320910 /nfs/dbraw/zinc/32/09/10/340320910.db2.gz KDGBXWVLSVAQAX-UHFFFAOYSA-N 1 2 324.852 4.656 20 0 DJADLO CC(C)C[C@H](C)CC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000303455583 340326520 /nfs/dbraw/zinc/32/65/20/340326520.db2.gz MEIYDNVLWDHDJI-HNNXBMFYSA-N 1 2 312.413 4.885 20 0 DJADLO CC[C@@H](CC1CCCC1)C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000511549642 340330249 /nfs/dbraw/zinc/33/02/49/340330249.db2.gz DWVJNORRPIOLJS-HNNXBMFYSA-N 1 2 311.429 4.622 20 0 DJADLO CCCCOc1ccc(CNc2ccc(-n3cc[nH+]c3)cc2)cc1 ZINC000512984239 340386891 /nfs/dbraw/zinc/38/68/91/340386891.db2.gz CAAPQZSWXHRYMV-UHFFFAOYSA-N 1 2 321.424 4.663 20 0 DJADLO C[C@@H]([NH2+]Cc1ccc(Cl)c(Cl)c1)c1c(F)cncc1F ZINC000513084135 340392590 /nfs/dbraw/zinc/39/25/90/340392590.db2.gz SQMJTGPDCSAORH-MRVPVSSYSA-N 1 2 317.166 4.517 20 0 DJADLO COCc1ccc(C[NH+]2Cc3ccccc3-c3ccccc3C2)o1 ZINC000513148556 340395145 /nfs/dbraw/zinc/39/51/45/340395145.db2.gz GYUQFSVJAKIUTC-UHFFFAOYSA-N 1 2 319.404 4.609 20 0 DJADLO Cc1ncsc1C[NH+]1Cc2ccccc2-c2ccccc2C1 ZINC000513155039 340395341 /nfs/dbraw/zinc/39/53/41/340395341.db2.gz TZBALRHAFMEHCF-UHFFFAOYSA-N 1 2 306.434 4.634 20 0 DJADLO CCCc1cccc(C[NH2+][C@H](C)c2noc(-c3ccccc3)n2)c1 ZINC000187301478 340519019 /nfs/dbraw/zinc/51/90/19/340519019.db2.gz JTYZOYRRENSQRK-OAHLLOKOSA-N 1 2 321.424 4.540 20 0 DJADLO C[C@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1csc(Cl)c1 ZINC000191253177 340551832 /nfs/dbraw/zinc/55/18/32/340551832.db2.gz BVBCGASSWOASMK-NSHDSACASA-N 1 2 318.829 4.907 20 0 DJADLO CS[C@@H](C)CC(=O)Nc1c2ccccc2[nH+]c(C)c1C(C)C ZINC000191957961 340560512 /nfs/dbraw/zinc/56/05/12/340560512.db2.gz JPIYWXNXXSJGHY-LBPRGKRZSA-N 1 2 316.470 4.747 20 0 DJADLO C[C@@H]([NH2+]Cc1ncc(Cl)s1)c1ccc(Cl)c(Cl)c1 ZINC000225296228 340566407 /nfs/dbraw/zinc/56/64/07/340566407.db2.gz WSQBUNXZXBNRMA-SSDOTTSWSA-N 1 2 321.660 4.954 20 0 DJADLO Clc1csc(C[NH2+][C@H](c2nccs2)c2ccccc2)c1 ZINC000193070323 340572061 /nfs/dbraw/zinc/57/20/61/340572061.db2.gz MVXYOWWCSAXTFK-AWEZNQCLSA-N 1 2 320.870 4.737 20 0 DJADLO CCc1cc(C[NH2+]Cc2c(Cl)cccc2SC(C)C)on1 ZINC000525980718 340706116 /nfs/dbraw/zinc/70/61/16/340706116.db2.gz JDWZPBFYSOCMFP-UHFFFAOYSA-N 1 2 324.877 4.681 20 0 DJADLO CC(C)[C@H]([NH2+]Cc1ncccc1Cl)c1ccc(F)cc1F ZINC000528440039 340719140 /nfs/dbraw/zinc/71/91/40/340719140.db2.gz SSSAFYBYSHMPIM-INIZCTEOSA-N 1 2 310.775 4.500 20 0 DJADLO C[C@H](Nc1ccc(N2CCCC2)[nH+]c1)c1ccccc1Cl ZINC000036982169 340726123 /nfs/dbraw/zinc/72/61/23/340726123.db2.gz QVHQTWOXMJFKMO-ZDUSSCGKSA-N 1 2 301.821 4.508 20 0 DJADLO Cc1cc([C@@H](C)Nc2ccc(N3CCCC3)[nH+]c2)c(C)s1 ZINC000036982071 340726135 /nfs/dbraw/zinc/72/61/35/340726135.db2.gz JTNILSRBSQTJQF-CYBMUJFWSA-N 1 2 301.459 4.533 20 0 DJADLO CCCCc1noc([C@@H](C)[NH2+][C@@H](CC)c2cc(C)ccc2C)n1 ZINC000528796523 340734670 /nfs/dbraw/zinc/73/46/70/340734670.db2.gz AFDIJJYCEWKOTQ-WBVHZDCISA-N 1 2 315.461 4.831 20 0 DJADLO CC[C@@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)no1)c1cc(C)ccc1C ZINC000528802462 340735133 /nfs/dbraw/zinc/73/51/33/340735133.db2.gz SZDXPOMQBZMWTF-GOEBONIOSA-N 1 2 315.461 4.786 20 0 DJADLO Cc1sc([C@@H](C)n2c[nH+]c3cc(C)c(C)cc32)nc1C1CC1 ZINC000538431997 340823564 /nfs/dbraw/zinc/82/35/64/340823564.db2.gz FBVFICDTAGSJQP-GFCCVEGCSA-N 1 2 311.454 4.905 20 0 DJADLO Fc1ccc2cc[nH+]c(N[C@@H]3CCOC4(CCCCC4)C3)c2c1 ZINC000538788541 340851764 /nfs/dbraw/zinc/85/17/64/340851764.db2.gz MZPDQWBWMNRKEL-MRXNPFEDSA-N 1 2 314.404 4.668 20 0 DJADLO CCc1nc(C[NH2+][C@@H](C)c2oc3ccccc3c2C)cs1 ZINC000067213890 340855832 /nfs/dbraw/zinc/85/58/32/340855832.db2.gz ZKBDHEIDMLMYST-LBPRGKRZSA-N 1 2 300.427 4.611 20 0 DJADLO CCCCc1nc(C[NH2+][C@H](c2ccccc2)C(CC)CC)no1 ZINC000539279271 340879081 /nfs/dbraw/zinc/87/90/81/340879081.db2.gz HDWUQUXUPKYBMC-IBGZPJMESA-N 1 2 315.461 4.679 20 0 DJADLO CC[C@@H](C)[C@H]([NH2+]Cc1nc(C(C)C)no1)c1ccc(Cl)cc1 ZINC000539285860 340879364 /nfs/dbraw/zinc/87/93/64/340879364.db2.gz FOUAXNGFGWBMCX-WBMJQRKESA-N 1 2 321.852 4.723 20 0 DJADLO Cc1csc(C2([NH2+][C@H](C)c3ccc(F)cc3Cl)CCC2)n1 ZINC000539633445 340893806 /nfs/dbraw/zinc/89/38/06/340893806.db2.gz UCBZYINMLKIAPL-LLVKDONJSA-N 1 2 324.852 4.974 20 0 DJADLO CC(C)c1nnc(C[NH2+]C(C)(C)c2ccc(C(C)(C)C)cc2)o1 ZINC000540405202 340929823 /nfs/dbraw/zinc/92/98/23/340929823.db2.gz YFCBTIBDIKWRLA-UHFFFAOYSA-N 1 2 315.461 4.515 20 0 DJADLO CC(C)(C)c1cnc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)o1 ZINC000540468538 340932561 /nfs/dbraw/zinc/93/25/61/340932561.db2.gz XOMFFKSVMLHKMT-QGZVFWFLSA-N 1 2 318.848 4.866 20 0 DJADLO CCc1cnc(C[N@H+](C)[C@H](C)c2cc3ccccc3o2)s1 ZINC000543396439 341042013 /nfs/dbraw/zinc/04/20/13/341042013.db2.gz KOZCHQMEFWJTGL-GFCCVEGCSA-N 1 2 300.427 4.645 20 0 DJADLO CCc1cnc(C[N@@H+](C)[C@H](C)c2cc3ccccc3o2)s1 ZINC000543396439 341042014 /nfs/dbraw/zinc/04/20/14/341042014.db2.gz KOZCHQMEFWJTGL-GFCCVEGCSA-N 1 2 300.427 4.645 20 0 DJADLO COc1cc(C)[nH+]c(CNc2cccc(C(F)F)c2Cl)c1 ZINC000543619551 341051261 /nfs/dbraw/zinc/05/12/61/341051261.db2.gz HFPCWNSSRLAWEQ-UHFFFAOYSA-N 1 2 312.747 4.602 20 0 DJADLO Cc1cc(C)c(NC(=O)CC2CC(c3ccccc3)C2)c(C)[nH+]1 ZINC000543769713 341057813 /nfs/dbraw/zinc/05/78/13/341057813.db2.gz RXXPONWDNALWJJ-UHFFFAOYSA-N 1 2 308.425 4.529 20 0 DJADLO Cc1ccc(-c2cnc(C[N@@H+]3Cc4ccccc4[C@@H]3C)o2)cc1 ZINC000543988093 341065070 /nfs/dbraw/zinc/06/50/70/341065070.db2.gz YUCHKIJKZRMQEO-HNNXBMFYSA-N 1 2 304.393 4.727 20 0 DJADLO Cc1ccc(-c2cnc(C[N@H+]3Cc4ccccc4[C@@H]3C)o2)cc1 ZINC000543988093 341065071 /nfs/dbraw/zinc/06/50/71/341065071.db2.gz YUCHKIJKZRMQEO-HNNXBMFYSA-N 1 2 304.393 4.727 20 0 DJADLO C[C@@H](c1cc2ccccc2o1)[N@H+](C)Cc1nc(C2CC2)cs1 ZINC000544072662 341069277 /nfs/dbraw/zinc/06/92/77/341069277.db2.gz ZYWKZMIALRKZDM-LBPRGKRZSA-N 1 2 312.438 4.960 20 0 DJADLO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)Cc1nc(C2CC2)cs1 ZINC000544072662 341069278 /nfs/dbraw/zinc/06/92/78/341069278.db2.gz ZYWKZMIALRKZDM-LBPRGKRZSA-N 1 2 312.438 4.960 20 0 DJADLO CCc1cnc(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)cc2)s1 ZINC000544347729 341077301 /nfs/dbraw/zinc/07/73/01/341077301.db2.gz ABGKWEUPVNLVEG-OAHLLOKOSA-N 1 2 306.862 4.696 20 0 DJADLO CCc1cnc(C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)s1 ZINC000544347729 341077302 /nfs/dbraw/zinc/07/73/02/341077302.db2.gz ABGKWEUPVNLVEG-OAHLLOKOSA-N 1 2 306.862 4.696 20 0 DJADLO CC(C)c1cnc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)s1 ZINC000544351146 341077544 /nfs/dbraw/zinc/07/75/44/341077544.db2.gz LXHYMBRFFNXMRN-HNNXBMFYSA-N 1 2 304.434 4.743 20 0 DJADLO CC(C)c1cnc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)s1 ZINC000544351146 341077545 /nfs/dbraw/zinc/07/75/45/341077545.db2.gz LXHYMBRFFNXMRN-HNNXBMFYSA-N 1 2 304.434 4.743 20 0 DJADLO CCC(CC)c1noc(-c2cccc(Oc3cc[nH+]cc3)c2)n1 ZINC000544571553 341086381 /nfs/dbraw/zinc/08/63/81/341086381.db2.gz MOORASPESGHMDR-UHFFFAOYSA-N 1 2 309.369 4.828 20 0 DJADLO CCCC[C@@H](CC)[NH2+][C@H](c1noc(C)n1)c1ccc(Cl)cc1 ZINC000547312722 341204951 /nfs/dbraw/zinc/20/49/51/341204951.db2.gz QTUATZOAPOZBRB-CVEARBPZSA-N 1 2 321.852 4.679 20 0 DJADLO CCO[C@H](C)c1nc(C[NH2+][C@H](C)c2ccc(Cl)cc2)cs1 ZINC000076716268 341212903 /nfs/dbraw/zinc/21/29/03/341212903.db2.gz MSPUJANBRNUCIH-VXGBXAGGSA-N 1 2 324.877 4.745 20 0 DJADLO CCO[C@H](C)c1nc(C[N@H+](C)[C@@H](CC)c2ccccc2)cs1 ZINC000076723273 341213017 /nfs/dbraw/zinc/21/30/17/341213017.db2.gz ZCAYVAQRRUYMIT-PBHICJAKSA-N 1 2 318.486 4.824 20 0 DJADLO CCO[C@H](C)c1nc(C[N@@H+](C)[C@@H](CC)c2ccccc2)cs1 ZINC000076723273 341213018 /nfs/dbraw/zinc/21/30/18/341213018.db2.gz ZCAYVAQRRUYMIT-PBHICJAKSA-N 1 2 318.486 4.824 20 0 DJADLO C[C@H](c1cc2ccccc2o1)[N@H+](C)Cc1csc(C2CC2)n1 ZINC000134820181 341224778 /nfs/dbraw/zinc/22/47/78/341224778.db2.gz KLMVNLWTPCHVMD-GFCCVEGCSA-N 1 2 312.438 4.960 20 0 DJADLO C[C@H](c1cc2ccccc2o1)[N@@H+](C)Cc1csc(C2CC2)n1 ZINC000134820181 341224779 /nfs/dbraw/zinc/22/47/79/341224779.db2.gz KLMVNLWTPCHVMD-GFCCVEGCSA-N 1 2 312.438 4.960 20 0 DJADLO Cc1cnc([C@@H](C)[NH2+]Cc2cccc(Cl)c2Cl)s1 ZINC000134909600 341226558 /nfs/dbraw/zinc/22/65/58/341226558.db2.gz APGBAFARZFYHIQ-SECBINFHSA-N 1 2 301.242 4.609 20 0 DJADLO C[C@H]([NH2+][C@H](c1ccco1)c1ccccc1)c1cc(F)ccc1F ZINC000078968689 341250731 /nfs/dbraw/zinc/25/07/31/341250731.db2.gz YSHLFBIDNVJUIG-DJJJIMSYSA-N 1 2 313.347 4.998 20 0 DJADLO Cc1cnc(C(C)(C)[NH2+]Cc2ccc(Cl)cc2Cl)s1 ZINC000080346190 341273095 /nfs/dbraw/zinc/27/30/95/341273095.db2.gz NFFBZBXYWKRJGK-UHFFFAOYSA-N 1 2 315.269 4.783 20 0 DJADLO CCC(=O)c1ccc(OCc2ccc(C(C)C)[nH+]c2C)c(F)c1 ZINC000549055895 341284813 /nfs/dbraw/zinc/28/48/13/341284813.db2.gz LZWYZCKFOXHNJS-UHFFFAOYSA-N 1 2 315.388 4.824 20 0 DJADLO COc1cccc(OC)c1SCc1ccc(C(C)C)[nH+]c1C ZINC000549064682 341285215 /nfs/dbraw/zinc/28/52/15/341285215.db2.gz WRKSFCMUXYYVNU-UHFFFAOYSA-N 1 2 317.454 4.823 20 0 DJADLO Cc1[nH+]c(C(C)C)ccc1COc1ccnc(C(F)(F)F)c1 ZINC000549067729 341285296 /nfs/dbraw/zinc/28/52/96/341285296.db2.gz RDHRTYSYJASVHN-UHFFFAOYSA-N 1 2 310.319 4.506 20 0 DJADLO Cc1cc(Cl)cc(CNc2cccc(-c3[nH+]ccn3C)c2)c1 ZINC000550175350 341311871 /nfs/dbraw/zinc/31/18/71/341311871.db2.gz YEEWCIMMDLQLJT-UHFFFAOYSA-N 1 2 311.816 4.661 20 0 DJADLO C[C@H]([NH2+]CC(C)(F)F)c1ccc2ccccc2c1OC(F)F ZINC000550873449 341325268 /nfs/dbraw/zinc/32/52/68/341325268.db2.gz AKBHPTZFEJVTRP-JTQLQIEISA-N 1 2 315.310 4.747 20 0 DJADLO Cc1[nH+]cccc1NCc1cnc(-c2ccc(Cl)cc2)s1 ZINC000551434546 341341679 /nfs/dbraw/zinc/34/16/79/341341679.db2.gz KFDAZCNDDITBDN-UHFFFAOYSA-N 1 2 315.829 4.779 20 0 DJADLO CCO[C@@H](C)c1nc(C[N@H+](C)[C@@H](CC)c2ccccc2)cs1 ZINC000247077363 341360698 /nfs/dbraw/zinc/36/06/98/341360698.db2.gz ZCAYVAQRRUYMIT-YOEHRIQHSA-N 1 2 318.486 4.824 20 0 DJADLO CCO[C@@H](C)c1nc(C[N@@H+](C)[C@@H](CC)c2ccccc2)cs1 ZINC000247077363 341360699 /nfs/dbraw/zinc/36/06/99/341360699.db2.gz ZCAYVAQRRUYMIT-YOEHRIQHSA-N 1 2 318.486 4.824 20 0 DJADLO Cc1ccc(-c2nc(C[NH2+]C3(c4cccc(F)c4)CC3)co2)cc1 ZINC000085328207 341367708 /nfs/dbraw/zinc/36/77/08/341367708.db2.gz NWMZNUVNSCTPIF-UHFFFAOYSA-N 1 2 322.383 4.568 20 0 DJADLO C[C@@H]([NH2+][C@H](c1nccn1C)C1CC1)c1ccc(Cl)cc1Cl ZINC000552088237 341368827 /nfs/dbraw/zinc/36/88/27/341368827.db2.gz DVFLFPOKICSPQP-BMIGLBTASA-N 1 2 324.255 4.529 20 0 DJADLO C[C@@H]1C[N@H+](Cc2csc(-c3ccoc3)n2)[C@H]1c1ccccc1 ZINC000248369724 341375767 /nfs/dbraw/zinc/37/57/67/341375767.db2.gz WPNRZFDTRRIBSK-CXAGYDPISA-N 1 2 310.422 4.596 20 0 DJADLO C[C@@H]1C[N@@H+](Cc2csc(-c3ccoc3)n2)[C@H]1c1ccccc1 ZINC000248369724 341375768 /nfs/dbraw/zinc/37/57/68/341375768.db2.gz WPNRZFDTRRIBSK-CXAGYDPISA-N 1 2 310.422 4.596 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1c(F)cncc1F)c1ccc(Cl)c(F)c1 ZINC000552327617 341386955 /nfs/dbraw/zinc/38/69/55/341386955.db2.gz AXJJECNKVAJRLL-RKDXNWHRSA-N 1 2 314.738 4.564 20 0 DJADLO COc1ccccc1[C@@H]([NH2+][C@@H](C)c1nccs1)c1ccccc1 ZINC000089554913 341405639 /nfs/dbraw/zinc/40/56/39/341405639.db2.gz PFSFJWYAMMEDDU-KSSFIOAISA-N 1 2 324.449 4.592 20 0 DJADLO COc1ccc2cc([C@@H](C)SCCn3cc[nH+]c3)ccc2c1 ZINC000090201860 341414041 /nfs/dbraw/zinc/41/40/41/341414041.db2.gz HUODJRVRHVITFR-CQSZACIVSA-N 1 2 312.438 4.539 20 0 DJADLO Cc1cc(N[C@H](C)c2ccc3n[nH]cc3c2)c2cccc(F)c2[nH+]1 ZINC000553388766 341427572 /nfs/dbraw/zinc/42/75/72/341427572.db2.gz LXDPCOYCYHYACV-GFCCVEGCSA-N 1 2 320.371 4.732 20 0 DJADLO C[C@@H]([NH2+]Cc1ccc(-c2ccccc2)cc1F)c1cscn1 ZINC000555608083 341486834 /nfs/dbraw/zinc/48/68/34/341486834.db2.gz ZAWZEKBMUJZNMC-CYBMUJFWSA-N 1 2 312.413 4.800 20 0 DJADLO Cc1cc([C@H](C)[NH2+]Cc2ccc(C)cc2OCCC(C)C)no1 ZINC000556262554 341499903 /nfs/dbraw/zinc/49/99/03/341499903.db2.gz AGEHVLACSYLODY-INIZCTEOSA-N 1 2 316.445 4.567 20 0 DJADLO CCOc1cccc(Cl)c1C[NH2+][C@H](CC)c1nc(C)cs1 ZINC000566417362 341557152 /nfs/dbraw/zinc/55/71/52/341557152.db2.gz XSISOSYHDYQVGR-CQSZACIVSA-N 1 2 324.877 4.745 20 0 DJADLO CCc1ccc(-c2ccc(C[NH2+][C@H](C)c3cscn3)o2)cc1 ZINC000574415056 341757965 /nfs/dbraw/zinc/75/79/65/341757965.db2.gz YKBIMBBHHVIJQP-CYBMUJFWSA-N 1 2 312.438 4.816 20 0 DJADLO Cc1cc(C[NH2+][C@H](c2ccccc2)c2ccc(Cl)cc2)on1 ZINC000192504620 341871042 /nfs/dbraw/zinc/87/10/42/341871042.db2.gz JADOUVUNXJPOKU-GOSISDBHSA-N 1 2 312.800 4.516 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1nc(-c2ccccc2)cs1)c1ccccn1 ZINC000152408665 518178287 /nfs/dbraw/zinc/17/82/87/518178287.db2.gz SCXVTRAXGZUNAZ-KGLIPLIRSA-N 1 2 309.438 4.617 20 0 DJADLO CC(C)c1nnc(C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cc2)o1 ZINC000181426169 