smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1ccccc1[C@@H](C)[NH2+]Cc1ccccc1C[NH+]1CCCCC1 ZINC000409658595 332044297 /nfs/dbraw/zinc/04/42/97/332044297.db2.gz UNXWQZAWFMYKLA-LJQANCHMSA-N 2 0 322.496 4.832 20 0 DJADRP C/C(=C/c1ccccc1)C[NH2+]Cc1ccccc1C[N@@H+](C)C(C)C ZINC000520949014 332119109 /nfs/dbraw/zinc/11/91/09/332119109.db2.gz OJTGGBRPAVDDRE-RGEXLXHISA-N 2 0 322.496 4.720 20 0 DJADRP CC[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1ccc(Cl)c(Cl)c1 ZINC000566245012 332276702 /nfs/dbraw/zinc/27/67/02/332276702.db2.gz HRHLLITZLVNCPL-KRWDZBQOSA-N 2 0 323.267 4.693 20 0 DJADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1ccc(-c2ccccc2)o1 ZINC000518748339 332330093 /nfs/dbraw/zinc/33/00/93/332330093.db2.gz MHYXTROSBVZHBT-QGZVFWFLSA-N 2 0 314.473 4.547 20 0 DJADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cccc(Cl)c1Cl ZINC000560523864 332350879 /nfs/dbraw/zinc/35/08/79/332350879.db2.gz FYUPZYYMYIZWAX-HIFPTAJRSA-N 2 0 315.288 4.517 20 0 DJADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cc(Cl)ccc1Cl ZINC000560528339 332351610 /nfs/dbraw/zinc/35/16/10/332351610.db2.gz PXBFHAIPLDHMSJ-XGNXJENSSA-N 2 0 315.288 4.517 20 0 DJADRP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(-c2ccccc2)cc1 ZINC000378906256 333062455 /nfs/dbraw/zinc/06/24/55/333062455.db2.gz FKTIRYKYHHXCBQ-HSQYWUDLSA-N 2 0 320.480 4.631 20 0 DJADRP Cc1ccc(C[NH2+]Cc2ccccc2C[NH+]2CCCCCC2)cc1 ZINC000497201593 333221244 /nfs/dbraw/zinc/22/12/44/333221244.db2.gz VVEUNXFWEUAAPP-UHFFFAOYSA-N 2 0 322.496 4.661 20 0 DJADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](c2ccccc2)C2CC2)cc1 ZINC000391965559 335140830 /nfs/dbraw/zinc/14/08/30/335140830.db2.gz FQSYLRBLLSBHAY-QFIPXVFZSA-N 2 0 322.496 4.769 20 0 DJADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H](C)CCc2ccc(Cl)s2)cc1 ZINC000414812348 334106345 /nfs/dbraw/zinc/10/63/45/334106345.db2.gz KUXVSULFGKDVRQ-QWHCGFSZSA-N 2 0 322.905 4.532 20 0 DJADRP CCC[C@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1ccsc1 ZINC000187747108 334270953 /nfs/dbraw/zinc/27/09/53/334270953.db2.gz NUZYYFSGRCCXAP-SFHVURJKSA-N 2 0 306.519 4.586 20 0 DJADRP CCSc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)cc1 ZINC000534495573 334277543 /nfs/dbraw/zinc/27/75/43/334277543.db2.gz DOKAUZGAIKCUGF-DLBZAZTESA-N 2 0 320.546 4.570 20 0 DJADRP CC(C)=CCC[C@H](C)[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000531950176 334304140 /nfs/dbraw/zinc/30/41/40/334304140.db2.gz DZSAKASTBSEVIO-KRWDZBQOSA-N 2 0 320.546 4.685 20 0 DJADRP CC[C@@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1cccc(Cl)c1 ZINC000532188465 335912825 /nfs/dbraw/zinc/91/28/25/335912825.db2.gz FNEXNHGONJDZJH-LJQANCHMSA-N 