519887795 /nfs/dbraw/zinc/88/77/95/519887795.db2.gz MQCFXDVFSPQVSR-HNNXBMFYSA-N 1 2 321.424 4.711 20 0 DJADLO CC(C)c1nnc(C[NH2+][C@H](C)c2ccc(C(C)(C)C)cc2)s1 ZINC000267991052 519888115 /nfs/dbraw/zinc/88/81/15/519888115.db2.gz JIDAHUUJBMDJFS-CYBMUJFWSA-N 1 2 317.502 4.810 20 0 DJADLO CC(C)n1ccc(C[NH2+]C2(c3ccc(Cl)c(Cl)c3)CC2)n1 ZINC000265313339 520004284 /nfs/dbraw/zinc/00/42/84/520004284.db2.gz FROMSSGIZAGVHD-UHFFFAOYSA-N 1 2 324.255 4.550 20 0 DJADLO CCCCc1nc(C[N@H+](C)[C@@H](C)c2sc(C)nc2C)cs1 ZINC000106877678 521291908 /nfs/dbraw/zinc/29/19/08/521291908.db2.gz HOYJKIHBBXECJU-LBPRGKRZSA-N 1 2 323.531 4.752 20 0 DJADLO CCCCc1nc(C[N@@H+](C)[C@@H](C)c2sc(C)nc2C)cs1 ZINC000106877678 521291920 /nfs/dbraw/zinc/29/19/20/521291920.db2.gz HOYJKIHBBXECJU-LBPRGKRZSA-N 1 2 323.531 4.752 20 0 DJADLO CCc1nc(C[NH2+][C@H](CC)c2cc(Cl)ccc2OC)cs1 ZINC000156412426 522354554 /nfs/dbraw/zinc/35/45/54/522354554.db2.gz KLRJTVCCWPJPGZ-CQSZACIVSA-N 1 2 324.877 4.608 20 0 DJADLO CC[C@@H]([NH2+]Cc1ccccc1F)c1nc(C(F)(F)F)cs1 ZINC000266596697 522885329 /nfs/dbraw/zinc/88/53/29/522885329.db2.gz BJCYEVLPPFFYNS-LLVKDONJSA-N 1 2 318.339 4.542 20 0 DJADLO CC[C@@H]([NH2+][C@@H](C)c1nc(C(C)C)no1)c1cccc(Cl)c1 ZINC000182598055 522917479 /nfs/dbraw/zinc/91/74/79/522917479.db2.gz POKXCXDSQOVSJT-SMDDNHRTSA-N 1 2 307.825 4.648 20 0 DJADLO CC[C@@H]([NH2+][C@H](C)c1nc(C(C)C)no1)c1cccc(Cl)c1 ZINC000182598095 522940783 /nfs/dbraw/zinc/94/07/83/522940783.db2.gz POKXCXDSQOVSJT-BXUZGUMPSA-N 1 2 307.825 4.648 20 0 DJADLO CO[C@@H](C)c1nc(C[N@H+](C)[C@@H](C)c2ccc(C)cc2C)cs1 ZINC000267071712 523464738 /nfs/dbraw/zinc/46/47/38/523464738.db2.gz VVUOVNWALJDBNX-GJZGRUSLSA-N 1 2 318.486 4.660 20 0 DJADLO CO[C@@H](C)c1nc(C[N@@H+](C)[C@@H](C)c2ccc(C)cc2C)cs1 ZINC000267071712 523464745 /nfs/dbraw/zinc/46/47/45/523464745.db2.gz VVUOVNWALJDBNX-GJZGRUSLSA-N 1 2 318.486 4.660 20 0 DJADLO CO[C@@H](C)c1nc(C[N@H+]([C@H](C)c2ccccc2)C2CC2)cs1 ZINC000267007539 523468904 /nfs/dbraw/zinc/46/89/04/523468904.db2.gz KONNLAKKGRZJAA-KGLIPLIRSA-N 1 2 316.470 4.576 20 0 DJADLO CO[C@@H](C)c1nc(C[N@@H+]([C@H](C)c2ccccc2)C2CC2)cs1 ZINC000267007539 523468917 /nfs/dbraw/zinc/46/89/17/523468917.db2.gz KONNLAKKGRZJAA-KGLIPLIRSA-N 1 2 316.470 4.576 20 0 DJADLO CC[C@](C)([NH2+]Cc1csc(CCC(C)C)n1)c1nccs1 ZINC000173514207 523491776 /nfs/dbraw/zinc/49/17/76/523491776.db2.gz RPOVEOUYJOZEBB-INIZCTEOSA-N 1 2 323.531 4.603 20 0 DJADLO CCc1ccc(-c2nc(C[NH2+][C@H](C)c3ccccn3)cs2)cc1 ZINC000180727636 523862150 /nfs/dbraw/zinc/86/21/50/523862150.db2.gz LVRQCDPRVPIXPQ-CQSZACIVSA-N 1 2 323.465 4.618 20 0 DJADLO Cc1ccc(C[N@H+](Cc2ccco2)Cc2ccc(C)cn2)s1 ZINC000156360442 524423214 /nfs/dbraw/zinc/42/32/14/524423214.db2.gz HEVAXNVKEJNHBI-UHFFFAOYSA-N 1 2 312.438 4.555 20 0 DJADLO Cc1ccc(C[N@@H+](Cc2ccco2)Cc2ccc(C)cn2)s1 ZINC000156360442 524423222 /nfs/dbraw/zinc/42/32/22/524423222.db2.gz HEVAXNVKEJNHBI-UHFFFAOYSA-N 1 2 312.438 4.555 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1Cl)c1cscn1 ZINC000162310112 525606062 /nfs/dbraw/zinc/60/60/62/525606062.db2.gz LVLHPLRMLKCTJL-DTWKUNHWSA-N 1 2 301.242 4.862 20 0 DJADLO Cc1ccc([C@H]([NH2+][C@H](C)c2ccccc2F)c2ccccn2)cc1 ZINC000366425611 525973118 /nfs/dbraw/zinc/97/31/18/525973118.db2.gz CPYILRJLHROOAK-IERDGZPVSA-N 1 2 320.411 4.969 20 0 DJADLO Cc1noc(C)c1C(=O)Nc1c2ccccc2[nH+]c(C)c1C(C)C ZINC000191319129 526473213 /nfs/dbraw/zinc/47/32/13/526473213.db2.gz OKUIAXJWDKDPMC-UHFFFAOYSA-N 1 2 323.396 4.524 20 0 DJADLO Cc1nc(C2([NH2+][C@@H](C)c3ccc(Cl)cc3)CCCCC2)no1 ZINC000264898309 526769997 /nfs/dbraw/zinc/76/99/97/526769997.db2.gz VJCINCHFWOIBGT-LBPRGKRZSA-N 1 2 319.836 4.542 20 0 DJADLO FC(F)(F)c1cccc(CNc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000338144535 527684859 /nfs/dbraw/zinc/68/48/59/527684859.db2.gz YRQZTXZQIDWPBF-UHFFFAOYSA-N 1 2 317.314 4.503 20 0 DJADLO CCCCC[C@@H](C)CC(=O)N1CCCC[C@H]1c1[nH+]ccn1CC ZINC000366646855 535112280 /nfs/dbraw/zinc/11/22/80/535112280.db2.gz IEVOKOLXVKKALC-SJORKVTESA-N 1 2 319.493 4.563 20 0 DJADLO CCCCc1noc([C@H](C)[NH2+][C@@H](C)c2ccccc2SC)n1 ZINC000281676271 535130315 /nfs/dbraw/zinc/13/03/15/535130315.db2.gz LZZXGUDKRXKYRD-STQMWFEESA-N 1 2 319.474 4.546 20 0 DJADLO CC(C)c1nc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)cc2F)cs1 ZINC000090049732 185279804 /nfs/dbraw/zinc/27/98/04/185279804.db2.gz QTYHQLBNZNDBLI-WDEREUQCSA-N 1 2 310.413 4.957 20 0 DJADLO C[C@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1cc2ccccc2o1 ZINC000090572190 185304287 /nfs/dbraw/zinc/30/42/87/185304287.db2.gz JIFPPANWGNVYTG-AWEZNQCLSA-N 1 2 309.413 4.595 20 0 DJADLO CCn1c2ccccc2nc1[C@H](C)[NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1 ZINC000237000342 202117195 /nfs/dbraw/zinc/11/71/95/202117195.db2.gz UTNPXIDLJQDAMO-DZKIICNBSA-N 1 2 323.440 4.623 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1F)c1nc2c(s1)CCCC2 ZINC000093369057 193239311 /nfs/dbraw/zinc/23/93/11/193239311.db2.gz DIIXXZAAMGVLQU-QWRGUYRKSA-N 1 2 322.424 4.712 20 0 DJADLO CCc1c2ccccc2oc1[C@@H](C)[NH2+][C@H](C)c1cscn1 ZINC000563827401 335033676 /nfs/dbraw/zinc/03/36/76/335033676.db2.gz WKQRMACPWGQRLW-VXGBXAGGSA-N 1 2 300.427 4.864 20 0 DJADLO Cc1ccc([C@@H]2CCCCN2C(=O)Nc2ccc(C)[nH+]c2C)cc1 ZINC000152393532 335047818 /nfs/dbraw/zinc/04/78/18/335047818.db2.gz DBTZECMTMSCOBA-IBGZPJMESA-N 1 2 323.440 4.766 20 0 DJADLO Cc1ccc(NC(=O)N(C)[C@H](C)c2ccccc2Cl)c(C)[nH+]1 ZINC000152408806 335057571 /nfs/dbraw/zinc/05/75/71/335057571.db2.gz CAVUSJYWKWBKHW-CYBMUJFWSA-N 1 2 317.820 4.577 20 0 DJADLO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2cc3cc(C)c(C)cc3o2)s1 ZINC000274218154 130218540 /nfs/dbraw/zinc/21/85/40/130218540.db2.gz NSUUYYVEBPSLTP-RYUDHWBXSA-N 1 2 315.442 4.621 20 0 DJADLO COc1cccc(C2([NH2+][C@@H](C)c3csc(C(C)C)n3)CC2)c1 ZINC000274523856 130243144 /nfs/dbraw/zinc/24/31/44/130243144.db2.gz YUZABMSLKZVPCY-ZDUSSCGKSA-N 1 2 316.470 4.615 20 0 DJADLO Cc1nccnc1[C@@H](C)[NH2+][C@@H](C)c1cc(Cl)ccc1Cl ZINC000275669899 130358548 /nfs/dbraw/zinc/35/85/48/130358548.db2.gz HCJVAQPBTGYJTL-GXSJLCMTSA-N 1 2 310.228 4.504 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1ccc(F)cc1Cl ZINC000285587034 131183648 /nfs/dbraw/zinc/18/36/48/131183648.db2.gz HOTUVTOKNIHLDT-BDAKNGLRSA-N 1 2 314.738 4.564 20 0 DJADLO Cc1ccnc([C@@H](C)[NH2+][C@@H](C)c2nc(-c3ccccc3)cs2)c1 ZINC000286279410 131228143 /nfs/dbraw/zinc/22/81/43/131228143.db2.gz VQTQZLDLWNKOJD-CABCVRRESA-N 1 2 323.465 4.925 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N1C[C@@H](C)CC[C@H]1c1ccccc1 ZINC000286964002 131258238 /nfs/dbraw/zinc/25/82/38/131258238.db2.gz AYBNYUPXWJPJOD-KSSFIOAISA-N 1 2 323.440 4.704 20 0 DJADLO CCCCC[C@H](C)CC(=O)N1CCCC[C@H]1c1[nH+]ccn1CC ZINC000366646852 131266868 /nfs/dbraw/zinc/26/68/68/131266868.db2.gz IEVOKOLXVKKALC-IRXDYDNUSA-N 1 2 319.493 4.563 20 0 DJADLO CCC(CC)c1cc(CNc2[nH+]ccc3ccc(F)cc32)on1 ZINC000340253690 131279728 /nfs/dbraw/zinc/27/97/28/131279728.db2.gz DKMLEKVWPJBYKO-UHFFFAOYSA-N 1 2 313.376 4.878 20 0 DJADLO CC[C@H](NC(=O)Nc1c(C)cc[nH+]c1C)c1ccc(Cl)s1 ZINC000287433820 131279958 /nfs/dbraw/zinc/27/99/58/131279958.db2.gz GVTZOZMBPORJCN-NSHDSACASA-N 1 2 323.849 4.686 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N(C)[C@H](C)c1ccccc1Cl ZINC000287642592 131292531 /nfs/dbraw/zinc/29/25/31/131292531.db2.gz VVMXPJRITPZUHJ-CYBMUJFWSA-N 1 2 317.820 4.577 20 0 DJADLO Cc1ccc([C@@H]2CCCCN2C(=O)Nc2c(C)cc[nH+]c2C)cc1 ZINC000287689912 131295206 /nfs/dbraw/zinc/29/52/06/131295206.db2.gz YVROPPIPDKIEFJ-SFHVURJKSA-N 1 2 323.440 4.766 20 0 DJADLO C[C@@H]([NH2+][C@H](c1c(Cl)cccc1Cl)C1CC1)c1cnccn1 ZINC000289366532 131378585 /nfs/dbraw/zinc/37/85/85/131378585.db2.gz AHYYVTVPKJEASZ-HWPZZCPQSA-N 1 2 322.239 4.585 20 0 DJADLO Clc1cccc(Cl)c1[C@@H]([NH2+]Cc1nccs1)C1CC1 ZINC000289363898 131378946 /nfs/dbraw/zinc/37/89/46/131378946.db2.gz ADCCKQYMTDHDMO-AWEZNQCLSA-N 1 2 313.253 4.691 20 0 DJADLO C[C@H]([NH2+][C@@H]1C[C@@H](C)n2ccnc21)c1cccc(Cl)c1Cl ZINC000297490325 132018816 /nfs/dbraw/zinc/01/88/16/132018816.db2.gz BIINRWXFOQPHFP-GBIKHYSHSA-N 1 2 310.228 4.547 20 0 DJADLO Cc1[nH]ncc1C[NH2+][C@@H](CCCc1ccccc1)c1ccccc1 ZINC000120878028 132146865 /nfs/dbraw/zinc/14/68/65/132146865.db2.gz JSWRITWEXZGMTD-NRFANRHFSA-N 1 2 319.452 4.572 20 0 DJADLO Cc1cc2cc([C@@H](C)[NH2+][C@H](C)c3cscn3)oc2cc1C ZINC000570739482 332809590 /nfs/dbraw/zinc/80/95/90/332809590.db2.gz BJGUTKPMVOCYJU-CHWSQXEVSA-N 1 2 300.427 4.918 20 0 DJADLO CC[C@@H]([NH2+][C@H](C)c1noc(-c2ccccc2)n1)c1ccc(C)cc1 ZINC000124277525 331557907 /nfs/dbraw/zinc/55/79/07/331557907.db2.gz YFRKGDGZWRGFPE-CRAIPNDOSA-N 1 2 321.424 4.847 20 0 DJADLO c1cn(Cc2ccccc2)c(CNc2cccc3ccsc32)[nH+]1 ZINC000533550769 331581370 /nfs/dbraw/zinc/58/13/70/331581370.db2.gz IGOGKJUQFBQKHM-UHFFFAOYSA-N 1 2 319.433 4.758 20 0 DJADLO Cc1ccc([C@H]([NH2+]Cc2cc(-c3ccccc3)on2)C2CCC2)o1 ZINC000558433486 331907097 /nfs/dbraw/zinc/90/70/97/331907097.db2.gz SRCKEXVQNAKYMH-HXUWFJFHSA-N 1 2 322.408 4.874 20 0 DJADLO CCCC[C@@H]([NH2+]Cc1ncccn1)c1ccc(Cl)cc1Cl ZINC000521069392 332014807 /nfs/dbraw/zinc/01/48/07/332014807.db2.gz ILQBBANZARHDSO-OAHLLOKOSA-N 1 2 324.255 4.805 20 0 DJADLO Cc1oc(-c2ccccc2)nc1C[N@@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000086233506 332019263 /nfs/dbraw/zinc/01/92/63/332019263.db2.gz TZZWHUJCRWKXEW-AWEZNQCLSA-N 1 2 322.408 4.969 20 0 DJADLO Cc1oc(-c2ccccc2)nc1C[N@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000086233506 332019265 /nfs/dbraw/zinc/01/92/65/332019265.db2.gz TZZWHUJCRWKXEW-AWEZNQCLSA-N 1 2 322.408 4.969 20 0 DJADLO Cc1c(Cl)c(C[N@@H+](C)[C@@H](C)c2ccco2)nc2ccccc12 ZINC000521198876 332074618 /nfs/dbraw/zinc/07/46/18/332074618.db2.gz PTLHVUBWSLSASC-ZDUSSCGKSA-N 1 2 314.816 4.983 20 0 DJADLO Cc1c(Cl)c(C[N@H+](C)[C@@H](C)c2ccco2)nc2ccccc12 ZINC000521198876 332074619 /nfs/dbraw/zinc/07/46/19/332074619.db2.gz PTLHVUBWSLSASC-ZDUSSCGKSA-N 1 2 314.816 4.983 20 0 DJADLO C[N@H+](Cc1cnc2ccccc2c1)Cc1c(F)cccc1Cl ZINC000410296910 332109610 /nfs/dbraw/zinc/10/96/10/332109610.db2.gz GXEKTXQKDBZWNH-UHFFFAOYSA-N 1 2 314.791 4.659 20 0 DJADLO C[N@@H+](Cc1cnc2ccccc2c1)Cc1c(F)cccc1Cl ZINC000410296910 332109611 /nfs/dbraw/zinc/10/96/11/332109611.db2.gz GXEKTXQKDBZWNH-UHFFFAOYSA-N 1 2 314.791 4.659 20 0 DJADLO CC[N@H+](Cc1cnc2ccccc2c1)Cc1c(F)cccc1F ZINC000410343271 332113510 /nfs/dbraw/zinc/11/35/10/332113510.db2.gz FKOYDUKSRIDNFK-UHFFFAOYSA-N 1 2 312.363 4.535 20 0 DJADLO CC[N@@H+](Cc1cnc2ccccc2c1)Cc1c(F)cccc1F ZINC000410343271 332113511 /nfs/dbraw/zinc/11/35/11/332113511.db2.gz FKOYDUKSRIDNFK-UHFFFAOYSA-N 1 2 312.363 4.535 20 0 DJADLO C[C@@H]([NH2+]Cc1csc(C(C)(C)C)n1)c1c(F)cccc1F ZINC000132961801 332135057 /nfs/dbraw/zinc/13/50/57/332135057.db2.gz KEAYJSMFMJDXSQ-SNVBAGLBSA-N 1 2 310.413 4.570 20 0 DJADLO CC/C(=C\c1nc(Cc2ccc(C)[nH+]c2)no1)c1ccc(C)cc1 ZINC000445209472 332143738 /nfs/dbraw/zinc/14/37/38/332143738.db2.gz GREYYGFDOXTHCV-SFQUDFHCSA-N 1 2 319.408 4.623 20 0 DJADLO CC[C@H]([NH2+]Cc1ccc(Oc2ccccc2)o1)c1nccs1 ZINC000180966436 332170288 /nfs/dbraw/zinc/17/02/88/332170288.db2.gz QPYYJHDIHFKRFW-HNNXBMFYSA-N 1 2 314.410 4.769 20 0 DJADLO CCCc1csc(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)n1 ZINC000426059558 335094694 /nfs/dbraw/zinc/09/46/94/335094694.db2.gz OYWPEHJDXKBKDP-MRXNPFEDSA-N 1 2 304.434 4.572 20 0 DJADLO CCCc1csc(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)n1 ZINC000426059558 335094695 /nfs/dbraw/zinc/09/46/95/335094695.db2.gz OYWPEHJDXKBKDP-MRXNPFEDSA-N 1 2 304.434 4.572 20 0 DJADLO Cc1ccc2nc(C[NH2+][C@@H](C)c3cc4ccc(C)cc4o3)[nH]c2c1 ZINC000426059054 335094758 /nfs/dbraw/zinc/09/47/58/335094758.db2.gz DBVANGIGSYAWGW-AWEZNQCLSA-N 1 2 319.408 4.777 20 0 DJADLO Cc1ccc2c(c1)[C@H]([NH2+]Cc1csc(Cl)c1Cl)CO2 ZINC000555762227 332265617 /nfs/dbraw/zinc/26/56/17/332265617.db2.gz LDEUJBPNBROUTQ-LLVKDONJSA-N 1 2 314.237 4.587 20 0 DJADLO CCOCc1cccc(N[C@@H](c2[nH]cc[nH+]2)C2CCCCC2)c1 ZINC000560553687 332359050 /nfs/dbraw/zinc/35/90/50/332359050.db2.gz YVKQGCLTRVXEMO-GOSISDBHSA-N 1 2 313.445 4.680 20 0 DJADLO CC(C)c1[nH+]c2ccccc2n1Cc1noc(C=C2CCCC2)n1 ZINC000583420379 332397773 /nfs/dbraw/zinc/39/77/73/332397773.db2.gz OCVIEPGIVZEOOX-UHFFFAOYSA-N 1 2 322.412 4.548 20 0 DJADLO Cc1cc[nH+]c(NC[C@H]2CCCO[C@H]2c2ccccc2)c1Cl ZINC000561156796 332417703 /nfs/dbraw/zinc/41/77/03/332417703.db2.gz DFJXZQDAZXZTIP-WBVHZDCISA-N 1 2 316.832 4.623 20 0 DJADLO Cc1cc[nH+]c(NC[C@@H]2CCCO[C@H]2c2ccccc2)c1Cl ZINC000561156795 332417737 /nfs/dbraw/zinc/41/77/37/332417737.db2.gz DFJXZQDAZXZTIP-RDJZCZTQSA-N 1 2 316.832 4.623 