2 0 316.876 4.643 20 0 DJADRP CCC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1)c1ccsc1 ZINC000443082458 336398429 /nfs/dbraw/zinc/39/84/29/336398429.db2.gz YLOIWMUOTCNYQF-FUHWJXTLSA-N 2 0 308.535 4.547 20 0 DJADRP C[C@@H]([NH2+]C1CCC([NH3+])CC1)c1ccc(SC2CCCC2)cc1 ZINC000423208119 337704029 /nfs/dbraw/zinc/70/40/29/337704029.db2.gz DAZWJKUTLBVRJI-ODIFPOPNSA-N 2 0 318.530 4.642 20 0 DJADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](C)c2cc(Cl)ccc2Cl)cc1 ZINC000423291814 337710095 /nfs/dbraw/zinc/71/00/95/337710095.db2.gz JYMPYMCCEZVWAS-VXGBXAGGSA-N 2 0 323.267 4.864 20 0 DJADRP CC(C)C[C@H]([NH2+]Cc1ccc([C@@H](C)[NH3+])cc1)c1cccs1 ZINC000423296561 337710978 /nfs/dbraw/zinc/71/09/78/337710978.db2.gz ZKPOFZDRNJROTK-PBHICJAKSA-N 2 0 302.487 4.645 20 0 DJADRP CCC[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccsc1 ZINC000423502352 337723437 /nfs/dbraw/zinc/72/34/37/337723437.db2.gz DVWIAAJFJJUVKV-ROUUACIJSA-N 2 0 302.487 4.659 20 0 DJADRP C[C@@H]1CC[C@@H]([NH2+][C@H](CCC[NH3+])c2ccccc2)c2sccc21 ZINC000423506377 337723733 /nfs/dbraw/zinc/72/37/33/337723733.db2.gz INVGJNAPGBHTES-ZTFGCOKTSA-N 2 0 314.498 4.756 20 0 DJADRP CSc1ccc([C@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423519049 337724333 /nfs/dbraw/zinc/72/43/33/337724333.db2.gz ZSWAXRZANCYEHT-KXBFYZLASA-N 2 0 314.498 4.539 20 0 DJADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1ccc(Cl)s1 ZINC000035285810 337742750 /nfs/dbraw/zinc/74/27/50/337742750.db2.gz FNFAHTNJPKNPOP-QWHCGFSZSA-N 2 0 302.915 4.563 20 0 DJADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1ccc(Cl)c(F)c1 ZINC000212277753 337849188 /nfs/dbraw/zinc/84/91/88/337849188.db2.gz KEEZBQXPFHWAGQ-KGLIPLIRSA-N 2 0 314.876 4.640 20 0 DJADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1csc(Cl)c1Cl ZINC000432234125 338149449 /nfs/dbraw/zinc/14/94/49/338149449.db2.gz ULMKWFFIGFPJEG-LLVKDONJSA-N 2 0 323.333 4.655 20 0 DJADRP C[C@H]1CC[C@H]([NH2+]Cc2ccc(C[NH+](C)C)cc2)c2sccc21 ZINC000453080442 338791343 /nfs/dbraw/zinc/79/13/43/338791343.db2.gz JQRMDCPAUIBWJE-KSSFIOAISA-N 2 0 314.498 4.538 20 0 DJADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1csc(Cl)c1 ZINC000468818392 339271585 /nfs/dbraw/zinc/27/15/85/339271585.db2.gz CZZXAIPGUAEOKH-ZIAGYGMSSA-N 2 0 314.926 4.707 20 0 DJADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1csc(Cl)c1 ZINC000469061574 339278969 /nfs/dbraw/zinc/27/89/69/339278969.db2.gz SHZDTTBPYLGXGZ-KBPBESRZSA-N 2 0 314.926 4.564 20 0 DJADRP CC(C)[NH+]1CCC([NH2+][C@@H](CC2CC2)c2ccc(Cl)cc2)CC1 ZINC000469204345 339283059 /nfs/dbraw/zinc/28/30/59/339283059.db2.gz ONQXYXUZPOREIC-IBGZPJMESA-N 2 0 320.908 4.644 20 0 DJADRP