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000425583503 335106713 /nfs/dbraw/zinc/10/67/13/335106713.db2.gz ATCYNVUGPIMREE-JTQLQIEISA-N 1 2 323.223 4.747 20 0 DJADLO CCCc1sc(C(=O)Nc2c(C)cc[nH+]c2C)cc1CC ZINC000425584625 335106877 /nfs/dbraw/zinc/10/68/77/335106877.db2.gz FEQJLTXDSBZEQU-UHFFFAOYSA-N 1 2 302.443 4.527 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)C1CCC(c2ccccc2)CC1 ZINC000425586009 335106984 /nfs/dbraw/zinc/10/69/84/335106984.db2.gz JXYZQLDARHNGEQ-UHFFFAOYSA-N 1 2 308.425 4.611 20 0 DJADLO CC1=C(c2nc(Cn3c4ccccc4[nH+]c3C(C)C)no2)CCC1 ZINC000562480863 332596664 /nfs/dbraw/zinc/59/66/64/332596664.db2.gz FFVPRGMKKKKJRP-UHFFFAOYSA-N 1 2 322.412 4.548 20 0 DJADLO Fc1cc(Cl)cc(C[NH2+][C@H](c2ccco2)c2ccccc2)c1 ZINC000318400982 332703191 /nfs/dbraw/zinc/70/31/91/332703191.db2.gz GONJDOQBNQAEID-SFHVURJKSA-N 1 2 315.775 4.951 20 0 DJADLO Cc1ccc(NC(=O)N(Cc2ccccc2)[C@@H](C)C2CC2)c(C)[nH+]1 ZINC000176741369 332954276 /nfs/dbraw/zinc/95/42/76/332954276.db2.gz DYBCRBCPNNEDLF-INIZCTEOSA-N 1 2 323.440 4.531 20 0 DJADLO O=C(C[C@@H]1C=CCCC1)Nc1ccc(Oc2cc[nH+]cc2)cc1 ZINC000187297427 332965895 /nfs/dbraw/zinc/96/58/95/332965895.db2.gz GGHVZMCFXGGNMJ-OAHLLOKOSA-N 1 2 308.381 4.559 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1nc(C(C)(C)C)no1)c1cc2ccccc2o1 ZINC000182628353 333043643 /nfs/dbraw/zinc/04/36/43/333043643.db2.gz PVAAPGZQFLWHLG-VXGBXAGGSA-N 1 2 313.401 4.525 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1nc2ccccc2o1)c1cc2ccccc2o1 ZINC000182627883 333043780 /nfs/dbraw/zinc/04/37/80/333043780.db2.gz MIBXDUKIHYALEA-CHWSQXEVSA-N 1 2 306.365 4.986 20 0 DJADLO CCc1cnc(C[NH2+]C2c3ccccc3-c3ccccc32)s1 ZINC000182687057 333045580 /nfs/dbraw/zinc/04/55/80/333045580.db2.gz JRYLKECJWHNTHW-UHFFFAOYSA-N 1 2 306.434 4.565 20 0 DJADLO C[C@@H]([NH2+][C@H](c1ccco1)c1ccccc1)c1cccc(F)c1F ZINC000183212575 333053123 /nfs/dbraw/zinc/05/31/23/333053123.db2.gz GWFRMRKUGSFRSK-YJYMSZOUSA-N 1 2 313.347 4.998 20 0 DJADLO C[C@@H]1C[C@H](Nc2cc(Cl)cc(C(F)(F)F)c2)c2[nH+]ccn21 ZINC000379034916 333097007 /nfs/dbraw/zinc/09/70/07/333097007.db2.gz YUYZZKJVSBTQKR-PELKAZGASA-N 1 2 315.726 4.673 20 0 DJADLO Cc1ccc(N[C@@H](C)c2csc(-c3ccccc3F)n2)c[nH+]1 ZINC000462820804 333118995 /nfs/dbraw/zinc/11/89/95/333118995.db2.gz ZFWVAHVUOGLRQJ-LBPRGKRZSA-N 1 2 313.401 4.826 20 0 DJADLO COc1ccc([C@H](C)[NH2+][C@@H](C)c2c(F)cccc2F)c(F)c1 ZINC000314530171 333138168 /nfs/dbraw/zinc/13/81/68/333138168.db2.gz HBBBGHSDJQEQRM-QWRGUYRKSA-N 1 2 309.331 4.524 20 0 DJADLO C[C@@H]1C[C@H](Nc2cccc(Oc3ccccc3)c2)c2[nH+]ccn21 ZINC000379073684 333181905 /nfs/dbraw/zinc/18/19/05/333181905.db2.gz BUTBAZUSXAVFDF-KDOFPFPSSA-N 1 2 305.381 4.793 20 0 DJADLO CCc1cnccc1[C@H](C)[NH2+][C@H](CCc1ccccc1)C(F)F ZINC000498764059 333252601 /nfs/dbraw/zinc/25/26/01/333252601.db2.gz JLTWRFBDKHTWNZ-KBXCAEBGSA-N 1 2 318.411 4.561 20 0 DJADLO CCc1cnccc1[C@@H](C)[NH2+][C@@H](CCc1ccccc1)C(F)F ZINC000498764060 333252680 /nfs/dbraw/zinc/25/26/80/333252680.db2.gz JLTWRFBDKHTWNZ-KDOFPFPSSA-N 1 2 318.411 4.561 20 0 DJADLO CC(C)[C@H]([NH2+]Cc1c(F)cccc1Cl)c1ccc(F)cn1 ZINC000497822322 333296884 /nfs/dbraw/zinc/29/68/84/333296884.db2.gz WXLKSBRGHLQUSK-INIZCTEOSA-N 1 2 310.775 4.500 20 0 DJADLO Cc1nc(C[N@@H+]([C@H](C)c2ccccc2Cl)C2CC2)cs1 ZINC000525787289 333313761 /nfs/dbraw/zinc/31/37/61/333313761.db2.gz KEXXYUCMHXJQKB-LLVKDONJSA-N 1 2 306.862 4.831 20 0 DJADLO Cc1nc(C[N@H+]([C@H](C)c2ccccc2Cl)C2CC2)cs1 ZINC000525787289 333313762 /nfs/dbraw/zinc/31/37/62/333313762.db2.gz KEXXYUCMHXJQKB-LLVKDONJSA-N 1 2 306.862 4.831 20 0 DJADLO CCCCc1nc(C[N@H+](C)[C@H](C)c2ccc(F)cc2)cs1 ZINC000497993763 333318358 /nfs/dbraw/zinc/31/83/58/333318358.db2.gz IQDCRAOJLVZDCH-CYBMUJFWSA-N 1 2 306.450 4.818 20 0 DJADLO CCCCc1nc(C[N@@H+](C)[C@H](C)c2ccc(F)cc2)cs1 ZINC000497993763 333318359 /nfs/dbraw/zinc/31/83/59/333318359.db2.gz IQDCRAOJLVZDCH-CYBMUJFWSA-N 1 2 306.450 4.818 20 0 DJADLO Cc1cnc(C[NH2+][C@H](C)c2cc(F)c(Cl)cc2Cl)s1 ZINC000122977477 333465035 /nfs/dbraw/zinc/46/50/35/333465035.db2.gz YVLYZFIHBWNZQM-MRVPVSSYSA-N 1 2 319.232 4.748 20 0 DJADLO CC[C@@H]([NH2+][C@H](C)c1csc(C(C)C)n1)c1c(C)noc1C ZINC000186434651 335158043 /nfs/dbraw/zinc/15/80/43/335158043.db2.gz AISXFCOYUBJDNF-ZWNOBZJWSA-N 1 2 307.463 4.673 20 0 DJADLO CCc1nc(C)c(C[NH2+][C@@H](C)c2cc(Cl)sc2Cl)o1 ZINC000291895085 333816235 /nfs/dbraw/zinc/81/62/35/333816235.db2.gz KYTYLVMEUOCXEP-ZETCQYMHSA-N 1 2 319.257 4.765 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1ccc(-c2ccccc2)s1)c1csnn1 ZINC000414296189 333935521 /nfs/dbraw/zinc/93/55/21/333935521.db2.gz GAYFCRHWZAKRPB-VXGBXAGGSA-N 1 2 315.467 4.678 20 0 DJADLO CCc1ccc([C@H]2CCC[N@@H+]2Cc2nc(C3CC3)cs2)o1 ZINC000343547534 335171450 /nfs/dbraw/zinc/17/14/50/335171450.db2.gz HCAWLZAAWKROQX-OAHLLOKOSA-N 1 2 302.443 4.513 20 0 DJADLO CCc1ccc([C@H]2CCC[N@H+]2Cc2nc(C3CC3)cs2)o1 ZINC000343547534 335171452 /nfs/dbraw/zinc/17/14/52/335171452.db2.gz HCAWLZAAWKROQX-OAHLLOKOSA-N 1 2 302.443 4.513 20 0 DJADLO CCn1ccnc1[C@@H](C)[NH2+][C@H](C)c1ccc(Cl)cc1Cl ZINC000296081127 334229730 /nfs/dbraw/zinc/22/97/30/334229730.db2.gz SPFVAMZJSIELQI-GHMZBOCLSA-N 1 2 312.244 4.622 20 0 DJADLO Cc1c[nH+]ccc1NC(=O)c1cc(-c2ccccc2)ccc1Cl ZINC000110768065 334294756 /nfs/dbraw/zinc/29/47/56/334294756.db2.gz IXMPJKYIYAGXFF-UHFFFAOYSA-N 1 2 322.795 4.963 20 0 DJADLO C[C@@H]([NH2+]Cc1nc2ccccc2[nH]1)c1ccc(Cl)cc1Cl ZINC000048776723 334296476 /nfs/dbraw/zinc/29/64/76/334296476.db2.gz HZKUGWKGOHRWHW-SNVBAGLBSA-N 1 2 320.223 4.721 20 0 DJADLO C[C@@H]1CCC[C@H](C(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)C1 ZINC000303897151 334339936 /nfs/dbraw/zinc/33/99/36/334339936.db2.gz PNTRKGRPIRNJOG-CABCVRRESA-N 1 2 310.397 4.639 20 0 DJADLO Cc1ccc(NC(=O)N2CCC[C@H](c3ccccc3)CC2)c(C)[nH+]1 ZINC000152292270 334739768 /nfs/dbraw/zinc/73/97/68/334739768.db2.gz IETFEHWOXWAAPJ-SFHVURJKSA-N 1 2 323.440 4.500 20 0 DJADLO Cc1csc(C[NH2+][C@H](C)c2cc(Cl)sc2Cl)n1 ZINC000126234802 334860250 /nfs/dbraw/zinc/86/02/50/334860250.db2.gz ZFNRZMZCRQODAT-SSDOTTSWSA-N 1 2 307.271 4.671 20 0 DJADLO CCC(CC)c1cc(C[NH2+]Cc2ccc(Cl)cc2F)on1 ZINC000189362955 334893000 /nfs/dbraw/zinc/89/30/00/334893000.db2.gz HAPXODIJVIXBJD-UHFFFAOYSA-N 1 2 310.800 4.661 20 0 DJADLO Cc1[nH+]cn(-c2ccc(N[C@H](C)CCc3ccco3)cc2)c1C ZINC000582155698 334921943 /nfs/dbraw/zinc/92/19/43/334921943.db2.gz AVYXRIJCUVPNPI-CQSZACIVSA-N 1 2 309.413 4.515 20 0 DJADLO CCC[C@@H]([NH2+]Cc1cn[nH]c1C)c1ccc(Cl)c(Cl)c1 ZINC000113352972 335325132 /nfs/dbraw/zinc/32/51/32/335325132.db2.gz GCPYAOFGURUPAF-OAHLLOKOSA-N 1 2 312.244 4.656 20 0 DJADLO Cc1ccccc1NC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000113571877 335756018 /nfs/dbraw/zinc/75/60/18/335756018.db2.gz HGEOFAMFVFEPIV-UHFFFAOYSA-N 1 2 319.364 4.826 20 0 DJADLO CCC(=Cc1nc(Cn2c3ccccc3[nH+]c2C(C)C)no1)CC ZINC000445660050 338504914 /nfs/dbraw/zinc/50/49/14/338504914.db2.gz KVMIXUAMDCQJDR-UHFFFAOYSA-N 1 2 324.428 4.794 20 0 DJADLO CSCc1cnc(C[N@@H+]2CCCCC[C@H]2c2ccco2)s1 ZINC000351599780 336048369 /nfs/dbraw/zinc/04/83/69/336048369.db2.gz CXUBZYVSPWBMFB-AWEZNQCLSA-N 1 2 322.499 4.716 20 0 DJADLO CSCc1cnc(C[N@H+]2CCCCC[C@H]2c2ccco2)s1 ZINC000351599780 336048371 /nfs/dbraw/zinc/04/83/71/336048371.db2.gz CXUBZYVSPWBMFB-AWEZNQCLSA-N 1 2 322.499 4.716 20 0 DJADLO CSCc1cnc(C[N@@H+]2CC[C@@H](C)C[C@@H]2c2ccco2)s1 ZINC000351699887 336059701 /nfs/dbraw/zinc/05/97/01/336059701.db2.gz HECXGNNXYISNST-TZMCWYRMSA-N 1 2 322.499 4.572 20 0 DJADLO CSCc1cnc(C[N@H+]2CC[C@@H](C)C[C@@H]2c2ccco2)s1 ZINC000351699887 336059703 /nfs/dbraw/zinc/05/97/03/336059703.db2.gz HECXGNNXYISNST-TZMCWYRMSA-N 1 2 322.499 4.572 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)c1ccc(OC2CCCCC2)cc1 ZINC000332522984 336173886 /nfs/dbraw/zinc/17/38/86/336173886.db2.gz LINVPJLNYSFHMN-UHFFFAOYSA-N 1 2 324.424 4.662 20 0 DJADLO Cc1ccc(C[N@H+](Cc2ncc(Cl)s2)C(C)C)s1 ZINC000352023067 336190208 /nfs/dbraw/zinc/19/02/08/336190208.db2.gz UBTULVYMPZABLI-UHFFFAOYSA-N 1 2 300.880 4.577 20 0 DJADLO Cc1ccc(C[N@@H+](Cc2ncc(Cl)s2)C(C)C)s1 ZINC000352023067 336190210 /nfs/dbraw/zinc/19/02/10/336190210.db2.gz UBTULVYMPZABLI-UHFFFAOYSA-N 1 2 300.880 4.577 20 0 DJADLO Clc1cc2c(s1)CC[C@@H]2[NH2+]Cc1csc(C2CC2)n1 ZINC000352446161 336219376 /nfs/dbraw/zinc/21/93/76/336219376.db2.gz BCXYOUBBSXKBPB-NSHDSACASA-N 1 2 310.875 4.513 20 0 DJADLO Cc1cccc2c1OCC[C@@H]2Nc1[nH+]ccc2ccc(F)cc21 ZINC000352446559 336219440 /nfs/dbraw/zinc/21/94/40/336219440.db2.gz WPKQDFISCYSSLN-KRWDZBQOSA-N 1 2 308.356 4.618 20 0 DJADLO Cc1cc([C@@H](C)[NH2+]Cc2csc(-c3cccs3)n2)c(C)o1 ZINC000103170622 336238245 /nfs/dbraw/zinc/23/82/45/336238245.db2.gz CAMJWXKVBNEKNB-LLVKDONJSA-N 1 2 318.467 4.932 20 0 DJADLO CCSc1ccc([C@H](C)[NH2+][C@H](C)c2nc(C(C)C)no2)cc1 ZINC000103499709 336241985 /nfs/dbraw/zinc/24/19/85/336241985.db2.gz UWRRYGPGFGLYNB-QWHCGFSZSA-N 1 2 319.474 4.717 20 0 DJADLO CC[C@@H](c1ccc(F)cc1F)[N@@H+]1CCO[C@H](c2ccsc2)C1 ZINC000532344198 336243401 /nfs/dbraw/zinc/24/34/01/336243401.db2.gz AVWGTSWDNSMICD-IRXDYDNUSA-N 1 2 323.408 4.551 20 0 DJADLO CC[C@@H](c1ccc(F)cc1F)[N@H+]1CCO[C@H](c2ccsc2)C1 ZINC000532344198 336243402 /nfs/dbraw/zinc/24/34/02/336243402.db2.gz AVWGTSWDNSMICD-IRXDYDNUSA-N 1 2 323.408 4.551 20 0 DJADLO CC[C@@H](c1ccc(F)cc1F)[N@@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000532344196 336243421 /nfs/dbraw/zinc/24/34/21/336243421.db2.gz AVWGTSWDNSMICD-DLBZAZTESA-N 1 2 323.408 4.551 20 0 DJADLO CC[C@@H](c1ccc(F)cc1F)[N@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000532344196 336243422 /nfs/dbraw/zinc/24/34/22/336243422.db2.gz AVWGTSWDNSMICD-DLBZAZTESA-N 1 2 323.408 4.551 20 0 DJADLO COc1cc(C)ccc1[C@H](C)[NH2+]Cc1c(F)cccc1Cl ZINC000532463791 336249056 /nfs/dbraw/zinc/24/90/56/336249056.db2.gz FPACGKFKLQVPJP-LBPRGKRZSA-N 1 2 307.796 4.647 20 0 DJADLO CCc1ccc([C@@H](COC)[NH2+][C@H](CC)c2ccc(F)cc2F)o1 ZINC000532524540 336254283 /nfs/dbraw/zinc/25/42/83/336254283.db2.gz DXRMYCLCJGFEEP-IAGOWNOFSA-N 1 2 323.383 4.549 20 0 DJADLO COc1ccccc1[C@H]([NH2+]Cc1ccsc1C)c1ccco1 ZINC000580349832 336259290 /nfs/dbraw/zinc/25/92/90/336259290.db2.gz VBSWUYFEUTYBIO-SFHVURJKSA-N 1 2 313.422 4.537 20 0 DJADLO CC(C)c1noc(C[N@H+]([C@@H](C)c2ccc(Cl)cc2)C2CC2)n1 ZINC000532657925 336265141 /nfs/dbraw/zinc/26/51/41/336265141.db2.gz NMBUZPNTFUHGFE-LBPRGKRZSA-N 1 2 319.836 4.572 20 0 DJADLO CC(C)c1noc(C[N@@H+]([C@@H](C)c2ccc(Cl)cc2)C2CC2)n1 ZINC000532657925 336265142 /nfs/dbraw/zinc/26/51/42/336265142.db2.gz NMBUZPNTFUHGFE-LBPRGKRZSA-N 1 2 319.836 4.572 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1cc2ccccc2o1)c1nc(C(C)(C)C)no1 ZINC000182628338 336276607 /nfs/dbraw/zinc/27/66/07/336276607.db2.gz PVAAPGZQFLWHLG-NWDGAFQWSA-N 1 2 313.401 4.525 20 0 DJADLO C[C@H]([NH2+]Cc1nc2cc(F)ccc2o1)c1cc2ccccc2o1 ZINC000182633037 336276815 /nfs/dbraw/zinc/27/68/15/336276815.db2.gz UHZHWTKLENVQQB-NSHDSACASA-N 1 2 310.328 4.564 20 0 DJADLO Cc1cc([C@H](C)Nc2cc(C)[nH+]c(-c3cccnc3)n2)c(C)s1 ZINC000301110798 336290511 /nfs/dbraw/zinc/29/05/11/336290511.db2.gz ODODTBZMXKENEE-ZDUSSCGKSA-N 1 2 324.453 4.698 20 0 DJADLO c1ccc2c(c1)ncnc2Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000301253951 336296978 /nfs/dbraw/zinc/29/69/78/336296978.db2.gz SOSDZSFVPINJAN-UHFFFAOYSA-N 1 2 314.348 4.561 20 0 DJADLO Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)Nc1cc(C)[nH+]cn1 ZINC000301277628 336298227 /nfs/dbraw/zinc/29/82/27/336298227.db2.gz SIRRRHJIUPUVQT-CYBMUJFWSA-N 1 2 324.453 4.698 20 0 DJADLO CCOc1cccc2cc([C@@H](C)Nc3cc[nH+]c(C4CC4)n3)oc21 ZINC000301282392 336298607 /nfs/dbraw/zinc/29/86/07/336298607.db2.gz YFNHBKLQZNGZGE-GFCCVEGCSA-N 1 2 323.396 4.672 20 0 DJADLO Cc1cc(N[C@H](c2cccs2)c2ccc(Cl)cc2)nc[nH+]1 ZINC000301292298 336299103 /nfs/dbraw/zinc/29/91/03/336299103.db2.gz ULAMIKPMUSRZND-INIZCTEOSA-N 1 2 315.829 4.701 20 0 DJADLO CC(C)c1nc(N[C@@H](C)c2ccc(-c3ccncc3)cc2)cc[nH+]1 ZINC000301462032 336308201 /nfs/dbraw/zinc/30/82/01/336308201.db2.gz ZEUNTUFRICIOBP-HNNXBMFYSA-N 1 2 318.424 4.835 20 0 DJADLO C[C@@H](Nc1cc(C(F)(F)F)cc[nH+]1)c1ccc(F)cc1F ZINC000301501433 336310727 /nfs/dbraw/zinc/31/07/27/336310727.db2.gz BAQVUVBDRZLUSW-MRVPVSSYSA-N 1 2 302.246 4.552 20 0 DJADLO O[C@@H](CNc1ccc2ccccc2[nH+]1)c1cc2ccccc2s1 ZINC000301611946 336318259 /nfs/dbraw/zinc/31/82/59/336318259.db2.gz FEECRUJBSSCDDX-INIZCTEOSA-N 1 2 320.417 4.595 20 0 DJADLO Cc1cnc([C@H](C)Nc2cc(C)[nH+]c3c(F)cccc23)s1 ZINC000301662562 336321544 /nfs/dbraw/zinc/32/15/44/336321544.db2.gz JZTRDVGILSZJOG-NSHDSACASA-N 1 2 301.390 4.620 20 0 DJADLO Cc1csc([C@@H](C)Nc2cc(C)[nH+]c3c(F)cccc23)n1 ZINC000301672145 336322419 /nfs/dbraw/zinc/32/24/19/336322419.db2.gz OGKLMNLKBGUVBU-LLVKDONJSA-N 1 2 301.390 4.620 20 0 DJADLO CC[C@@H](Nc1cc(C)[nH+]c2c(F)cccc12)c1c(C)noc1C ZINC000301838083 336333368 /nfs/dbraw/zinc/33/33/68/336333368.db2.gz WMJKTUQUPBUOGK-OAHLLOKOSA-N 1 2 313.376 4.850 20 0 DJADLO Cc1cc2ccccc2[nH+]c1NCc1nc(-c2ccccc2)c[nH]1 ZINC000301985345 336341482 /nfs/dbraw/zinc/34/14/82/336341482.db2.gz LGVMQCZYOLSKOJ-UHFFFAOYSA-N 1 2 314.392 4.545 20 0 DJADLO CC(C)(C)OCCCCSCc1ccc(-n2cc[nH+]c2)cc1 ZINC000352933257 336378195 /nfs/dbraw/zinc/37/81/95/336378195.db2.gz WUYKHRBSQBGVNV-UHFFFAOYSA-N 1 2 318.486 4.701 20 0 DJADLO FC(F)[C@@H](CCc1ccccc1)[NH2+][C@H]1CCCc2occc21 ZINC000353544230 336423887 /nfs/dbraw/zinc/42/38/87/336423887.db2.gz QJVFUVJNQIALKA-JKSUJKDBSA-N 1 2 305.368 4.513 20 0 DJADLO FC(F)[C@H](CCc1ccccc1)[NH2+][C@@H]1CCCc2occc21 ZINC000353544211 336423964 /nfs/dbraw/zinc/42/39/64/336423964.db2.gz QJVFUVJNQIALKA-CVEARBPZSA-N 1 2 305.368 4.513 20 0 DJADLO CC[C@@H]1CC[C@H](C)N1C(=O)c1ccc(C)c(Oc2cc[nH+]cc2)c1 ZINC000357764337 336597349 /nfs/dbraw/zinc/59/73/49/336597349.db2.gz UEUGMVLOTLWHAV-DOTOQJQBSA-N 1 2 324.424 4.585 20 0 DJADLO C[C@H]1[C@@H](C(F)(F)F)CCCN1c1[nH+]ccc2ccc(F)cc21 ZINC000359697117 336683988 /nfs/dbraw/zinc/68/39/88/336683988.db2.gz AZOIJEFRJHUBKH-HZMBPMFUSA-N 1 2 312.310 4.541 20 0 DJADLO COc1ccsc1[C@@H](C)[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC000375085667 337002977 /nfs/dbraw/zinc/00/29/77/337002977.db2.gz ZYLCMRCHMDMIAI-RDTXWAMCSA-N 1 2 324.449 4.592 20 0 DJADLO Cc1cccc([C@@H]([NH2+][C@H](C)c2cc(C)ccn2)c2ccccn2)c1 ZINC000375811368 337020233 /nfs/dbraw/zinc/02/02/33/337020233.db2.gz WGGNVDOXXDFYCR-DYESRHJHSA-N 1 2 317.436 4.534 20 0 DJADLO C[C@@H]([NH2+][C@H](c1cccs1)c1ccc(Cl)cc1)c1ncc[nH]1 ZINC000375898424 337022608 /nfs/dbraw/zinc/02/26/08/337022608.db2.gz SKFINIVAHKEYBD-ABAIWWIYSA-N 1 2 317.845 4.565 20 0 DJADLO Fc1ccc2c(c1)CC[C@@H]2[NH2+][C@H](c1nccs1)c1ccccc1 ZINC000123072665 337035216 /nfs/dbraw/zinc/03/52/16/337035216.db2.gz OORZQLDIAOBXFI-ROUUACIJSA-N 1 2 324.424 4.649 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)N1CCC[C@H](c2ccccc2)CC1 ZINC000376669971 337039332 /nfs/dbraw/zinc/03/93/32/337039332.db2.gz FGINNMOTVMSGOP-SFHVURJKSA-N 1 2 323.440 4.500 20 0 DJADLO COc1ccc([C@@H](C)[NH2+][C@H](c2nccs2)c2ccccc2)cc1 ZINC000123300540 337044370 /nfs/dbraw/zinc/04/43/70/337044370.db2.gz UXAOFGZFOBOAGP-KDOFPFPSSA-N 1 2 324.449 4.592 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)C/C=C\c1ccc(C(C)C)cc1 ZINC000425596403 337089256 /nfs/dbraw/zinc/08/92/56/337089256.db2.gz NCRLSRZBBLLMTA-WAYWQWQTSA-N 1 2 308.425 4.864 20 0 DJADLO CC(C)CCN(C(=O)c1cccc(Oc2cc[nH+]cc2)c1)C1CC1 ZINC000172000981 337090786 /nfs/dbraw/zinc/09/07/86/337090786.db2.gz IRHDNCJXYLQVTG-UHFFFAOYSA-N 1 2 324.424 4.525 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1cccc(F)c1)c1ncc(-c2ccccc2)o1 ZINC000172581917 337130027 /nfs/dbraw/zinc/13/00/27/337130027.db2.gz XALDIWKZWLDEEC-ZIAGYGMSSA-N 1 2 310.372 4.893 20 0 DJADLO C[C@H]([NH2+]Cc1cccc(Cl)c1)c1ncc(-c2ccccc2)o1 ZINC000173796182 337138300 /nfs/dbraw/zinc/13/83/00/337138300.db2.gz MCDITWFUSWZTQU-ZDUSSCGKSA-N 1 2 312.800 4.846 20 0 DJADLO Cc1cc(C)cc(C[NH2+][C@@H](C)c2nc(C3CCCCC3)no2)c1 ZINC000173865118 337138729 /nfs/dbraw/zinc/13/87/29/337138729.db2.gz KHPYLYZGPBSUHQ-HNNXBMFYSA-N 1 2 313.445 4.585 20 0 DJADLO C[C@H]([NH2+][C@H](c1nccs1)c1ccccc1)c1ccsc1 ZINC000178197769 337161251 /nfs/dbraw/zinc/16/12/51/337161251.db2.gz GKIWLJXYDMSMKW-WFASDCNBSA-N 1 2 300.452 4.645 20 0 DJADLO CC(C)c1csc(C[NH2+][C@H](c2ccccc2)c2ccccn2)n1 ZINC000180787654 337177886 /nfs/dbraw/zinc/17/78/86/337177886.db2.gz HAJSCCRPTFMCFF-LJQANCHMSA-N 1 2 323.465 4.541 20 0 DJADLO Cc1csc([C@@H](C)[NH2+]Cc2ccc(Oc3ccccc3)o2)n1 ZINC000180855689 337178178 /nfs/dbraw/zinc/17/81/78/337178178.db2.gz IIMHBLBQHLSSCC-CYBMUJFWSA-N 1 2 314.410 4.688 20 0 DJADLO C[C@H]([NH2+]Cc1cc(C(F)(F)F)ccc1Cl)c1cscn1 ZINC000583034601 337231915 /nfs/dbraw/zinc/23/19/15/337231915.db2.gz IWSLFAURGLISQI-QMMMGPOBSA-N 1 2 320.767 4.666 20 0 DJADLO C[N@H+](Cc1sc2ccccc2c1Cl)Cc1ccccn1 ZINC000584438378 337325311 /nfs/dbraw/zinc/32/53/11/337325311.db2.gz VELAEIKCTPQSLR-UHFFFAOYSA-N 1 2 302.830 4.582 20 0 DJADLO C[N@@H+](Cc1sc2ccccc2c1Cl)Cc1ccccn1 ZINC000584438378 337325312 /nfs/dbraw/zinc/32/53/12/337325312.db2.gz VELAEIKCTPQSLR-UHFFFAOYSA-N 1 2 302.830 4.582 20 0 DJADLO C[C@H]([NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1)c1nc2c(s1)CCCC2 ZINC000584486159 337349784 /nfs/dbraw/zinc/34/97/84/337349784.db2.gz RSTIJZDNFWVMPD-SGMGOOAPSA-N 1 2 316.470 4.589 20 0 DJADLO Cc1nc([C@H](C)[NH2+][C@@H](C)c2ccccc2OC(C)C)cs1 ZINC000037118918 337363208 /nfs/dbraw/zinc/36/32/08/337363208.db2.gz NYCQYTUEQRMHFX-STQMWFEESA-N 1 2 304.459 4.651 20 0 DJADLO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1csc(C(C)C)n1)CCC2 ZINC000111311321 337389562 /nfs/dbraw/zinc/38/95/62/337389562.db2.gz BUCBWQQKUXPAPE-AWEZNQCLSA-N 1 2 321.515 4.541 20 0 DJADLO Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1csc(C(C)C)n1)CCC2 ZINC000111311321 337389563 /nfs/dbraw/zinc/38/95/63/337389563.db2.gz BUCBWQQKUXPAPE-AWEZNQCLSA-N 1 2 321.515 4.541 20 0 DJADLO c1csc([C@@H]([NH2+][C@@H]2CCc3ccccc32)c2ccccc2)n1 ZINC000123146671 337397858 /nfs/dbraw/zinc/39/78/58/337397858.db2.gz QAQWDLSOHLOIDB-MSOLQXFVSA-N 1 2 306.434 4.510 20 0 DJADLO c1csc([C@@H]([NH2+][C@H]2CCc3ccccc32)c2ccccc2)n1 ZINC000123147095 337397908 /nfs/dbraw/zinc/39/79/08/337397908.db2.gz QAQWDLSOHLOIDB-ROUUACIJSA-N 1 2 306.434 4.510 20 0 DJADLO COc1cc[nH+]cc1CSCc1cccc(C(F)(F)F)c1 ZINC000572036716 337587622 /nfs/dbraw/zinc/58/76/22/337587622.db2.gz AFONMUVFBKNITI-UHFFFAOYSA-N 1 2 313.344 4.542 20 0 DJADLO FC(F)(F)Cc1ccc(N[C@@H]2CCc3ccc[nH+]c3CC2)cc1 ZINC000421831398 337649316 /nfs/dbraw/zinc/64/93/16/337649316.db2.gz DWSLXLPSGRKORY-MRXNPFEDSA-N 1 2 320.358 4.546 20 0 DJADLO Cc1nc(C(C)(C)C)sc1[C@@H](C)Nc1ccc2c(c1)CC[NH2+]2 ZINC000423220496 337705193 /nfs/dbraw/zinc/70/51/93/337705193.db2.gz VIKILWJVRJYBIM-LLVKDONJSA-N 1 2 315.486 4.890 20 0 DJADLO COc1cccc2cc([C@H](C)Nc3ccc4c(c3)CC[NH2+]4)oc21 ZINC000423219846 337705242 /nfs/dbraw/zinc/70/52/42/337705242.db2.gz URUGHNSHBIWGRF-LBPRGKRZSA-N 1 2 308.381 4.583 20 0 DJADLO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2cc(F)c(Cl)cc2F)o1 ZINC000433195350 337718713 /nfs/dbraw/zinc/71/87/13/337718713.db2.gz UDTNKQOOQMUVCM-BXKDBHETSA-N 1 2 311.759 4.624 20 0 DJADLO CC(C)Oc1c(Cl)cccc1NCc1c[nH+]cn1C(C)C ZINC000424136360 337756101 /nfs/dbraw/zinc/75/61/01/337756101.db2.gz ALNQLESBHVXGDJ-UHFFFAOYSA-N 1 2 307.825 4.517 20 0 DJADLO CC(C)c1nc([C@H](C)[NH2+][C@@H](c2ccccn2)C2CCC2)cs1 ZINC000527968452 337781035 /nfs/dbraw/zinc/78/10/35/337781035.db2.gz RNCYBMUMKJRAGQ-SUMWQHHRSA-N 1 2 315.486 4.854 20 0 DJADLO CC(C)c1nc([C@@H](C)[NH2+][C@H](c2ccccn2)C2CCC2)cs1 ZINC000527968450 337781050 /nfs/dbraw/zinc/78/10/50/337781050.db2.gz RNCYBMUMKJRAGQ-DYVFJYSZSA-N 1 2 315.486 4.854 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1ncccc1F)c1ccc(Cl)cc1Cl ZINC000528036140 337782541 /nfs/dbraw/zinc/78/25/41/337782541.db2.gz OIHXASBFKZCYJN-UWVGGRQHSA-N 1 2 313.203 4.939 20 0 DJADLO Cc1csc(-c2cccc(NCc3c[nH+]cn3C(C)C)c2)n1 ZINC000424162596 337787224 /nfs/dbraw/zinc/78/72/24/337787224.db2.gz ZRZGRSNKOAAIRC-UHFFFAOYSA-N 1 2 312.442 4.508 20 0 DJADLO Cc1ccc(-c2nc(C[NH2+]C3(c4ccc(F)cc4)CC3)co2)cc1 ZINC000533068451 337808231 /nfs/dbraw/zinc/80/82/31/337808231.db2.gz REMNKWDARZPWJO-UHFFFAOYSA-N 1 2 322.383 4.568 20 0 DJADLO CCc1nc([C@@H](C)[NH2+][C@H](C)c2ccc(OC)cc2Cl)cs1 ZINC000424327703 337821624 /nfs/dbraw/zinc/82/16/24/337821624.db2.gz ZIGZWFYSZNKELF-GHMZBOCLSA-N 1 2 324.877 4.779 20 0 DJADLO CCc1nc(C[NH2+][C@@H](c2ccc([C@H](C)CC)cc2)C(C)C)no1 ZINC000533334314 337842631 /nfs/dbraw/zinc/84/26/31/337842631.db2.gz UYJMJSUNJVSIBJ-AUUYWEPGSA-N 1 2 315.461 4.632 20 0 DJADLO Cc1c[nH+]ccc1NC(=O)N[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000120378440 337872959 /nfs/dbraw/zinc/87/29/59/337872959.db2.gz DQUFZUJDPUCTDE-JTQLQIEISA-N 1 2 324.211 4.580 20 0 DJADLO CC[C@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1cc(F)ccc1F ZINC000090547134 337882485 /nfs/dbraw/zinc/88/24/85/337882485.db2.gz KLOJDEGHJOFDSB-SFHVURJKSA-N 1 2 319.399 4.517 20 0 DJADLO Cc1nc(C[NH2+][C@@H](c2ccc(F)cc2F)C(C)(C)C)c(C)s1 ZINC000537123903 337893333 /nfs/dbraw/zinc/89/33/33/337893333.db2.gz NVWRUGRYZBJKAT-INIZCTEOSA-N 1 2 324.440 4.915 20 0 DJADLO CC(C)CCc1nc(C[NH2+][C@@H](C)c2cccc(F)c2F)cs1 ZINC000537128555 337894224 /nfs/dbraw/zinc/89/42/24/337894224.db2.gz LFMSKEAHXCTEEN-LBPRGKRZSA-N 1 2 324.440 4.861 20 0 DJADLO Cc1cnc(C[NH2+][C@@H](C)c2cc(Cl)sc2Cl)s1 ZINC000122925498 337930602 /nfs/dbraw/zinc/93/06/02/337930602.db2.gz DKMNSPZBFZCKAI-ZETCQYMHSA-N 1 2 307.271 4.671 20 0 DJADLO Cc1ccsc1[C@@H](C)Nc1ccc(N2CCCCC2)c[nH+]1 ZINC000537425336 337935796 /nfs/dbraw/zinc/93/57/96/337935796.db2.gz MVBUKFUURKOITB-CQSZACIVSA-N 1 2 301.459 4.615 20 0 DJADLO CC1(C)CC[C@H](C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000514222843 337966636 /nfs/dbraw/zinc/96/66/36/337966636.db2.gz NKKZNLAHXFOCRF-AWEZNQCLSA-N 1 2 310.397 4.639 20 0 DJADLO FC(F)c1ccc(CNc2ccc(N3CCCCC3)[nH+]c2)cc1 ZINC000321946355 337980996 /nfs/dbraw/zinc/98/09/96/337980996.db2.gz NGFVWRHAXXEHJB-UHFFFAOYSA-N 1 2 317.383 4.622 20 0 DJADLO Cc1cc[nH+]cc1CCCNc1cccc(CCC(F)(F)F)c1 ZINC000515710575 337996383 /nfs/dbraw/zinc/99/63/83/337996383.db2.gz SJGMRVKNTARHIP-UHFFFAOYSA-N 1 2 322.374 4.930 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)[C@@H](C)c1ccc(CC(C)C)cc1 ZINC000425596618 338015758 /nfs/dbraw/zinc/01/57/58/338015758.db2.gz OBCXIHZAYCKSPP-HNNXBMFYSA-N 1 2 310.441 4.639 20 0 DJADLO Cc1cc[nH+]c(C)c1NC(=O)c1ccc([C@H](C)C(F)(F)F)cc1 ZINC000425594275 338015826 /nfs/dbraw/zinc/01/58/26/338015826.db2.gz GLHCVSLYEVGGJC-NSHDSACASA-N 1 2 322.330 4.617 20 0 DJADLO Cc1ccc2cc([C@H](C)[NH2+]Cc3ccn(C4CCCC4)n3)oc2c1 ZINC000426062375 338020258 /nfs/dbraw/zinc/02/02/58/338020258.db2.gz MNFFZTOHFSTORT-HNNXBMFYSA-N 1 2 323.440 4.904 20 0 DJADLO C[C@@H]([NH2+]Cc1ccc(-c2ccccc2)cc1F)c1nccs1 ZINC000426286405 338024673 /nfs/dbraw/zinc/02/46/73/338024673.db2.gz NSNXRGIBCKZWNO-CYBMUJFWSA-N 1 2 312.413 4.800 20 0 DJADLO CCCc1csc(C[N@H+](C)[C@H](C)c2sc(CC)nc2C)n1 ZINC000426416319 338031308 /nfs/dbraw/zinc/03/13/08/338031308.db2.gz HOSXYPQKZPRXSG-GFCCVEGCSA-N 1 2 323.531 4.616 20 0 DJADLO CCCc1csc(C[N@@H+](C)[C@H](C)c2sc(CC)nc2C)n1 ZINC000426416319 338031309 /nfs/dbraw/zinc/03/13/09/338031309.db2.gz HOSXYPQKZPRXSG-GFCCVEGCSA-N 1 2 323.531 4.616 20 0 DJADLO Cc1nc(C(C)C)oc1C[NH2+][C@@H](C)c1nc(C(C)(C)C)cs1 ZINC000428360413 338048660 /nfs/dbraw/zinc/04/86/60/338048660.db2.gz LBJXEJAGXGTGPX-LBPRGKRZSA-N 1 2 321.490 4.711 20 0 DJADLO CCCc1nc(C)c(C[NH2+][C@H](C)c2nc(C(C)(C)C)cs2)o1 ZINC000428360397 338048725 /nfs/dbraw/zinc/04/87/25/338048725.db2.gz KYYOEJNMQDNKOV-GFCCVEGCSA-N 1 2 321.490 4.540 20 0 DJADLO CCc1nc(C)c(C[N@H+](Cc2ccco2)Cc2cccc(C)c2)o1 ZINC000428377200 338049505 /nfs/dbraw/zinc/04/95/05/338049505.db2.gz XGNISABZKVPJKW-UHFFFAOYSA-N 1 2 324.424 4.649 20 0 DJADLO CCc1nc(C)c(C[N@@H+](Cc2ccco2)Cc2cccc(C)c2)o1 ZINC000428377200 338049506 /nfs/dbraw/zinc/04/95/06/338049506.db2.gz XGNISABZKVPJKW-UHFFFAOYSA-N 1 2 324.424 4.649 20 0 DJADLO Fc1ccc2cc[nH+]c(NC[C@@H]3CCO[C@H]3c3ccccc3)c2c1 ZINC000428660567 338057975 /nfs/dbraw/zinc/05/79/75/338057975.db2.gz CLAHXWRNIBLBNP-LPHOPBHVSA-N 1 2 322.383 4.564 20 0 DJADLO CCCCc1nc(C[NH2+]C(C)(C)c2ccccc2F)cs1 ZINC000429228300 338074020 /nfs/dbraw/zinc/07/40/20/338074020.db2.gz SMBXLSJDQCACGB-UHFFFAOYSA-N 1 2 306.450 4.650 20 0 DJADLO Cc1cc[nH+]cc1CCCNc1cccc(-c2nccs2)c1 ZINC000429836929 338090902 /nfs/dbraw/zinc/09/09/02/338090902.db2.gz ATHMEGRDCUFAGP-UHFFFAOYSA-N 1 2 309.438 4.558 20 0 DJADLO CC(C)c1ccsc1C(=O)Nc1ccc(-c2[nH]cc[nH+]2)cc1 ZINC000162833495 338136433 /nfs/dbraw/zinc/13/64/33/338136433.db2.gz YTNYDPKGNFTTOG-UHFFFAOYSA-N 1 2 311.410 4.514 20 0 DJADLO CC[C@H]([NH2+]Cc1ccc(F)c(Cl)c1Cl)c1nccs1 ZINC000432238065 338149762 /nfs/dbraw/zinc/14/97/62/338149762.db2.gz MRYSDRVHIMLYQX-JTQLQIEISA-N 1 2 319.232 4.830 20 0 DJADLO Cc1cnc(C(C)(C)[NH2+]Cc2csc(Cl)c2Cl)s1 ZINC000432254680 338151308 /nfs/dbraw/zinc/15/13/08/338151308.db2.gz VCLLRFJGYCYCHD-UHFFFAOYSA-N 1 2 321.298 4.845 20 0 DJADLO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1csc(Cl)c1Cl ZINC000432738676 338165192 /nfs/dbraw/zinc/16/51/92/338165192.db2.gz LXEUIAUFFFPDMU-SECBINFHSA-N 