CCc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+](CC)CC)cc2)o1 ZINC000480147538 339560468 /nfs/dbraw/zinc/56/04/68/339560468.db2.gz VLEMPIJKMBXSRR-MRXNPFEDSA-N 2 0 314.473 4.535 20 0 DJADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2ccc(C)s2)c1 ZINC000481291358 339599895 /nfs/dbraw/zinc/59/98/95/339599895.db2.gz BJKIKOQEBYUNRV-MRXNPFEDSA-N 2 0 316.514 4.749 20 0 DJADRP Cc1cccc2c1[C@H](C)C[C@H]2[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000504900273 340155218 /nfs/dbraw/zinc/15/52/18/340155218.db2.gz UYYFFDYIXJAJTR-OXQOHEQNSA-N 2 0 312.501 4.540 20 0 DJADRP CC1CC[NH+](C2CCC([NH2+][C@H]3CCC[C@@H]3CCCF)CC2)CC1 ZINC000510696929 340307142 /nfs/dbraw/zinc/30/71/42/340307142.db2.gz SKMLMOICCUNKOA-OAHAVBBTSA-N 2 0 324.528 4.538 20 0 DJADRP Cc1ccc([C@@H]([NH2+]C2CCC([NH+](C)C)CC2)c2ccccc2)cc1 ZINC000513713172 340421314 /nfs/dbraw/zinc/42/13/14/340421314.db2.gz LJQNTCGULYZBKO-HRTMPFAESA-N 2 0 322.496 4.547 20 0 DJADRP C[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccc2ccccc2c1 ZINC000177199366 340437221 /nfs/dbraw/zinc/43/72/21/340437221.db2.gz RAPYLCGGVZWXOF-KRWDZBQOSA-N 2 0 318.464 4.752 20 0 DJADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2cc(Cl)cs2)c1 ZINC000193011150 340571497 /nfs/dbraw/zinc/57/14/97/340571497.db2.gz SRAIEJXFWROEMV-UHFFFAOYSA-N 2 0 322.905 4.533 20 0 DJADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1ccccc1 ZINC000564258579 341019122 /nfs/dbraw/zinc/01/91/22/341019122.db2.gz WBOJJLIQXJCODM-IBGZPJMESA-N 2 0 322.496 4.769 20 0 DJADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1ccc(F)cc1 ZINC000072895517 341110181 /nfs/dbraw/zinc/11/01/81/341110181.db2.gz HERVJSFBWPBKSX-INIZCTEOSA-N 2 0 314.448 4.518 20 0 DJADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)c1ccco1 ZINC000247180532 341361903 /nfs/dbraw/zinc/36/19/03/341361903.db2.gz VDHDMTLHTUKJFT-DLBZAZTESA-N 2 0 312.457 4.505 20 0 DJADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1)c1ccoc1 ZINC000178217471 341949529 /nfs/dbraw/zinc/94/95/29/341949529.db2.gz ZOPNSOHNDGISSQ-KRWDZBQOSA-N 2 0 312.457 4.506 20 0 DJADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+]Cc2cccc(-c3ccccc3)c2)C1 ZINC000518274452 332004402 /nfs/dbraw/zinc/00/44/02/332004402.db2.gz GRBNDTYAWRHLDQ-HXUWFJFHSA-N 2 0 322.496 4.564 20 0 DJADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1cc2ccccc2o1 ZINC000314253612 333096493 /nfs/dbraw/zinc/09/64/93/333096493.db2.gz XTQHHBUCRUJCGO-HZPDHXFCSA-N 2 0 302.462 4.594 20 0 DJADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1ccc(Cl)cc1Cl ZINC000021051872 333413598 /nfs/dbraw/zinc/41/35/98/333413598.db2.gz ZUOZXWOPKNIXJN-ZDUSSCGKSA-N 2 0 317.304 4.594 20 0 DJADRP [NH3+]CCC[C@@H]([NH2+]Cc1cc(Cl)ccc1Cl)c1ccccc1 ZINC000415047141 334261423 /nfs/dbraw/zinc/26/14/23/334261423.db2.gz DVOQBWVJACMYLL-QGZVFWFLSA-N 2 0 323.267 4.563 20 0 DJADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](CC2CC2)c2ccccc2)c1 ZINC000531959222 334314827 /nfs/dbraw/zinc/31/48/27/334314827.db2.gz RTHLFPMTLNDEAI-JOCHJYFZSA-N 2 0 322.496 4.769 20 0 DJADRP CCC[C@@H]([NH2+]C1CCN(C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000532454800 336248264 /nfs/dbraw/zinc/24/82/64/336248264.db2.gz RIHOENSRVBDPHC-MRXNPFEDSA-N 2 0 315.288 4.518 20 0 DJADRP CC(C)c1ccc([C@@H](C)[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000324910316 336272967 /nfs/dbraw/zinc/27/29/67/336272967.db2.gz XDKNAGCSMWNEPH-QGZVFWFLSA-N 2 0 323.484 4.525 20 0 DJADRP CC(C)(C)C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1ccc(F)cc1 ZINC000572159453 337594227 /nfs/dbraw/zinc/59/42/27/337594227.db2.gz MKFZKJGFVPYNHD-IBGZPJMESA-N 2 0 314.448 4.552 20 0 DJADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](c1cc2ccccc2o1)c1ccccc1 ZINC000422928179 337691953 /nfs/dbraw/zinc/69/19/53/337691953.db2.gz JJMIVJUGMRCKNJ-HRAATJIYSA-N 2 0 322.452 4.629 20 0 DJADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)cc1 ZINC000423291813 337710085 /nfs/dbraw/zinc/71/00/85/337710085.db2.gz JYMPYMCCEZVWAS-RYUDHWBXSA-N 2 0 323.267 4.864 20 0 DJADRP Cc1ccc2cc([C@H](C)[NH2+]Cc3ccc([C@H](C)[NH3+])cc3)oc2c1 ZINC000423292023 337710124 /nfs/dbraw/zinc/71/01/24/337710124.db2.gz KZSDNJPSRFLXTH-GJZGRUSLSA-N 2 0 308.425 4.612 20 0 DJADRP C[C@@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccc(SC2CCCC2)cc1 ZINC000423371764 337715150 /nfs/dbraw/zinc/71/51/50/337715150.db2.gz HWBPTLXPFMKSGS-INMHGKMJSA-N 2 0 318.530 4.512 20 0 DJADRP C[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1cccc2ccccc21 ZINC000423497380 337722984 /nfs/dbraw/zinc/72/29/84/337722984.db2.gz GVPFNVICJDTMPR-VGOFRKELSA-N 2 0 318.464 4.971 20 0 DJADRP Cc1c2ccccc2oc1[C@@H](C)[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000423507678 337723754 /nfs/dbraw/zinc/72/37/54/337723754.db2.gz QBNZACIVYQFCAS-APWZRJJASA-N 2 0 322.452 4.872 20 0 DJADRP C[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccc(F)cc1Cl ZINC000423517050 337724391 /nfs/dbraw/zinc/72/43/91/337724391.db2.gz YLJCDKHFTJYTIF-ACJLOTCBSA-N 2 0 320.839 4.610 20 0 DJADRP C[C@H](c1cccc2ccccc21)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000516299915 338010069 /nfs/dbraw/zinc/01/00/69/338010069.db2.gz QITJYMAIJBAILE-QGZVFWFLSA-N 2 0 310.485 4.565 20 0 DJADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+][C@@H]1CC[C@@H](c2ccccc2)C1 ZINC000436271675 338264721 /nfs/dbraw/zinc/26/47/21/338264721.db2.gz RAQDQUOCKPKHMD-HMXCVIKNSA-N 