1 2 316.253 4.954 20 0 DJADLO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1csc(Cl)c1Cl ZINC000432738676 338165193 /nfs/dbraw/zinc/16/51/93/338165193.db2.gz LXEUIAUFFFPDMU-SECBINFHSA-N 1 2 316.253 4.954 20 0 DJADLO C[C@@H](c1cccnc1)[N@H+](C)Cc1ccc(F)c(Cl)c1Cl ZINC000432915648 338172843 /nfs/dbraw/zinc/17/28/43/338172843.db2.gz FZTNHQGYVGHBEZ-JTQLQIEISA-N 1 2 313.203 4.721 20 0 DJADLO C[C@@H](c1cccnc1)[N@@H+](C)Cc1ccc(F)c(Cl)c1Cl ZINC000432915648 338172844 /nfs/dbraw/zinc/17/28/44/338172844.db2.gz FZTNHQGYVGHBEZ-JTQLQIEISA-N 1 2 313.203 4.721 20 0 DJADLO C[C@H](c1ccccn1)[N@H+](C)Cc1ccc(F)c(Cl)c1Cl ZINC000432918885 338173122 /nfs/dbraw/zinc/17/31/22/338173122.db2.gz QYQDRVKLFTWCHJ-SNVBAGLBSA-N 1 2 313.203 4.721 20 0 DJADLO C[C@H](c1ccccn1)[N@@H+](C)Cc1ccc(F)c(Cl)c1Cl ZINC000432918885 338173123 /nfs/dbraw/zinc/17/31/23/338173123.db2.gz QYQDRVKLFTWCHJ-SNVBAGLBSA-N 1 2 313.203 4.721 20 0 DJADLO CC(C)O[C@H](C[NH2+][C@H](c1ccccc1)C(F)F)c1ccccc1 ZINC000433052519 338178743 /nfs/dbraw/zinc/17/87/43/338178743.db2.gz MRJXGWIEUYSTGT-QZTJIDSGSA-N 1 2 319.395 4.749 20 0 DJADLO CC(C)[C@@H]([NH2+][C@@H](C)c1nc(C2CC2)no1)c1ccc(Cl)cc1 ZINC000433782602 338201750 /nfs/dbraw/zinc/20/17/50/338201750.db2.gz JRVOOSAUDDFRCB-XHDPSFHLSA-N 1 2 319.836 4.648 20 0 DJADLO CC[C@@H](Nc1[nH+]c(C)nc2[nH]ccc21)c1ccc(Cl)s1 ZINC000433790355 338202049 /nfs/dbraw/zinc/20/20/49/338202049.db2.gz WGOGGLIIMBICJD-SNVBAGLBSA-N 1 2 306.822 4.544 20 0 DJADLO Cc1cc(N[C@H](C)c2cccc(OCc3ccccc3)c2)nc[nH+]1 ZINC000433803095 338202427 /nfs/dbraw/zinc/20/24/27/338202427.db2.gz BSUNWBDSIJNHIL-MRXNPFEDSA-N 1 2 319.408 4.537 20 0 DJADLO CC(C)[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1ncc(Cl)s1 ZINC000434612248 338221037 /nfs/dbraw/zinc/22/10/37/338221037.db2.gz PUZKRRWYQVOZLL-HNNXBMFYSA-N 1 2 312.841 4.765 20 0 DJADLO CC(C)[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1ncc(Cl)s1 ZINC000434612248 338221038 /nfs/dbraw/zinc/22/10/38/338221038.db2.gz PUZKRRWYQVOZLL-HNNXBMFYSA-N 1 2 312.841 4.765 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1nccs1)c1cc(Cl)sc1Cl ZINC000153352871 338223062 /nfs/dbraw/zinc/22/30/62/338223062.db2.gz NVHGOVSXORHLKW-BQBZGAKWSA-N 1 2 307.271 4.923 20 0 DJADLO CCc1ccccc1C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000153737614 338229486 /nfs/dbraw/zinc/22/94/86/338229486.db2.gz AIPCMNJLYOBHNO-UHFFFAOYSA-N 1 2 318.376 4.689 20 0 DJADLO Cc1ccc([C@@H](C)[N@H+](C)Cc2ncc(C(F)(F)F)s2)cc1 ZINC000435134215 338232978 /nfs/dbraw/zinc/23/29/78/338232978.db2.gz GHQTZEIFTMRSLO-LLVKDONJSA-N 1 2 314.376 4.663 20 0 DJADLO Cc1ccc([C@@H](C)[N@@H+](C)Cc2ncc(C(F)(F)F)s2)cc1 ZINC000435134215 338232979 /nfs/dbraw/zinc/23/29/79/338232979.db2.gz GHQTZEIFTMRSLO-LLVKDONJSA-N 1 2 314.376 4.663 20 0 DJADLO Cc1cc(C)c(NC(=O)N[C@H](C)c2cccc(Cl)c2)c(C)[nH+]1 ZINC000436486169 338273873 /nfs/dbraw/zinc/27/38/73/338273873.db2.gz BKMPYXNUESEFEY-GFCCVEGCSA-N 1 2 317.820 4.543 20 0 DJADLO Cc1cc(C)c(NC(=O)N2CCC[C@H]2c2ccccc2C)c(C)[nH+]1 ZINC000436497103 338274333 /nfs/dbraw/zinc/27/43/33/338274333.db2.gz RWADFZPUGVFRBJ-SFHVURJKSA-N 1 2 323.440 4.684 20 0 DJADLO Cc1cc(C)c(NC(=O)N[C@@H](C)c2cc3ccccc3o2)c(C)[nH+]1 ZINC000436495895 338274393 /nfs/dbraw/zinc/27/43/93/338274393.db2.gz PKCYTUOAHLRLLF-ZDUSSCGKSA-N 1 2 323.396 4.636 20 0 DJADLO CCSCc1cc[nH+]c(NCc2ccc3nc(C)ccc3c2)c1 ZINC000437805956 338322249 /nfs/dbraw/zinc/32/22/49/338322249.db2.gz WVZQVNJPALHWRZ-UHFFFAOYSA-N 1 2 323.465 4.803 20 0 DJADLO CCc1ccc(-c2ccc(C[N@@H+]3CCC[C@H]3c3ncc[nH]3)o2)cc1 ZINC000437966322 338326701 /nfs/dbraw/zinc/32/67/01/338326701.db2.gz VZMYBSAMXMAAIQ-SFHVURJKSA-N 1 2 321.424 4.569 20 0 DJADLO CCc1ccc(-c2ccc(C[N@H+]3CCC[C@H]3c3ncc[nH]3)o2)cc1 ZINC000437966322 338326702 /nfs/dbraw/zinc/32/67/02/338326702.db2.gz VZMYBSAMXMAAIQ-SFHVURJKSA-N 1 2 321.424 4.569 20 0 DJADLO Clc1ccc2nc([C@H]3CCC[N@@H+]3Cc3cccs3)[nH]c2c1 ZINC000438285823 338338747 /nfs/dbraw/zinc/33/87/47/338338747.db2.gz SGQWHBNRKWKQCV-OAHLLOKOSA-N 1 2 317.845 4.615 20 0 DJADLO Clc1ccc2nc([C@H]3CCC[N@H+]3Cc3cccs3)[nH]c2c1 ZINC000438285823 338338748 /nfs/dbraw/zinc/33/87/48/338338748.db2.gz SGQWHBNRKWKQCV-OAHLLOKOSA-N 1 2 317.845 4.615 20 0 DJADLO Clc1c2ccccc2sc1C[N@@H+]1CCc2ncsc2C1 ZINC000438370287 338341833 /nfs/dbraw/zinc/34/18/33/338341833.db2.gz BSMYKRWOLNXFOQ-UHFFFAOYSA-N 1 2 320.870 4.570 20 0 DJADLO Clc1c2ccccc2sc1C[N@H+]1CCc2ncsc2C1 ZINC000438370287 338341834 /nfs/dbraw/zinc/34/18/34/338341834.db2.gz BSMYKRWOLNXFOQ-UHFFFAOYSA-N 1 2 320.870 4.570 20 0 DJADLO CC(C)CCc1nc(C[NH2+]C2(c3ccc(F)cc3)CC2)cs1 ZINC000440289186 338385053 /nfs/dbraw/zinc/38/50/53/338385053.db2.gz FCHLFPCGZQFQIB-UHFFFAOYSA-N 1 2 318.461 4.650 20 0 DJADLO CC(C)c1ncc(C[N@H+](C)Cc2cccc(Cl)c2Cl)cn1 ZINC000440465782 338387813 /nfs/dbraw/zinc/38/78/13/338387813.db2.gz KDCYDJNOXMMTBJ-UHFFFAOYSA-N 1 2 324.255 4.539 20 0 DJADLO CC(C)c1ncc(C[N@@H+](C)Cc2cccc(Cl)c2Cl)cn1 ZINC000440465782 338387814 /nfs/dbraw/zinc/38/78/14/338387814.db2.gz KDCYDJNOXMMTBJ-UHFFFAOYSA-N 1 2 324.255 4.539 20 0 DJADLO Cc1cc2[nH+]cn([C@H](C)c3nc(C4CCC4)cs3)c2cc1C ZINC000440532873 338389517 /nfs/dbraw/zinc/38/95/17/338389517.db2.gz HJLLNFNHCASQBL-CYBMUJFWSA-N 1 2 311.454 4.986 20 0 DJADLO CC(C)CC1(C(=O)Nc2ccc(Oc3cc[nH+]cc3)cc2)CC1 ZINC000440723198 338396092 /nfs/dbraw/zinc/39/60/92/338396092.db2.gz CFVISMWPJCJJJG-UHFFFAOYSA-N 1 2 310.397 4.639 20 0 DJADLO Cc1cc(N[C@@H](c2[nH]cc[nH+]2)c2ccccc2)cc(C)c1Cl ZINC000442794433 338432031 /nfs/dbraw/zinc/43/20/31/338432031.db2.gz AHSQEZUVSZGMTE-QGZVFWFLSA-N 1 2 311.816 4.881 20 0 DJADLO Cc1ccc(NC(=O)[C@H]2C[C@@H]2c2ccc3ccccc3c2)c(C)[nH+]1 ZINC000446437386 338528109 /nfs/dbraw/zinc/52/81/09/338528109.db2.gz HKQLWYLTCJIVLB-MOPGFXCFSA-N 1 2 316.404 4.594 20 0 DJADLO CCCN(C(=O)Nc1ccc(C)[nH+]c1C)[C@@H]1CCc2ccccc21 ZINC000447193343 338547288 /nfs/dbraw/zinc/54/72/88/338547288.db2.gz OPIFCWIZQUSWNB-LJQANCHMSA-N 1 2 323.440 4.630 20 0 DJADLO Cc1ccc(NC(=O)N2CCC[C@@H]2CC2CCCCC2)c(C)[nH+]1 ZINC000447193628 338547316 /nfs/dbraw/zinc/54/73/16/338547316.db2.gz PRARNEBJPJWCIA-QGZVFWFLSA-N 1 2 315.461 4.665 20 0 DJADLO CSc1ccc(F)cc1C[NH2+]Cc1ncc(C(C)(C)C)s1 ZINC000447946384 338572528 /nfs/dbraw/zinc/57/25/28/338572528.db2.gz UYROZARHAMLQFL-UHFFFAOYSA-N 1 2 324.490 4.591 20 0 DJADLO Fc1ccccc1C1([NH2+][C@@H]2CCc3cc(F)c(F)c(F)c32)CC1 ZINC000449161954 338598170 /nfs/dbraw/zinc/59/81/70/338598170.db2.gz QGTDDDXXOUNPRX-CQSZACIVSA-N 1 2 321.317 4.509 20 0 DJADLO C[C@@H]([NH2+]Cc1cc(Cl)sc1Cl)c1c(F)cncc1F ZINC000449322884 338612860 /nfs/dbraw/zinc/61/28/60/338612860.db2.gz ZPMVJWMIOKQVDX-ZCFIWIBFSA-N 1 2 323.195 4.579 20 0 DJADLO CCCc1csc(C[NH2+][C@@H](C)c2ccc(F)cc2Cl)n1 ZINC000449349942 338616341 /nfs/dbraw/zinc/61/63/41/338616341.db2.gz SIPBAKWNENIYOX-JTQLQIEISA-N 1 2 312.841 4.739 20 0 DJADLO c1ccc(N2Cc3cccc(NCC4=CCCCC4)c3C2)[nH+]c1 ZINC000453093070 338792942 /nfs/dbraw/zinc/79/29/42/338792942.db2.gz DZLSIXPJRNFREG-UHFFFAOYSA-N 1 2 305.425 4.514 20 0 DJADLO C[C@H]([NH2+][C@H](c1c(Cl)cccc1Cl)C1CC1)c1ccncn1 ZINC000453254088 338814745 /nfs/dbraw/zinc/81/47/45/338814745.db2.gz OWKDXCGTPLGPKK-QFYYESIMSA-N 1 2 322.239 4.585 20 0 DJADLO CCn1ccnc1[C@H](C)[NH2+][C@@H]1CCc2cc(Cl)cc(Cl)c21 ZINC000453331734 338826172 /nfs/dbraw/zinc/82/61/72/338826172.db2.gz ADOZPEOBEBXTKI-IINYFYTJSA-N 1 2 324.255 4.548 20 0 DJADLO CCCc1ncc(C[NH2+][C@H](C)c2ccc(Cl)cc2Cl)o1 ZINC000453384848 338835919 /nfs/dbraw/zinc/83/59/19/338835919.db2.gz NICDCAHWVHVPTE-SNVBAGLBSA-N 1 2 313.228 4.785 20 0 DJADLO c1nc(C[N@@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)oc1C1CC1 ZINC000459591034 339037744 /nfs/dbraw/zinc/03/77/44/339037744.db2.gz ZJDNUWLSNUKBND-IBGZPJMESA-N 1 2 308.425 4.669 20 0 DJADLO c1nc(C[N@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)oc1C1CC1 ZINC000459591034 339037745 /nfs/dbraw/zinc/03/77/45/339037745.db2.gz ZJDNUWLSNUKBND-IBGZPJMESA-N 1 2 308.425 4.669 20 0 DJADLO Cc1ncc(C[NH2+]Cc2ccc(-c3ccc(C(C)(C)C)cc3)o2)o1 ZINC000459673140 339042311 /nfs/dbraw/zinc/04/23/11/339042311.db2.gz IUHYMVMIGFVITQ-UHFFFAOYSA-N 1 2 324.424 4.830 20 0 DJADLO CCC[C@H](C)C(=O)Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000498181655 339061693 /nfs/dbraw/zinc/06/16/93/339061693.db2.gz IAAJOPKPTIWJEF-LBPRGKRZSA-N 1 2 318.804 4.902 20 0 DJADLO Cc1noc([C@@H](C)[NH2+]Cc2ccc(-c3cc(C)cc(C)c3)cc2)n1 ZINC000462751451 339086812 /nfs/dbraw/zinc/08/68/12/339086812.db2.gz XRVYOTJWEPGPOH-OAHLLOKOSA-N 1 2 321.424 4.513 20 0 DJADLO COc1cccc([C@H](Nc2cccc[nH+]2)c2ccccc2Cl)c1 ZINC000462895653 339096619 /nfs/dbraw/zinc/09/66/19/339096619.db2.gz RHTZHSNAUZCVAQ-IBGZPJMESA-N 1 2 324.811 4.945 20 0 DJADLO C[C@H]([NH2+][C@@H]1CCOc2c(F)ccc(F)c21)c1ccccc1Cl ZINC000462955261 339099039 /nfs/dbraw/zinc/09/90/39/339099039.db2.gz IMPBRHMANGSBSE-ZUZCIYMTSA-N 1 2 323.770 4.793 20 0 DJADLO Cc1[nH+]cn(-c2ccc(N[C@H](C)CCC(F)(F)F)cc2)c1C ZINC000463030770 339101867 /nfs/dbraw/zinc/10/18/67/339101867.db2.gz ADGGIUQAMMUOCI-LLVKDONJSA-N 1 2 311.351 4.632 20 0 DJADLO C[C@@H](SCc1[nH+]ccn1C)c1ccc(Cl)c(Cl)c1 ZINC000463192884 339108805 /nfs/dbraw/zinc/10/88/05/339108805.db2.gz MPPYUXPNFKKZOZ-SECBINFHSA-N 1 2 301.242 4.721 20 0 DJADLO CC[C@H]1c2ccsc2CC[N@H+]1Cc1nc2cc(F)ccc2o1 ZINC000464865471 339158919 /nfs/dbraw/zinc/15/89/19/339158919.db2.gz GVFHWTHKBWJIMX-AWEZNQCLSA-N 1 2 316.401 4.538 20 0 DJADLO CC[C@H]1c2ccsc2CC[N@@H+]1Cc1nc2cc(F)ccc2o1 ZINC000464865471 339158920 /nfs/dbraw/zinc/15/89/20/339158920.db2.gz GVFHWTHKBWJIMX-AWEZNQCLSA-N 1 2 316.401 4.538 20 0 DJADLO CC[N@H+](Cc1ccc(Cl)s1)Cc1nc2cc(F)ccc2o1 ZINC000464866736 339159133 /nfs/dbraw/zinc/15/91/33/339159133.db2.gz GFEOEHPHFCGEGG-UHFFFAOYSA-N 1 2 324.808 4.704 20 0 DJADLO CC[N@@H+](Cc1ccc(Cl)s1)Cc1nc2cc(F)ccc2o1 ZINC000464866736 339159134 /nfs/dbraw/zinc/15/91/34/339159134.db2.gz GFEOEHPHFCGEGG-UHFFFAOYSA-N 1 2 324.808 4.704 20 0 DJADLO CC(C)[N@H+](Cc1nc2ccc(F)cc2o1)Cc1ccccc1F ZINC000466820732 339218084 /nfs/dbraw/zinc/21/80/84/339218084.db2.gz CEJJAVGYXBLTLP-UHFFFAOYSA-N 1 2 316.351 4.517 20 0 DJADLO CC(C)[N@@H+](Cc1nc2ccc(F)cc2o1)Cc1ccccc1F ZINC000466820732 339218085 /nfs/dbraw/zinc/21/80/85/339218085.db2.gz CEJJAVGYXBLTLP-UHFFFAOYSA-N 1 2 316.351 4.517 20 0 DJADLO O=C(Nc1cccc(-c2[nH]cc[nH+]2)c1)c1cccc2ccsc21 ZINC000467288074 339230048 /nfs/dbraw/zinc/23/00/48/339230048.db2.gz MCJMYSCDKLVZDV-UHFFFAOYSA-N 1 2 319.389 4.544 20 0 DJADLO COc1cc(N[C@H]2CCC[C@H](c3[nH+]cccc3C)C2)ccc1F ZINC000467368374 339234518 /nfs/dbraw/zinc/23/45/18/339234518.db2.gz VDHAKVSDSCKHQS-GJZGRUSLSA-N 1 2 314.404 4.676 20 0 DJADLO C[C@@H](c1ccccc1Cl)[N@@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000468127962 339254912 /nfs/dbraw/zinc/25/49/12/339254912.db2.gz CSRPQQIDZYOWBV-BLLLJJGKSA-N 1 2 307.846 4.536 20 0 DJADLO C[C@@H](c1ccccc1Cl)[N@H+]1CCO[C@@H](c2ccsc2)C1 ZINC000468127962 339254913 /nfs/dbraw/zinc/25/49/13/339254913.db2.gz CSRPQQIDZYOWBV-BLLLJJGKSA-N 1 2 307.846 4.536 20 0 DJADLO C[C@H]1CC[C@@H](CC(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)C1 ZINC000468842595 339272485 /nfs/dbraw/zinc/27/24/85/339272485.db2.gz GRFQHGIOWVZYRB-LSDHHAIUSA-N 1 2 310.397 4.639 20 0 DJADLO CC(C)[C@H]([NH2+]CC1CCC(C(F)(F)F)CC1)C(F)(F)F ZINC000469196499 339282778 /nfs/dbraw/zinc/28/27/78/339282778.db2.gz WEYOUNWEKMDJHC-ILDUYXDCSA-N 1 2 305.306 4.532 20 0 DJADLO CC(C)c1nc(C[N@@H+]2CC[C@@H](c3c(F)cccc3F)C2)cs1 ZINC000469461818 339290323 /nfs/dbraw/zinc/29/03/23/339290323.db2.gz YNUTUTXNPKTVHK-GFCCVEGCSA-N 1 2 322.424 4.534 20 0 DJADLO CC(C)c1nc(C[N@H+]2CC[C@@H](c3c(F)cccc3F)C2)cs1 ZINC000469461818 339290324 /nfs/dbraw/zinc/29/03/24/339290324.db2.gz YNUTUTXNPKTVHK-GFCCVEGCSA-N 1 2 322.424 4.534 20 0 DJADLO C[C@@H]1CCC[C@H]1CC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000469508640 339292149 /nfs/dbraw/zinc/29/21/49/339292149.db2.gz NTMWMGYQILKTDY-CABCVRRESA-N 1 2 310.397 4.639 20 0 DJADLO Fc1ccc(C[N@H+](Cc2ccccc2)Cc2ccccc2F)nc1 ZINC000469613431 339294607 /nfs/dbraw/zinc/29/46/07/339294607.db2.gz MREINUJBASMGSJ-UHFFFAOYSA-N 1 2 324.374 4.562 20 0 DJADLO Fc1ccc(C[N@@H+](Cc2ccccc2)Cc2ccccc2F)nc1 ZINC000469613431 339294608 /nfs/dbraw/zinc/29/46/08/339294608.db2.gz MREINUJBASMGSJ-UHFFFAOYSA-N 1 2 324.374 4.562 20 0 DJADLO C[C@@H](c1c(F)cccc1F)[N@@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000470191017 339313501 /nfs/dbraw/zinc/31/35/01/339313501.db2.gz RXDZTUFNNOBXQO-BFQNTYOBSA-N 1 2 323.408 4.549 20 0 DJADLO C[C@@H](c1c(F)cccc1F)[N@H+]1C[C@@H](C)O[C@@H](c2ccsc2)C1 ZINC000470191017 339313502 /nfs/dbraw/zinc/31/35/02/339313502.db2.gz RXDZTUFNNOBXQO-BFQNTYOBSA-N 1 2 323.408 4.549 20 0 DJADLO CCC(CC)[C@@H](c1ccc(Cl)cc1)[N@H+](C)Cc1noc(C)n1 ZINC000470933292 339331401 /nfs/dbraw/zinc/33/14/01/339331401.db2.gz RDMUGCUAHOMZHI-KRWDZBQOSA-N 1 2 321.852 4.641 20 0 DJADLO CCC(CC)[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1noc(C)n1 ZINC000470933292 339331402 /nfs/dbraw/zinc/33/14/02/339331402.db2.gz RDMUGCUAHOMZHI-KRWDZBQOSA-N 1 2 321.852 4.641 20 0 DJADLO Cc1oc(-c2cccs2)nc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000471174204 339339540 /nfs/dbraw/zinc/33/95/40/339339540.db2.gz VHQLEQJYHXADKS-MRXNPFEDSA-N 1 2 310.422 4.659 20 0 DJADLO Cc1oc(-c2cccs2)nc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000471174204 339339541 /nfs/dbraw/zinc/33/95/41/339339541.db2.gz VHQLEQJYHXADKS-MRXNPFEDSA-N 1 2 310.422 4.659 20 0 DJADLO CCCCc1nc(C[N@H+](CC)[C@H](C)c2cccc(O)c2)cs1 ZINC000471182167 339339797 /nfs/dbraw/zinc/33/97/97/339339797.db2.gz KCUYDFMLCXSSJT-CQSZACIVSA-N 1 2 318.486 4.774 20 0 DJADLO CCCCc1nc(C[N@@H+](CC)[C@H](C)c2cccc(O)c2)cs1 ZINC000471182167 339339798 /nfs/dbraw/zinc/33/97/98/339339798.db2.gz KCUYDFMLCXSSJT-CQSZACIVSA-N 1 2 318.486 4.774 20 0 DJADLO C[C@H]([NH2+][C@@H](CO)c1ccsc1)c1cc(Cl)sc1Cl ZINC000471583002 339348034 /nfs/dbraw/zinc/34/80/34/339348034.db2.gz SJJIMXAGLVXTSX-XVKPBYJWSA-N 1 2 322.282 4.501 20 0 DJADLO Cc1cccn2cc(CNc3ccccc3SC(C)C)[nH+]c12 ZINC000471641831 339350209 /nfs/dbraw/zinc/35/02/09/339350209.db2.gz HEYRXYFISGNISC-UHFFFAOYSA-N 1 2 311.454 4.755 20 0 DJADLO Clc1cnc(CNc2cccc([NH+]3CCCCCC3)c2)s1 ZINC000472064945 339361892 /nfs/dbraw/zinc/36/18/92/339361892.db2.gz KUQGRZSZZLPJPK-UHFFFAOYSA-N 1 2 321.877 4.789 20 0 DJADLO CC(C)([NH2+]Cc1ncc(Cl)s1)c1cccc(Cl)c1F ZINC000472137778 339364041 /nfs/dbraw/zinc/36/40/41/339364041.db2.gz FFQPTPRGVBLHDL-UHFFFAOYSA-N 1 2 319.232 4.614 20 0 DJADLO C[C@@H]1CC[N@H+](Cc2ncc(C(C)(C)C)o2)[C@H]1c1cccc(F)c1 ZINC000472317774 339369660 /nfs/dbraw/zinc/36/96/60/339369660.db2.gz JQYHUALCUFXRIM-FZKQIMNGSA-N 1 2 316.420 4.694 20 0 DJADLO C[C@@H]1CC[N@@H+](Cc2ncc(C(C)(C)C)o2)[C@H]1c1cccc(F)c1 ZINC000472317774 339369661 /nfs/dbraw/zinc/36/96/61/339369661.db2.gz JQYHUALCUFXRIM-FZKQIMNGSA-N 1 2 316.420 4.694 20 0 DJADLO Fc1ccc([C@@H]2CCCC[N@@H+]2Cc2ccncc2Cl)cc1 ZINC000473034437 339380461 /nfs/dbraw/zinc/38/04/61/339380461.db2.gz JDCVNBZKUZGYIO-KRWDZBQOSA-N 1 2 304.796 4.601 20 0 DJADLO Fc1ccc([C@@H]2CCCC[N@H+]2Cc2ccncc2Cl)cc1 ZINC000473034437 339380462 /nfs/dbraw/zinc/38/04/62/339380462.db2.gz JDCVNBZKUZGYIO-KRWDZBQOSA-N 1 2 304.796 4.601 20 0 DJADLO CC(C)c1ccc(C[N@@H+]2CCSC[C@@H]2c2nccs2)cc1 ZINC000473070196 339380919 /nfs/dbraw/zinc/38/09/19/339380919.db2.gz CZZJLOJKUASVSA-MRXNPFEDSA-N 1 2 318.511 4.557 20 0 DJADLO CC(C)c1ccc(C[N@H+]2CCSC[C@@H]2c2nccs2)cc1 ZINC000473070196 339380920 /nfs/dbraw/zinc/38/09/20/339380920.db2.gz CZZJLOJKUASVSA-MRXNPFEDSA-N 1 2 318.511 4.557 20 0 DJADLO CC(C)(C)[N@H+](Cc1ncc(Cl)s1)Cc1ccc(F)cc1 ZINC000473137458 339381969 /nfs/dbraw/zinc/38/19/69/339381969.db2.gz AENCJGJUIWHFQX-UHFFFAOYSA-N 1 2 312.841 4.736 20 0 DJADLO CC(C)(C)[N@@H+](Cc1ncc(Cl)s1)Cc1ccc(F)cc1 ZINC000473137458 339381970 /nfs/dbraw/zinc/38/19/70/339381970.db2.gz AENCJGJUIWHFQX-UHFFFAOYSA-N 1 2 312.841 4.736 20 0 DJADLO C[C@@H]1CC[N@H+](Cc2ncc(Cl)s2)[C@H]1c1cccc(F)c1 ZINC000473139073 339382294 /nfs/dbraw/zinc/38/22/94/339382294.db2.gz LWHYZOHYKJZFLP-MEBBXXQBSA-N 1 2 310.825 4.519 20 0 DJADLO C[C@@H]1CC[N@@H+](Cc2ncc(Cl)s2)[C@H]1c1cccc(F)c1 ZINC000473139073 339382295 /nfs/dbraw/zinc/38/22/95/339382295.db2.gz LWHYZOHYKJZFLP-MEBBXXQBSA-N 1 2 310.825 4.519 20 0 DJADLO Cc1ccc(C)c([C@@H]2CCC[N@@H+]2Cc2ncc(Cl)s2)c1 ZINC000473140930 339382316 /nfs/dbraw/zinc/38/23/16/339382316.db2.gz DLMXDJXYOUNRIN-AWEZNQCLSA-N 1 2 306.862 4.750 20 0 DJADLO Cc1ccc(C)c([C@@H]2CCC[N@H+]2Cc2ncc(Cl)s2)c1 ZINC000473140930 339382317 /nfs/dbraw/zinc/38/23/17/339382317.db2.gz DLMXDJXYOUNRIN-AWEZNQCLSA-N 1 2 306.862 4.750 20 0 DJADLO CCC[N@H+](Cc1ncc(Cl)s1)[C@@H](C)c1ccccc1OC ZINC000473140933 339382360 /nfs/dbraw/zinc/38/23/60/339382360.db2.gz DMOUOYDCQRWYCN-LBPRGKRZSA-N 1 2 324.877 4.778 20 0 DJADLO CCC[N@@H+](Cc1ncc(Cl)s1)[C@@H](C)c1ccccc1OC ZINC000473140933 339382361 /nfs/dbraw/zinc/38/23/61/339382361.db2.gz DMOUOYDCQRWYCN-LBPRGKRZSA-N 1 2 324.877 4.778 20 0 DJADLO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2ncc(Cl)s2)c1C ZINC000473150130 339383274 /nfs/dbraw/zinc/38/32/74/339383274.db2.gz ZDNHFMOEZDRALX-AWEZNQCLSA-N 1 2 306.862 4.750 20 0 DJADLO Cc1cccc([C@@H]2CCC[N@H+]2Cc2ncc(Cl)s2)c1C ZINC000473150130 339383275 /nfs/dbraw/zinc/38/32/75/339383275.db2.gz ZDNHFMOEZDRALX-AWEZNQCLSA-N 1 2 306.862 4.750 20 0 DJADLO Cc1cc2[nH+]cn([C@H](C)c3nc(C4(C)CC4)cs3)c2cc1C ZINC000473436375 339385238 /nfs/dbraw/zinc/38/52/38/339385238.db2.gz SVZHKCDUVXGZQK-CYBMUJFWSA-N 1 2 311.454 4.770 20 0 DJADLO COc1c2ccccc2oc1C[NH2+][C@@H](C)c1cc(F)ccc1F ZINC000473799635 339392400 /nfs/dbraw/zinc/39/24/00/339392400.db2.gz ULVHFXSLVWAZLW-NSHDSACASA-N 1 2 317.335 4.570 20 0 DJADLO Cc1ccc(NC(=O)N2CCCC[C@H]2CCC(C)C)c(C)[nH+]1 ZINC000473810089 339392584 /nfs/dbraw/zinc/39/25/84/339392584.db2.gz UFAYFHSUWVVTJH-INIZCTEOSA-N 1 2 303.450 4.521 20 0 DJADLO C[C@H](C(=O)Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1)C1CC1 ZINC000477110860 339487205 /nfs/dbraw/zinc/48/72/05/339487205.db2.gz MGEHBAVZOFNBEV-NSHDSACASA-N 1 2 316.788 4.512 20 0 DJADLO C[C@H](CC(=O)Nc1cccc(Oc2cc[nH+]cc2)c1)C(C)(C)C ZINC000482724780 339640976 /nfs/dbraw/zinc/64/09/76/339640976.db2.gz RRXBYYFCHZCROX-CQSZACIVSA-N 1 2 312.413 4.885 20 0 DJADLO Cc1cc(C(=O)Nc2cccc(Oc3cc[nH+]cc3)c2)sc1C ZINC000482772371 339642142 /nfs/dbraw/zinc/64/21/42/339642142.db2.gz AHWHYPKINOERHD-UHFFFAOYSA-N 1 2 324.405 4.805 20 0 DJADLO Cc1ccccc1[C@H](NC(=O)Nc1c(C)cc[nH+]c1C)C(C)C ZINC000485634711 339707847 /nfs/dbraw/zinc/70/78/47/339707847.db2.gz WMINUADDRXWDGP-QGZVFWFLSA-N 1 2 311.429 4.526 20 0 DJADLO Cc1c2cc(C)ccc2sc1C(=O)Nc1ccc(C)[nH+]c1C ZINC000486206575 339723376 /nfs/dbraw/zinc/72/33/76/339723376.db2.gz QZBOEHFNQSHWSN-UHFFFAOYSA-N 1 2 310.422 4.782 20 0 DJADLO Cc1cc(N2CCCC[C@@H]2c2ccccc2C(F)(F)F)nc[nH+]1 ZINC000487209663 339746477 /nfs/dbraw/zinc/74/64/77/339746477.db2.gz QSUAHMRNSGPTDI-OAHLLOKOSA-N 1 2 321.346 4.535 20 0 DJADLO Cc1cccc(C(=O)Nc2ccc(Oc3cc[nH+]cc3)c(C)c2)c1 ZINC000487653342 339760368 /nfs/dbraw/zinc/76/03/68/339760368.db2.gz OUFDAWTUKSOYEQ-UHFFFAOYSA-N 1 2 318.376 4.743 20 0 DJADLO c1ccc(N2Cc3cccc(NC4CCC5(CC5)CC4)c3C2)[nH+]c1 ZINC000488443229 339782642 /nfs/dbraw/zinc/78/26/42/339782642.db2.gz GHJMSISNHQOSHQ-UHFFFAOYSA-N 1 2 319.452 4.737 20 0 DJADLO CC[C@@H]1CCCC[C@H]1NC(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000492514282 339902763 /nfs/dbraw/zinc/90/27/63/339902763.db2.gz HYTFFNKSBKUEEL-DNVCBOLYSA-N 1 2 324.424 4.573 20 0 DJADLO CC[C@H]1CCCC[C@H]1NC(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000492514283 339902769 /nfs/dbraw/zinc/90/27/69/339902769.db2.gz HYTFFNKSBKUEEL-HNAYVOBHSA-N 1 2 324.424 4.573 20 0 DJADLO CC(C)c1nc(N(C)[C@H](C)c2cccc(C(F)(F)F)c2)cc[nH+]1 ZINC000498961406 340026998 /nfs/dbraw/zinc/02/69/98/340026998.db2.gz WHSNJWBRMNBMPI-GFCCVEGCSA-N 1 2 323.362 4.816 20 0 DJADLO CC(C)c1nc(C[NH2+][C@]2(c3ccc(Cl)cc3)C[C@H]2C)cs1 ZINC000500414721 340057435 /nfs/dbraw/zinc/05/74/35/340057435.db2.gz INKUBBZQTYTTEW-SJKOYZFVSA-N 1 2 320.889 4.945 20 0 DJADLO Cc1ccc(C[N@H+]2CCCCC[C@H]2c2noc(C(C)C)n2)s1 ZINC000501701022 340086887 /nfs/dbraw/zinc/08/68/87/340086887.db2.gz AFSNCQFQESYQPV-HNNXBMFYSA-N 1 2 319.474 4.680 20 0 DJADLO Cc1ccc(C[N@@H+]2CCCCC[C@H]2c2noc(C(C)C)n2)s1 ZINC000501701022 340086888 /nfs/dbraw/zinc/08/68/88/340086888.db2.gz AFSNCQFQESYQPV-HNNXBMFYSA-N 1 2 319.474 4.680 20 0 DJADLO Cc1ccccc1C[N@H+]1CCCCC[C@@H]1c1noc(C(C)C)n1 ZINC000501720064 340087146 /nfs/dbraw/zinc/08/71/46/340087146.db2.gz MISCIUPCKSCFSV-QGZVFWFLSA-N 1 2 313.445 4.619 20 0 DJADLO Cc1ccccc1C[N@@H+]1CCCCC[C@@H]1c1noc(C(C)C)n1 ZINC000501720064 340087147 /nfs/dbraw/zinc/08/71/47/340087147.db2.gz MISCIUPCKSCFSV-QGZVFWFLSA-N 1 2 313.445 4.619 20 0 DJADLO Cc1cc(C)cc(C(=O)Nc2ccc3[nH]c(C4CCC4)[nH+]c3c2)c1 ZINC000502474685 340105164 /nfs/dbraw/zinc/10/51/64/340105164.db2.gz SMGZLPRDSGYVNM-UHFFFAOYSA-N 1 2 319.408 4.700 20 0 DJADLO CCCc1noc(C[N@H+](C)[C@@H](c2ccccc2Cl)C(C)C)n1 ZINC000502577892 340108263 /nfs/dbraw/zinc/10/82/63/340108263.db2.gz VFCKHHSUFJLKQN-QGZVFWFLSA-N 1 2 321.852 4.505 20 0 DJADLO CCCc1noc(C[N@@H+](C)[C@@H](c2ccccc2Cl)C(C)C)n1 ZINC000502577892 340108264 /nfs/dbraw/zinc/10/82/64/340108264.db2.gz VFCKHHSUFJLKQN-QGZVFWFLSA-N 1 2 321.852 4.505 20 0 DJADLO C[C@@H]([NH2+]Cc1c(F)cccc1Cl)c1cnn(C2CCCC2)c1 ZINC000502734133 340112688 /nfs/dbraw/zinc/11/26/88/340112688.db2.gz IOIVZJIVIFJHMO-GFCCVEGCSA-N 1 2 321.827 4.642 20 0 DJADLO Cc1cc([C@H](C)[NH2+][C@H]2CCc3c2ccc(Cl)c3Cl)no1 ZINC000503904407 340136261 /nfs/dbraw/zinc/13/62/61/340136261.db2.gz SRESMLLPMMIABW-ZANVPECISA-N 1 2 311.212 4.628 20 0 DJADLO Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]C1(C(F)F)CC1 ZINC000503907016 340136354 /nfs/dbraw/zinc/13/63/54/340136354.db2.gz BOCBQDDHVGYTNZ-NSHDSACASA-N 1 2 308.397 4.567 20 0 DJADLO Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]C1(C(F)F)CC1 ZINC000503927318 340137252 /nfs/dbraw/zinc/13/72/52/340137252.db2.gz IREDACPSOSVBOK-LBPRGKRZSA-N 1 2 322.424 4.875 20 0 DJADLO CCCc1nc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)cs1 ZINC000505471329 340169154 /nfs/dbraw/zinc/16/91/54/340169154.db2.gz JHBMCPAYTYQQBY-MRXNPFEDSA-N 1 2 304.434 4.572 20 0 DJADLO CCCc1nc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)cs1 ZINC000505471329 340169155 /nfs/dbraw/zinc/16/91/55/340169155.db2.gz JHBMCPAYTYQQBY-MRXNPFEDSA-N 1 2 304.434 4.572 20 0 DJADLO C[N@H+](Cc1cccs1)Cc1nc(-c2ccccc2)cs1 ZINC000505553884 340170888 /nfs/dbraw/zinc/17/08/88/340170888.db2.gz ROOBUNOYPFLUGV-UHFFFAOYSA-N 1 2 300.452 4.504 20 0 DJADLO C[N@@H+](Cc1cccs1)Cc1nc(-c2ccccc2)cs1 ZINC000505553884 340170889 /nfs/dbraw/zinc/17/08/89/340170889.db2.gz ROOBUNOYPFLUGV-UHFFFAOYSA-N 1 2 300.452 4.504 20 0 DJADLO CCc1ccc(C[N@H+](Cc2ccco2)Cc2cccs2)o1 ZINC000505552972 340170932 /nfs/dbraw/zinc/17/09/32/340170932.db2.gz GYLAEFBYYIEFQE-UHFFFAOYSA-N 1 2 301.411 4.699 20 0 DJADLO CCc1ccc(C[N@@H+](Cc2ccco2)Cc2cccs2)o1 ZINC000505552972 340170933 /nfs/dbraw/zinc/17/09/33/340170933.db2.gz GYLAEFBYYIEFQE-UHFFFAOYSA-N 1 2 301.411 4.699 20 0 DJADLO C[N@H+](Cc1ccccc1F)Cc1ccc(-c2ccncc2)cc1F ZINC000505596068 340172170 /nfs/dbraw/zinc/17/21/70/340172170.db2.gz HTKOIZPCSFANRE-UHFFFAOYSA-N 1 2 324.374 4.659 20 0 DJADLO C[N@@H+](Cc1ccccc1F)Cc1ccc(-c2ccncc2)cc1F ZINC000505596068 340172171 /nfs/dbraw/zinc/17/21/71/340172171.db2.gz HTKOIZPCSFANRE-UHFFFAOYSA-N 1 2 324.374 4.659 20 0 DJADLO Fc1cccc(F)c1C[NH2+][C@H](CC(F)(F)F)c1ccccc1 ZINC000505636374 340173711 /nfs/dbraw/zinc/17/37/11/340173711.db2.gz PAJVZTQTIOYHBZ-OAHLLOKOSA-N 1 2 315.285 4.748 20 0 DJADLO CC(C)CCC(=O)Nc1ccc(Oc2cc[nH+]cc2)c(Cl)c1 ZINC000505745343 340176442 /nfs/dbraw/zinc/17/64/42/340176442.db2.gz XJPWTMSQJGAPPB-UHFFFAOYSA-N 1 2 318.804 4.902 20 0 DJADLO c1ccc([C@H](Nc2ccc3ccccc3[nH+]2)[C@H]2CCCO2)cc1 ZINC000505779584 340177848 /nfs/dbraw/zinc/17/78/48/340177848.db2.gz YHEJKNIZAVSGCS-QUCCMNQESA-N 1 2 304.393 4.567 20 0 DJADLO CC(C)Cc1ncc(C[N@H+](C)[C@@H](C)c2ccccc2F)s1 ZINC000506583229 340197123 /nfs/dbraw/zinc/19/71/23/340197123.db2.gz AEJKSQNVNOQVFX-ZDUSSCGKSA-N 1 2 306.450 4.674 20 0 DJADLO CC(C)Cc1ncc(C[N@@H+](C)[C@@H](C)c2ccccc2F)s1 ZINC000506583229 340197124 /nfs/dbraw/zinc/19/71/24/340197124.db2.gz AEJKSQNVNOQVFX-ZDUSSCGKSA-N 1 2 306.450 4.674 20 0 DJADLO Fc1ccc([C@@H]2CCC[N@@H+]2Cc2cnc(-c3ccccc3)[nH]2)cc1 ZINC000506638346 340198291 /nfs/dbraw/zinc/19/82/91/340198291.db2.gz CXIWOMYFGIHIJH-IBGZPJMESA-N 1 2 321.399 4.553 20 0 DJADLO Fc1ccc([C@@H]2CCC[N@H+]2Cc2cnc(-c3ccccc3)[nH]2)cc1 ZINC000506638346 340198292 /nfs/dbraw/zinc/19/82/92/340198292.db2.gz CXIWOMYFGIHIJH-IBGZPJMESA-N 1 2 321.399 4.553 20 0 DJADLO C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000506673152 340199176 /nfs/dbraw/zinc/19/91/76/340199176.db2.gz FQFRLIWXBSVKBM-NSHDSACASA-N 1 2 324.440 4.912 20 0 DJADLO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1csc(C(C)(C)C)n1 ZINC000506673152 340199177 /nfs/dbraw/zinc/19/91/77/340199177.db2.gz FQFRLIWXBSVKBM-NSHDSACASA-N 1 2 324.440 4.912 20 0 DJADLO C[C@@H](c1nc2ccccc2s1)[N@H+](C)Cc1cc(F)cc(F)c1 ZINC000506707544 340199796 /nfs/dbraw/zinc/19/97/96/340199796.db2.gz OYXCVYGKXRGKIL-NSHDSACASA-N 1 2 318.392 4.768 20 0 DJADLO C[C@@H](c1nc2ccccc2s1)[N@@H+](C)Cc1cc(F)cc(F)c1 ZINC000506707544 340199797 /nfs/dbraw/zinc/19/97/97/340199797.db2.gz OYXCVYGKXRGKIL-NSHDSACASA-N 1 2 318.392 4.768 20 0 DJADLO Cc1nc(C[NH2+]C(C)(C)c2ccc(Cl)c(Cl)c2)oc1C ZINC000506704532 340199871 /nfs/dbraw/zinc/19/98/71/340199871.db2.gz OBHZUHKDIUPKCJ-UHFFFAOYSA-N 1 2 313.228 4.623 20 0 DJADLO C[N@H+](Cc1csc(-c2ccco2)n1)Cc1cccc(Cl)c1 ZINC000506788906 340201842 /nfs/dbraw/zinc/20/18/42/340201842.db2.gz IOCGOHPSARJOIM-UHFFFAOYSA-N 1 2 318.829 4.689 20 0 DJADLO C[N@@H+](Cc1csc(-c2ccco2)n1)Cc1cccc(Cl)c1 ZINC000506788906 340201843 /nfs/dbraw/zinc/20/18/43/340201843.db2.gz IOCGOHPSARJOIM-UHFFFAOYSA-N 1 2 318.829 4.689 20 0 DJADLO CC(C)n1cc[nH+]c1CN([C@H](C)c1ccccc1Cl)C1CC1 ZINC000506948952 340204185 /nfs/dbraw/zinc/20/41/85/340204185.db2.gz UXKANBGRVUVBAM-CQSZACIVSA-N 1 2 317.864 4.843 20 0 DJADLO c1ccc(-c2cccc3c2OCC[C@H]3Nc2cccc[nH+]2)cc1 ZINC000507028023 340205756 /nfs/dbraw/zinc/20/57/56/340205756.db2.gz RLQXMFYQGGFZTM-GOSISDBHSA-N 1 2 302.377 4.684 20 0 DJADLO C[C@@H](c1cc2ccccc2o1)[N@H+](C)Cc1c(F)ccc(O)c1F ZINC000507109427 340207561 /nfs/dbraw/zinc/20/75/61/340207561.db2.gz DKVPAZQNYFABLO-NSHDSACASA-N 1 2 317.335 4.610 20 0 DJADLO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)Cc1c(F)ccc(O)c1F ZINC000507109427 340207562 /nfs/dbraw/zinc/20/75/62/340207562.db2.gz DKVPAZQNYFABLO-NSHDSACASA-N 1 2 317.335 4.610 20 0 DJADLO Clc1cccc(Cl)c1C[N@H+](Cc1ccncc1)C1CC1 ZINC000507141124 340209233 /nfs/dbraw/zinc/20/92/33/340209233.db2.gz GMUGDFCSKZLKFJ-UHFFFAOYSA-N 1 2 307.224 4.553 20 0 DJADLO Clc1cccc(Cl)c1C[N@@H+](Cc1ccncc1)C1CC1 ZINC000507141124 340209234 /nfs/dbraw/zinc/20/92/34/340209234.db2.gz GMUGDFCSKZLKFJ-UHFFFAOYSA-N 1 2 307.224 4.553 20 0 DJADLO Fc1cccc([C@@H]2CCC[N@@H+]2Cc2ncccc2C(F)(F)F)c1 ZINC000507170632 340210916 /nfs/dbraw/zinc/21/09/16/340210916.db2.gz PFAIMMVISMZDHC-INIZCTEOSA-N 1 2 324.321 4.577 20 0 DJADLO Fc1cccc([C@@H]2CCC[N@H+]2Cc2ncccc2C(F)(F)F)c1 ZINC000507170632 340210917 /nfs/dbraw/zinc/21/09/17/340210917.db2.gz PFAIMMVISMZDHC-INIZCTEOSA-N 1 2 324.321 4.577 20 0 DJADLO CC(C)c1ncc(C[N@H+](C)[C@@H](C)c2cc(F)ccc2F)s1 ZINC000507192600 340212425 /nfs/dbraw/zinc/21/24/25/340212425.db2.gz SLKKTOQKAHWMEY-NSHDSACASA-N 1 2 310.413 4.738 20 0 DJADLO CC(C)c1ncc(C[N@@H+](C)[C@@H](C)c2cc(F)ccc2F)s1 ZINC000507192600 340212426 /nfs/dbraw/zinc/21/24/26/340212426.db2.gz SLKKTOQKAHWMEY-NSHDSACASA-N 1 2 310.413 4.738 20 0 DJADLO Cc1ccc(C[N@@H+](C)[C@H](C)c2ccc(Cl)cc2Cl)nc1 ZINC000507241586 340215089 /nfs/dbraw/zinc/21/50/89/340215089.db2.gz ALLPBCOYSWPVMS-GFCCVEGCSA-N 1 2 309.240 4.890 20 0 DJADLO Cc1ccc(C[N@H+](C)[C@H](C)c2ccc(Cl)cc2Cl)nc1 ZINC000507241586 340215090 /nfs/dbraw/zinc/21/50/90/340215090.db2.gz ALLPBCOYSWPVMS-GFCCVEGCSA-N 1 2 309.240 4.890 20 0 DJADLO CCc1cccnc1[C@@H](C)[NH2+][C@H](C)c1c(F)cccc1Cl ZINC000507508583 340223277 /nfs/dbraw/zinc/22/32/77/340223277.db2.gz JPJBEZOHXGTSFT-VXGBXAGGSA-N 1 2 306.812 4.848 20 0 DJADLO CCc1cccnc1[C@H](C)[NH2+][C@@H](C)c1nc(C(C)(C)C)cs1 ZINC000507517873 340223981 /nfs/dbraw/zinc/22/39/81/340223981.db2.gz ZAYHGJCTNNAOTP-STQMWFEESA-N 1 2 317.502 4.810 20 0 DJADLO CCc1cccnc1[C@@H](C)[NH2+][C@@H](C)c1nc(C(C)(C)C)cs1 ZINC000507517868 340224009 /nfs/dbraw/zinc/22/40/09/340224009.db2.gz ZAYHGJCTNNAOTP-OLZOCXBDSA-N 1 2 317.502 4.810 20 0 DJADLO Cc1sc(C[NH2+][C@@H]2CCc3c2c(F)ccc3F)nc1C(C)C ZINC000507828707 340233431 /nfs/dbraw/zinc/23/34/31/340233431.db2.gz VRBLNLARVSZJAI-CQSZACIVSA-N 1 2 322.424 4.630 20 0 DJADLO C[C@H](c1ccccc1F)[N@@H+]1CCO[C@H](c2ccccc2Cl)C1 ZINC000507860182 340234510 /nfs/dbraw/zinc/23/45/10/340234510.db2.gz ONEMIULQEMUXBJ-ACJLOTCBSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@H](c1ccccc1F)[N@H+]1CCO[C@H](c2ccccc2Cl)C1 ZINC000507860182 340234511 /nfs/dbraw/zinc/23/45/11/340234511.db2.gz ONEMIULQEMUXBJ-ACJLOTCBSA-N 1 2 319.807 4.614 20 0 DJADLO C[C@@H](c1ccccn1)[N@H+](C)Cc1c(Cl)oc2ccccc21 ZINC000508637798 340249207 /nfs/dbraw/zinc/24/92/07/340249207.db2.gz MVYAWSMTQTVEON-LBPRGKRZSA-N 1 2 300.789 4.674 20 0 DJADLO C[C@@H](c1ccccn1)[N@@H+](C)Cc1c(Cl)oc2ccccc21 ZINC000508637798 340249208 /nfs/dbraw/zinc/24/92/08/340249208.db2.gz MVYAWSMTQTVEON-LBPRGKRZSA-N 1 2 300.789 4.674 20 0 DJADLO C[C@@H](c1cccs1)[N@H+](Cc1nccs1)Cc1ccccc1 ZINC000508838626 340254076 /nfs/dbraw/zinc/25/40/76/340254076.db2.gz XWZSNRVPYOUGAA-AWEZNQCLSA-N 1 2 314.479 4.968 20 0 DJADLO C[C@@H](c1cccs1)[N@@H+](Cc1nccs1)Cc1ccccc1 ZINC000508838626 340254077 /nfs/dbraw/zinc/25/40/77/340254077.db2.gz XWZSNRVPYOUGAA-AWEZNQCLSA-N 1 2 314.479 4.968 20 0 DJADLO O=C(Nc1ccc(Cl)cc1)c1ccccc1Oc1cc[nH+]cc1 ZINC000509011135 340258207 /nfs/dbraw/zinc/25/82/07/340258207.db2.gz BFWHGTVILUHHLD-UHFFFAOYSA-N 1 2 324.767 4.780 20 0 DJADLO Cc1ccc(NC(=O)c2ccccc2Oc2cc[nH+]cc2)c(C)c1 ZINC000509016612 340258405 /nfs/dbraw/zinc/25/84/05/340258405.db2.gz QQIUVZRTEVEYNI-UHFFFAOYSA-N 1 2 318.376 4.743 20 0 DJADLO C[C@H]1CCC[C@@H](N(C)C(=O)c2ccccc2Oc2cc[nH+]cc2)C1 ZINC000509148547 340262314 /nfs/dbraw/zinc/26/23/14/340262314.db2.gz AQMLFPUSNTYNIC-JKSUJKDBSA-N 1 2 324.424 4.525 20 0 DJADLO Cn1c(CCSc2ccccc2Cl)[nH+]c2ccccc21 ZINC000509954167 340283697 /nfs/dbraw/zinc/28/36/97/340283697.db2.gz CRJMGSAMNGLRKR-UHFFFAOYSA-N 1 2 302.830 4.562 20 0 DJADLO Fc1ccc(-c2cc(C[NH2+]C3(C(F)F)CCCCC3)on2)cc1 ZINC000510096895 340288563 /nfs/dbraw/zinc/28/85/63/340288563.db2.gz DXVYDYSNQHYGKL-UHFFFAOYSA-N 1 2 324.346 4.538 20 0 DJADLO CC(C)n1ccc(C[N@@H+](Cc2ccccc2Cl)CC2CC2)n1 ZINC000510187074 340292083 /nfs/dbraw/zinc/29/20/83/340292083.db2.gz WGTMOLIGWZGOMJ-UHFFFAOYSA-N 1 2 317.864 4.530 20 0 DJADLO CC(C)n1ccc(C[N@H+](Cc2ccccc2Cl)CC2CC2)n1 ZINC000510187074 340292084 /nfs/dbraw/zinc/29/20/84/340292084.db2.gz WGTMOLIGWZGOMJ-UHFFFAOYSA-N 1 2 317.864 4.530 20 0 DJADLO COc1c(C)c[nH+]c(COc2cccc(Cl)c2Cl)c1C ZINC000302990257 340292543 /nfs/dbraw/zinc/29/25/43/340292543.db2.gz XHDHWUQBCMMYAW-UHFFFAOYSA-N 1 2 312.196 4.593 20 0 DJADLO c1ccc(N2Cc3cccc(N[C@@H]4CC[C@H]4C4CCC4)c3C2)[nH+]c1 ZINC000510701265 340307269 /nfs/dbraw/zinc/30/72/69/340307269.db2.gz HGNPCRBKOHEPRZ-FXAWDEMLSA-N 1 2 319.452 4.592 20 0 DJADLO Cc1csc(C[N@@H+](Cc2ccc(F)cc2Cl)CC2CC2)n1 ZINC000511111402 340321078 /nfs/dbraw/zinc/32/10/78/340321078.db2.gz YJSROBSCVMAURZ-UHFFFAOYSA-N 1 2 324.852 4.656 20 0 DJADLO Cc1csc(C[N@H+](Cc2ccc(F)cc2Cl)CC2CC2)n1 ZINC000511111402 340321079 /nfs/dbraw/zinc/32/10/79/340321079.db2.gz YJSROBSCVMAURZ-UHFFFAOYSA-N 1 2 324.852 4.656 20 0 DJADLO Fc1ccc2nc(C[N@@H+]3CC[C@H]3c3ccc(Cl)cc3)oc2c1 ZINC000511625154 340332881 /nfs/dbraw/zinc/33/28/81/340332881.db2.gz RGRHFBDWUTXGHV-HNNXBMFYSA-N 1 2 316.763 4.567 20 0 DJADLO Fc1ccc2nc(C[N@H+]3CC[C@H]3c3ccc(Cl)cc3)oc2c1 ZINC000511625154 340332882 /nfs/dbraw/zinc/33/28/82/340332882.db2.gz RGRHFBDWUTXGHV-HNNXBMFYSA-N 1 2 316.763 4.567 20 0 DJADLO C[C@H](c1ccco1)[N@H+](Cc1nc2c(s1)C[C@@H](C)CC2)C1CC1 ZINC000511758621 340337394 /nfs/dbraw/zinc/33/73/94/340337394.db2.gz DRCBUJYVPHNJMF-QWHCGFSZSA-N 1 2 316.470 4.587 20 0 DJADLO C[C@H](c1ccco1)[N@@H+](Cc1nc2c(s1)C[C@@H](C)CC2)C1CC1 ZINC000511758621 340337395 /nfs/dbraw/zinc/33/73/95/340337395.db2.gz DRCBUJYVPHNJMF-QWHCGFSZSA-N 1 2 316.470 4.587 20 0 DJADLO CCc1ccc(C[NH2+]C2(c3c(Cl)cccc3Cl)CC2)cn1 ZINC000512009580 340345209 /nfs/dbraw/zinc/34/52/09/340345209.db2.gz PWVDPNZABSSLCW-UHFFFAOYSA-N 1 2 321.251 4.730 20 0 DJADLO Cc1ccccc1-c1cccc(C[N@H+](C)Cc2cscn2)c1 ZINC000512067354 340347315 /nfs/dbraw/zinc/34/73/15/340347315.db2.gz LKCHFSNPFSMMLK-UHFFFAOYSA-N 1 2 308.450 4.751 20 0 DJADLO Cc1ccccc1-c1cccc(C[N@@H+](C)Cc2cscn2)c1 ZINC000512067354 340347316 /nfs/dbraw/zinc/34/73/16/340347316.db2.gz LKCHFSNPFSMMLK-UHFFFAOYSA-N 1 2 308.450 4.751 20 0 DJADLO CSc1cccc(F)c1C[NH2+]Cc1c(F)cccc1Cl ZINC000512581261 340367996 /nfs/dbraw/zinc/36/79/96/340367996.db2.gz GUAQFLPSYQJFLG-UHFFFAOYSA-N 1 2 313.800 4.630 20 0 DJADLO Cc1ccc(C[NH2+][C@H](C)c2nc(C3CCCCC3)no2)c(C)c1 ZINC000173867810 340376302 /nfs/dbraw/zinc/37/63/02/340376302.db2.gz AHOZHIXBSLUSTA-OAHLLOKOSA-N 1 2 313.445 4.585 20 0 DJADLO Cc1cccc(C[NH2+][C@H](C)c2nc(C3CCCCC3)no2)c1C ZINC000173864326 340376408 /nfs/dbraw/zinc/37/64/08/340376408.db2.gz WVKNKYZACDEJDF-OAHLLOKOSA-N 1 2 313.445 4.585 20 0 DJADLO CC[C@](C)([NH2+]Cc1c(F)cccc1Cl)c1nc(C)cs1 ZINC000173943821 340378394 /nfs/dbraw/zinc/37/83/94/340378394.db2.gz OSMYSTPXCIZFMZ-HNNXBMFYSA-N 1 2 312.841 4.659 20 0 DJADLO CCc1oc2ccccc2c1CNc1ccc(N2CCCC2)c[nH+]1 ZINC000513009676 340388221 /nfs/dbraw/zinc/38/82/21/340388221.db2.gz UOMDHYOFKMKPCD-UHFFFAOYSA-N 1 2 321.424 4.603 20 0 DJADLO C[C@H]([NH2+]Cc1ccc(Cl)cc1Cl)c1c(F)cncc1F ZINC000513106914 340393479 /nfs/dbraw/zinc/39/34/79/340393479.db2.gz RRVWBUIXGWOVOV-QMMMGPOBSA-N 1 2 317.166 4.517 20 0 DJADLO C[C@@H]([NH2+]Cc1ccc(Cl)cc1Cl)c1c(F)cncc1F ZINC000513106913 340393545 /nfs/dbraw/zinc/39/35/45/340393545.db2.gz RRVWBUIXGWOVOV-MRVPVSSYSA-N 1 2 317.166 4.517 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1cccc(Cl)c1F ZINC000513261465 340399724 /nfs/dbraw/zinc/39/97/24/340399724.db2.gz NGGVMOZCHRBYSO-BDAKNGLRSA-N 1 2 314.738 4.564 20 0 DJADLO CC(C)c1ccc([C@H]([NH2+]Cc2ncccn2)c2cccs2)cc1 ZINC000190320702 340544227 /nfs/dbraw/zinc/54/42/27/340544227.db2.gz AEHBOFUMASYIRE-IBGZPJMESA-N 1 2 323.465 4.541 20 0 DJADLO CC[C@H](CC(=O)Nc1c(C)cc(C)[nH+]c1C)c1ccc(C)cc1 ZINC000523100490 340615358 /nfs/dbraw/zinc/61/53/58/340615358.db2.gz SAUZRGYTHKVHKH-QGZVFWFLSA-N 1 2 310.441 4.838 20 0 DJADLO C[C@H](CC1CCCCC1)C(=O)Nc1ccc(-c2c[nH]c[nH+]2)cc1 ZINC000523682509 340633070 /nfs/dbraw/zinc/63/30/70/340633070.db2.gz HEPUMJXPBUCEHW-CQSZACIVSA-N 1 2 311.429 4.622 20 0 DJADLO Cc1cc([C@H](C)Nc2ccc(N3CCCC3)[nH+]c2)c(C)s1 ZINC000036982072 340726158 /nfs/dbraw/zinc/72/61/58/340726158.db2.gz JTNILSRBSQTJQF-ZDUSSCGKSA-N 1 2 301.459 4.533 20 0 DJADLO Fc1ccc(F)c(C[NH2+]Cc2c(Cl)cccc2Cl)c1 ZINC000063775970 340800650 /nfs/dbraw/zinc/80/06/50/340800650.db2.gz XECMLGHXIGMOLR-UHFFFAOYSA-N 1 2 302.151 4.561 20 0 DJADLO CCc1ccc(C(C)(C)[NH2+]Cc2ncc(C(C)(C)C)o2)cc1 ZINC000538256999 340815192 /nfs/dbraw/zinc/81/51/92/340815192.db2.gz VPTYECCNXLJAMC-UHFFFAOYSA-N 1 2 300.446 4.559 20 0 DJADLO C[C@H]([NH2+]Cc1nccs1)c1ccccc1OCc1ccccc1 ZINC000128144657 340861304 /nfs/dbraw/zinc/86/13/04/340861304.db2.gz CFAOSDVBXZHYCH-HNNXBMFYSA-N 1 2 324.449 4.573 20 0 DJADLO C[C@@H]([NH2+][C@H](COc1ccccc1)c1ccccc1)c1nccs1 ZINC000539069118 340870117 /nfs/dbraw/zinc/87/01/17/340870117.db2.gz OKWDNQZLKSOAJG-CRAIPNDOSA-N 1 2 324.449 4.614 20 0 DJADLO CCC(CC)[C@H]([NH2+]Cc1noc(C(C)C)n1)c1cccs1 ZINC000539276763 340879066 /nfs/dbraw/zinc/87/90/66/340879066.db2.gz KIGGQHYCGRUUOK-HNNXBMFYSA-N 1 2 307.463 4.522 20 0 DJADLO Cc1cc(OCc2ncc(C(C)(C)C)o2)c2cccc(C)c2[nH+]1 ZINC000539745703 340898602 /nfs/dbraw/zinc/89/86/02/340898602.db2.gz OTALWRLGFOHOOZ-UHFFFAOYSA-N 1 2 310.397 4.716 20 0 DJADLO CCCCc1nc(C[NH2+]C2(c3cccc(Cl)c3)CC2)cs1 ZINC000540415545 340930364 /nfs/dbraw/zinc/93/03/64/340930364.db2.gz SSPOFAZNSDFQDU-UHFFFAOYSA-N 1 2 320.889 4.918 20 0 DJADLO CCc1cnc(C[N@@H+]2CCC[C@H]2c2ccccc2Cl)s1 ZINC000542464763 341008148 /nfs/dbraw/zinc/00/81/48/341008148.db2.gz IWIWSIZCYGYBMB-HNNXBMFYSA-N 1 2 306.862 4.696 20 0 DJADLO CCc1cnc(C[N@H+]2CCC[C@H]2c2ccccc2Cl)s1 ZINC000542464763 341008149 /nfs/dbraw/zinc/00/81/49/341008149.db2.gz IWIWSIZCYGYBMB-HNNXBMFYSA-N 1 2 306.862 4.696 20 0 DJADLO CCc1cnc(C[N@@H+]2CCCC[C@H]2c2ccc(F)cc2)s1 ZINC000542466641 341008394 /nfs/dbraw/zinc/00/83/94/341008394.db2.gz OPDZROZBDPDNOZ-INIZCTEOSA-N 1 2 304.434 4.572 20 0 DJADLO CCc1cnc(C[N@H+]2CCCC[C@H]2c2ccc(F)cc2)s1 ZINC000542466641 341008395 /nfs/dbraw/zinc/00/83/95/341008395.db2.gz OPDZROZBDPDNOZ-INIZCTEOSA-N 1 2 304.434 4.572 20 0 DJADLO CC(C)c1cnc(C[N@H+](C)[C@H](C)c2ccc(F)c(F)c2)s1 ZINC000542466603 341008467 /nfs/dbraw/zinc/00/84/67/341008467.db2.gz XGSNQMRLTKWAIK-LLVKDONJSA-N 1 2 310.413 4.738 20 0 DJADLO CC(C)c1cnc(C[N@@H+](C)[C@H](C)c2ccc(F)c(F)c2)s1 ZINC000542466603 341008468 /nfs/dbraw/zinc/00/84/68/341008468.db2.gz XGSNQMRLTKWAIK-LLVKDONJSA-N 1 2 310.413 4.738 20 0 DJADLO CC1(C)CC[C@H](Nc2cccc3c2CN(c2cccc[nH+]2)C3)C1 ZINC000542500821 341010628 /nfs/dbraw/zinc/01/06/28/341010628.db2.gz ZNKMESLEWDCGKQ-INIZCTEOSA-N 1 2 307.441 4.592 20 0 DJADLO CC(C)n1cc([C@@H](C)[NH2+][C@@H](C)c2ncc(-c3ccccc3)o2)cn1 ZINC000542574398 341014155 /nfs/dbraw/zinc/01/41/55/341014155.db2.gz PDDYJGOSRNBJRR-CABCVRRESA-N 1 2 324.428 4.531 20 0 DJADLO C[N@H+](Cc1ccncc1)Cc1ccc(-c2ccccc2)cc1F ZINC000542694350 341017564 /nfs/dbraw/zinc/01/75/64/341017564.db2.gz SOZNKIPRUDJGRI-UHFFFAOYSA-N 1 2 306.384 4.520 20 0 DJADLO C[N@@H+](Cc1ccncc1)Cc1ccc(-c2ccccc2)cc1F ZINC000542694350 341017565 /nfs/dbraw/zinc/01/75/65/341017565.db2.gz SOZNKIPRUDJGRI-UHFFFAOYSA-N 1 2 306.384 4.520 20 0 DJADLO CCc1cnc(C[NH2+][C@@H](C)c2cccc(Cl)c2Cl)s1 ZINC000130439467 341021895 /nfs/dbraw/zinc/02/18/95/341021895.db2.gz JOWBFIFVHBSLPP-VIFPVBQESA-N 1 2 315.269 4.863 20 0 DJADLO C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@H+](C)Cc1ccco1 ZINC000130631305 341034752 /nfs/dbraw/zinc/03/47/52/341034752.db2.gz PGCMGPHOGWMUSG-GFCCVEGCSA-N 1 2 316.788 4.781 20 0 DJADLO C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@@H+](C)Cc1ccco1 ZINC000130631305 341034753 /nfs/dbraw/zinc/03/47/53/341034753.db2.gz PGCMGPHOGWMUSG-GFCCVEGCSA-N 1 2 316.788 4.781 20 0 DJADLO CC[C@@H]1c2ccsc2CC[N@H+]1Cc1ncc(C(C)C)s1 ZINC000543393288 341041587 /nfs/dbraw/zinc/04/15/87/341041587.db2.gz FYXLFESSUWASJC-CYBMUJFWSA-N 1 2 306.500 4.837 20 0 DJADLO CC[C@@H]1c2ccsc2CC[N@@H+]1Cc1ncc(C(C)C)s1 ZINC000543393288 341041588 /nfs/dbraw/zinc/04/15/88/341041588.db2.gz FYXLFESSUWASJC-CYBMUJFWSA-N 1 2 306.500 4.837 20 0 DJADLO CCc1cnc(C[N@H+](C)[C@@H](C)c2cc3ccccc3o2)s1 ZINC000543396442 341041914 /nfs/dbraw/zinc/04/19/14/341041914.db2.gz KOZCHQMEFWJTGL-LBPRGKRZSA-N 1 2 300.427 4.645 20 0 DJADLO CCc1cnc(C[N@@H+](C)[C@@H](C)c2cc3ccccc3o2)s1 ZINC000543396442 341041915 /nfs/dbraw/zinc/04/19/15/341041915.db2.gz KOZCHQMEFWJTGL-LBPRGKRZSA-N 1 2 300.427 4.645 20 0 DJADLO CCc1c[nH+]ccc1[C@@H](C)[C@@H](c1ccc(F)cc1)c1cnccn1 ZINC000543403844 341042619 /nfs/dbraw/zinc/04/26/19/341042619.db2.gz WGSVATSVMKPZLD-VLIAUNLRSA-N 1 2 321.399 4.509 20 0 DJADLO CC[C@@H]([NH2+][C@H](C)c1cccc(Cl)c1Cl)c1ccn(C)n1 ZINC000543591994 341049774 /nfs/dbraw/zinc/04/97/74/341049774.db2.gz RSDUMWLUJKPERF-ZWNOBZJWSA-N 1 2 312.244 4.529 20 0 DJADLO CCc1cnc(C[NH2+][C@@H](c2ccc(Cl)cc2F)C(C)C)o1 ZINC000543847698 341061486 /nfs/dbraw/zinc/06/14/86/341061486.db2.gz ZLQDZSODVAAWCM-MRXNPFEDSA-N 1 2 310.800 4.516 20 0 DJADLO Cc1ccc2ccccc2c1C[NH2+][C@@H](C)c1nc(C(C)(C)C)no1 ZINC000544517730 341084826 /nfs/dbraw/zinc/08/48/26/341084826.db2.gz GAOKIPDLFRWZML-AWEZNQCLSA-N 1 2 323.440 4.680 20 0 DJADLO C[N@H+](Cc1ccccn1)Cc1ccc(-c2ccccc2)cc1F ZINC000544600513 341088030 /nfs/dbraw/zinc/08/80/30/341088030.db2.gz AQQMQDZZRKGNQP-UHFFFAOYSA-N 1 2 306.384 4.520 20 0 DJADLO C[N@@H+](Cc1ccccn1)Cc1ccc(-c2ccccc2)cc1F ZINC000544600513 341088031 /nfs/dbraw/zinc/08/80/31/341088031.db2.gz AQQMQDZZRKGNQP-UHFFFAOYSA-N 1 2 306.384 4.520 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1cccc(OCc2ccccc2)c1)c1ccon1 ZINC000544606704 341088460 /nfs/dbraw/zinc/08/84/60/341088460.db2.gz VPKSOGIXSSHYHH-HZPDHXFCSA-N 1 2 322.408 4.665 20 0 DJADLO CC[C@@H](CC(F)(F)F)[NH2+][C@@H](CCc1ccccc1)C(F)F ZINC000544943833 341100410 /nfs/dbraw/zinc/10/04/10/341100410.db2.gz UTYMOWOPUMHBMW-STQMWFEESA-N 1 2 309.322 4.574 20 0 DJADLO Cc1c(F)cccc1NC(=O)c1cccc(Oc2cc[nH+]cc2)c1 ZINC000073394239 341116273 /nfs/dbraw/zinc/11/62/73/341116273.db2.gz IJIZOOVFERVAKV-UHFFFAOYSA-N 1 2 322.339 4.574 20 0 DJADLO FC(F)(F)C1C[NH+](Cc2sc3ccccc3c2Cl)C1 ZINC000564294084 341140657 /nfs/dbraw/zinc/14/06/57/341140657.db2.gz NRVYEXQOSOAVIO-UHFFFAOYSA-N 1 2 305.752 4.549 20 0 DJADLO CC(C)(C)[C@@H]([NH2+]CC1CCC(C(F)(F)F)CC1)C(F)(F)F ZINC000546028798 341151922 /nfs/dbraw/zinc/15/19/22/341151922.db2.gz MROXBACAKWXYIG-VQXHTEKXSA-N 1 2 319.333 4.922 20 0 DJADLO CCc1ccc(C[NH2+][C@@H](C)c2nc(-c3ccccc3)cs2)o1 ZINC000133232336 341165170 /nfs/dbraw/zinc/16/51/70/341165170.db2.gz NNKLDDBVHJMUDA-ZDUSSCGKSA-N 1 2 312.438 4.816 20 0 DJADLO C[C@H](c1cc2ccccc2o1)[N@H+](C)Cc1ccncc1Cl ZINC000075586250 341178784 /nfs/dbraw/zinc/17/87/84/341178784.db2.gz YCJYAQOSDKHOJP-GFCCVEGCSA-N 1 2 300.789 4.674 20 0 DJADLO C[C@H](c1cc2ccccc2o1)[N@@H+](C)Cc1ccncc1Cl ZINC000075586250 341178785 /nfs/dbraw/zinc/17/87/85/341178785.db2.gz YCJYAQOSDKHOJP-GFCCVEGCSA-N 1 2 300.789 4.674 20 0 DJADLO CC[N@H+](Cc1ncc(C)o1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000075674651 341180639 /nfs/dbraw/zinc/18/06/39/341180639.db2.gz RIHKMJSAZWZEEM-LBPRGKRZSA-N 1 2 312.335 4.585 20 0 DJADLO CC[N@@H+](Cc1ncc(C)o1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000075674651 341180640 /nfs/dbraw/zinc/18/06/40/341180640.db2.gz RIHKMJSAZWZEEM-LBPRGKRZSA-N 1 2 312.335 4.585 20 0 DJADLO C[C@H]([NH2+][C@@H](c1ccccc1)c1ccc(F)cc1)c1nccs1 ZINC000134218932 341209786 /nfs/dbraw/zinc/20/97/86/341209786.db2.gz QIVFZBBHGLVCLI-GUYCJALGSA-N 1 2 312.413 4.722 20 0 DJADLO Cc1cnc([C@@H](C)[NH2+]Cc2c(Cl)oc3ccccc32)s1 ZINC000135537498 341241500 /nfs/dbraw/zinc/24/15/00/341241500.db2.gz OXQIGOUETHLLDA-SNVBAGLBSA-N 1 2 306.818 4.702 20 0 DJADLO c1coc([C@@H]2CCCCC[N@H+]2Cc2csc(C3CC3)n2)c1 ZINC000135581653 341242400 /nfs/dbraw/zinc/24/24/00/341242400.db2.gz TWIRISFZXYPZQJ-HNNXBMFYSA-N 1 2 302.443 4.731 20 0 DJADLO c1coc([C@@H]2CCCCC[N@@H+]2Cc2csc(C3CC3)n2)c1 ZINC000135581653 341242401 /nfs/dbraw/zinc/24/24/01/341242401.db2.gz TWIRISFZXYPZQJ-HNNXBMFYSA-N 1 2 302.443 4.731 20 0 DJADLO C[C@@H]([NH2+][C@@H](c1ccco1)c1ccccc1)c1c(F)cccc1F ZINC000078991488 341251525 /nfs/dbraw/zinc/25/15/25/341251525.db2.gz WMVGVMSXTGEPLG-BFUOFWGJSA-N 1 2 313.347 4.998 20 0 DJADLO CCCCc1noc([C@@H](C)[NH2+][C@@H](C)c2cccc3ccccc32)n1 ZINC000079287787 341256269 /nfs/dbraw/zinc/25/62/69/341256269.db2.gz OJFHTFOWJBZDNJ-LSDHHAIUSA-N 1 2 323.440 4.977 20 0 DJADLO CC[C@H]([NH2+]Cc1cccc(Cl)c1Cl)c1nccs1 ZINC000080262537 341271727 /nfs/dbraw/zinc/27/17/27/341271727.db2.gz HAZMJRXZQBMLNW-NSHDSACASA-N 1 2 301.242 4.691 20 0 DJADLO Cc1[nH+]c(C(C)C)ccc1CSc1ncnc2sccc21 ZINC000549306540 341290817 /nfs/dbraw/zinc/29/08/17/341290817.db2.gz LZCBXJOQLLJACQ-UHFFFAOYSA-N 1 2 315.467 4.810 20 0 DJADLO CCO[C@@H](C)c1nc(C[N@H+](C)[C@H](C)c2cccc(C)c2)cs1 ZINC000245453255 341294952 /nfs/dbraw/zinc/29/49/52/341294952.db2.gz RATMBYFJVJSTSJ-CABCVRRESA-N 1 2 318.486 4.742 20 0 DJADLO CCO[C@@H](C)c1nc(C[N@@H+](C)[C@H](C)c2cccc(C)c2)cs1 ZINC000245453255 341294953 /nfs/dbraw/zinc/29/49/53/341294953.db2.gz RATMBYFJVJSTSJ-CABCVRRESA-N 1 2 318.486 4.742 20 0 DJADLO C[C@H]1C[N@H+](Cc2ncc(-c3cccs3)o2)[C@@H]1c1ccccc1 ZINC000081574899 341297381 /nfs/dbraw/zinc/29/73/81/341297381.db2.gz PQEPDHUFQNXNEB-UGSOOPFHSA-N 1 2 310.422 4.596 20 0 DJADLO C[C@H]1C[N@@H+](Cc2ncc(-c3cccs3)o2)[C@@H]1c1ccccc1 ZINC000081574899 341297382 /nfs/dbraw/zinc/29/73/82/341297382.db2.gz PQEPDHUFQNXNEB-UGSOOPFHSA-N 1 2 310.422 4.596 20 0 DJADLO Cc1nc(C(C)C)ccc1C[N@@H+]1CCc2c3ccccc3[nH]c2C1 ZINC000549921859 341306676 /nfs/dbraw/zinc/30/66/76/341306676.db2.gz NJGXXPSHITZSJZ-UHFFFAOYSA-N 1 2 319.452 4.553 20 0 DJADLO Cc1nc(C(C)C)ccc1C[N@H+]1CCc2c3ccccc3[nH]c2C1 ZINC000549921859 341306677 /nfs/dbraw/zinc/30/66/77/341306677.db2.gz NJGXXPSHITZSJZ-UHFFFAOYSA-N 1 2 319.452 4.553 20 0 DJADLO CC[C@@H](C)Oc1cccc(N[C@@H](c2[nH]cc[nH+]2)c2ccccc2)c1 ZINC000550855970 341324517 /nfs/dbraw/zinc/32/45/17/341324517.db2.gz GHCDFESFPVCFKD-DNVCBOLYSA-N 1 2 321.424 4.789 20 0 DJADLO COc1ccccc1-c1ccc([C@@H](C)[NH2+]CC(C)(F)F)cc1 ZINC000550869685 341325067 /nfs/dbraw/zinc/32/50/67/341325067.db2.gz CJZZJJPZNSBTJS-CYBMUJFWSA-N 1 2 305.368 4.668 20 0 DJADLO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1Cl)c1cn2ccccc2n1 ZINC000551315318 341338346 /nfs/dbraw/zinc/33/83/46/341338346.db2.gz RBXKFEHPLYIDMZ-VXGBXAGGSA-N 1 2 317.795 4.539 20 0 DJADLO Cc1ccnc(C[N@@H+](CC(C)C)[C@@H](C)c2ccccc2Cl)n1 ZINC000551421392 341341257 /nfs/dbraw/zinc/34/12/57/341341257.db2.gz BXFQPRSNEUBBOM-HNNXBMFYSA-N 1 2 317.864 4.658 20 0 DJADLO Cc1ccnc(C[N@H+](CC(C)C)[C@@H](C)c2ccccc2Cl)n1 ZINC000551421392 341341258 /nfs/dbraw/zinc/34/12/58/341341258.db2.gz BXFQPRSNEUBBOM-HNNXBMFYSA-N 1 2 317.864 4.658 20 0 DJADLO CCSCc1cccc(NCc2cn3cc(C)ccc3[nH+]2)c1 ZINC000551596429 341346899 /nfs/dbraw/zinc/34/68/99/341346899.db2.gz HIJVBHPNYBMNOY-UHFFFAOYSA-N 1 2 311.454 4.508 20 0 DJADLO C[C@@H]1c2cccn2CC[N@H+]1Cc1cnc(C2CCCCC2)s1 ZINC000551921543 341355090 /nfs/dbraw/zinc/35/50/90/341355090.db2.gz PGBXGDJAMIOZAP-CQSZACIVSA-N 1 2 315.486 4.569 20 0 DJADLO C[C@@H]1c2cccn2CC[N@@H+]1Cc1cnc(C2CCCCC2)s1 ZINC000551921543 341355091 /nfs/dbraw/zinc/35/50/91/341355091.db2.gz PGBXGDJAMIOZAP-CQSZACIVSA-N 1 2 315.486 4.569 20 0 DJADLO CC(C)Cc1cccc([C@H](C)[NH2+]Cc2nnc(C(C)C)s2)c1 ZINC000552057376 341365707 /nfs/dbraw/zinc/36/57/07/341365707.db2.gz QZCVIOMAPOTOEF-AWEZNQCLSA-N 1 2 317.502 4.711 20 0 DJADLO C[C@H]([NH2+][C@@H](c1nccn1C)C1CC1)c1ccc(Cl)cc1Cl ZINC000552088240 341368796 /nfs/dbraw/zinc/36/87/96/341368796.db2.gz DVFLFPOKICSPQP-ZUZCIYMTSA-N 1 2 324.255 4.529 20 0 DJADLO CCc1nc2cc(N[C@H](c3[nH]cc[nH+]3)C3CCCCC3)ccc2o1 ZINC000552275290 341383138 /nfs/dbraw/zinc/38/31/38/341383138.db2.gz QSFRIUGXCDSZBO-SFHVURJKSA-N 1 2 324.428 4.847 20 0 DJADLO CC[C@@H](C)[C@@H]([NH2+]Cc1noc(C(C)C)n1)c1ccc(Cl)cc1 ZINC000553338116 341426343 /nfs/dbraw/zinc/42/63/43/341426343.db2.gz UJGMLSJJEJHBGD-MLGOLLRUSA-N 1 2 321.852 4.723 20 0 DJADLO C[C@H](Nc1cc[nH+]c2c(Cl)cccc12)c1c(F)cncc1F ZINC000553671909 341433693 /nfs/dbraw/zinc/43/36/93/341433693.db2.gz BEFUYHYLBXWMTH-VIFPVBQESA-N 1 2 319.742 4.735 20 0 DJADLO Cc1nc([C@H](C)[NH2+]Cc2ccccc2OCCC(C)C)cs1 ZINC000553859675 341437229 /nfs/dbraw/zinc/43/72/29/341437229.db2.gz VCUOLIZVMRTWRU-AWEZNQCLSA-N 1 2 318.486 4.727 20 0 DJADLO Cc1nc([C@@H](C)[NH2+][C@H](c2ccc(C(C)(C)C)cc2)C(C)C)no1 ZINC000565567122 341531328 /nfs/dbraw/zinc/53/13/28/341531328.db2.gz SCHHJDCOCRMKOV-DYVFJYSZSA-N 1 2 315.461 4.723 20 0 DJADLO Cc1nc([C@H](C)[NH2+][C@@H](c2ccc(C(C)(C)C)cc2)C(C)C)no1 ZINC000565567124 341531361 /nfs/dbraw/zinc/53/13/61/341531361.db2.gz SCHHJDCOCRMKOV-SUMWQHHRSA-N 1 2 315.461 4.723 20 0 DJADLO CC(C)(C)[C@@H]([NH2+]Cc1nc(C2CCCC2)no1)c1ccccc1 ZINC000156158101 341617555 /nfs/dbraw/zinc/61/75/55/341617555.db2.gz CHLKQJBCFCPHMH-KRWDZBQOSA-N 1 2 313.445 4.604 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1cccc(C2CC2)c1)c1nc(C(C)(C)C)no1 ZINC000574639983 341764465 /nfs/dbraw/zinc/76/44/65/341764465.db2.gz SVCAPXCECKUXMK-STQMWFEESA-N 1 2 313.445 4.656 20 0 DJADLO CC[C@H]([NH2+][C@H](C)c1nc(C(C)(C)C)no1)c1cccc(Cl)c1 ZINC000173454444 341816810 /nfs/dbraw/zinc/81/68/10/341816810.db2.gz DQXBLLWAYDGFCV-RISCZKNCSA-N 1 2 321.852 4.822 20 0 DJADLO Cc1ccc(NC(=O)N(C)[C@H](C)c2ccc(Cl)cc2)c(C)[nH+]1 ZINC000152153659 518189295 /nfs/dbraw/zinc/18/92/95/518189295.db2.gz PCMNRCFUGHTESY-CYBMUJFWSA-N 1 2 317.820 4.577 20 0 DJADLO CC(C)n1cc[nH+]c1CNc1ccccc1CCC(F)(F)F ZINC000124776951 520035354 /nfs/dbraw/zinc/03/53/54/520035354.db2.gz RPGQFUHTGWDRLR-UHFFFAOYSA-N 1 2 311.351 4.571 20 0 DJADLO CCC[C@H](C)N(C)C(=O)Nc1cccc(Oc2cc[nH+]cc2)c1 ZINC000264852129 521031194 /nfs/dbraw/zinc/03/11/94/521031194.db2.gz OZGVOYIQEJJMFT-AWEZNQCLSA-N 1 2 313.401 4.526 20 0 DJADLO COc1ccc(Cl)cc1[C@H](CC(C)C)[NH2+]Cc1ncc(C)o1 ZINC000179664662 524253928 /nfs/dbraw/zinc/25/39/28/524253928.db2.gz VUPASRLXKBWTJL-HNNXBMFYSA-N 1 2 322.836 4.522 20 0 DJADLO COc1ccc(F)cc1[C@H](C)[NH2+][C@@H](C)c1csc(C(C)C)n1 ZINC000181019501 524334572 /nfs/dbraw/zinc/33/45/72/524334572.db2.gz BRWZCZPTYRXOFM-RYUDHWBXSA-N 1 2 322.449 4.826 20 0 DJADLO C[C@H]([NH2+]Cc1noc(C2CCCCC2)n1)c1ccc(Cl)cc1 ZINC000157328380 525497779 /nfs/dbraw/zinc/49/77/79/525497779.db2.gz QPJPUXIYTVTKRL-LBPRGKRZSA-N 1 2 319.836 4.622 20 0 DJADLO C[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1Cl)c1cscn1 ZINC000162309811 525531768 /nfs/dbraw/zinc/53/17/68/525531768.db2.gz LVLHPLRMLKCTJL-IUCAKERBSA-N 1 2 301.242 4.862 20 0 DJADLO C[C@@H]([NH2+][C@@H](C)c1nccs1)c1cccc(Cl)c1Cl ZINC000153321998 525625317 /nfs/dbraw/zinc/62/53/17/525625317.db2.gz WIPGJIXLELWZNC-BDAKNGLRSA-N 1 2 301.242 4.862 20 0 DJADLO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2noc(-c3ccccc3)n2)s1 ZINC000124251650 525743084 /nfs/dbraw/zinc/74/30/84/525743084.db2.gz ITNXOFSCTSYHNM-OLZOCXBDSA-N 1 2 313.426 4.518 20 0 DJADLO COc1cccc(Cl)c1C[N@H+](C)[C@@H](C)c1sc(C)nc1C ZINC000338303513 526098085 /nfs/dbraw/zinc/09/80/85/526098085.db2.gz HDUYTEYVUFXBMV-NSHDSACASA-N 1 2 324.877 4.615 20 0 DJADLO COc1cccc(Cl)c1C[N@@H+](C)[C@@H](C)c1sc(C)nc1C ZINC000338303513 526098092 /nfs/dbraw/zinc/09/80/92/526098092.db2.gz HDUYTEYVUFXBMV-NSHDSACASA-N 1 2 324.877 4.615 20 0 DJADLO Clc1sc(Cl)c2c1CCC[C@@H]2[NH2+]Cc1nccs1 ZINC000128126535 527011845 /nfs/dbraw/zinc/01/18/45/527011845.db2.gz KWKCWVWWPXXZGH-QMMMGPOBSA-N 1 2 319.282 4.679 20 0 DJADLO CCSc1ccc(Cl)cc1N[C@H]1C[C@@H](C)n2cc[nH+]c21 ZINC000296578151 535737891 /nfs/dbraw/zinc/73/78/91/535737891.db2.gz VTKUPTINHXJYAB-MFKMUULPSA-N 1 2 307.850 4.766 20 0 DJADLO