2 0 314.517 4.567 20 0 DJADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+][C@H]1CC[C@@H](c2ccccc2)C1 ZINC000436271676 338264813 /nfs/dbraw/zinc/26/48/13/338264813.db2.gz RAQDQUOCKPKHMD-NRSPTQNISA-N 2 0 314.517 4.567 20 0 DJADRP C[C@@H](CC(F)(F)F)[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449254648 338607291 /nfs/dbraw/zinc/60/72/91/338607291.db2.gz ZMAHQFLZFBCXBG-ZDUSSCGKSA-N 2 0 322.459 4.596 20 0 DJADRP C[C@H]1CC[C@@H]([NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)C1 ZINC000462679211 339083919 /nfs/dbraw/zinc/08/39/19/339083919.db2.gz HKGDBDFSHLQNCD-LAUBAEHRSA-N 2 0 322.496 4.693 20 0 DJADRP CC[C@@H]1CCC[C@@H]([NH2+]CC2CC[NH+](Cc3cccs3)CC2)C1 ZINC000462764835 339087412 /nfs/dbraw/zinc/08/74/12/339087412.db2.gz HDBWPXXQYVETML-SJLPKXTDSA-N 2 0 320.546 4.519 20 0 DJADRP CC[NH+](CC)C[C@H]1CC[N@@H+]([C@@H](C)c2ccc3ccccc3c2)C1 ZINC000464772634 339152318 /nfs/dbraw/zinc/15/23/18/339152318.db2.gz FIPPBAAYNAQBKK-ZWKOTPCHSA-N 2 0 310.485 4.565 20 0 DJADRP c1cc2c(s1)CCC[C@H]2[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000468030380 339251650 /nfs/dbraw/zinc/25/16/50/339251650.db2.gz POBDVXPQCNXVRC-GOSISDBHSA-N 2 0 318.530 4.512 20 0 DJADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1csc(Cl)c1 ZINC000468818375 339271645 /nfs/dbraw/zinc/27/16/45/339271645.db2.gz CZZXAIPGUAEOKH-UONOGXRCSA-N 2 0 314.926 4.707 20 0 DJADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1csc(Cl)c1 ZINC000469061919 339278897 /nfs/dbraw/zinc/27/88/97/339278897.db2.gz SHZDTTBPYLGXGZ-UONOGXRCSA-N 2 0 314.926 4.564 20 0 DJADRP CC(C)[NH+]1CCC([NH2+][C@H](CC2CC2)c2ccc(Cl)cc2)CC1 ZINC000469204463 339283020 /nfs/dbraw/zinc/28/30/20/339283020.db2.gz ONQXYXUZPOREIC-LJQANCHMSA-N 2 0 320.908 4.644 20 0 DJADRP C[C@H](c1ccc2ccccc2c1)[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000470961607 339333136 /nfs/dbraw/zinc/33/31/36/339333136.db2.gz TYKRYCVWFDGPOB-MJGOQNOKSA-N 2 0 322.496 4.565 20 0 DJADRP C[C@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1ccc(Cl)s1 ZINC000480615470 339579725 /nfs/dbraw/zinc/57/97/25/339579725.db2.gz PFQMQIUSFLPTDS-AWEZNQCLSA-N 2 0 314.926 4.564 20 0 DJADRP CC[C@@H]([NH2+]Cc1cccc(C[NH+](CC)CC)c1)c1cccs1 ZINC000481319620 339601075 /nfs/dbraw/zinc/60/10/75/339601075.db2.gz IALKNAPISCCJBU-GOSISDBHSA-N 2 0 316.514 4.831 20 0 DJADRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCC[C@H]3CCCF)CC2)CC1 ZINC000510696921 340307060 /nfs/dbraw/zinc/30/70/60/340307060.db2.gz SKMLMOICCUNKOA-DCCYDQLOSA-N 2 0 324.528 4.538 20 0 DJADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCC[C@@H]1CCCF ZINC000510732378 340308462 /nfs/dbraw/zinc/30/84/62/340308462.db2.gz HXIJVEHMPXVOBQ-YLJYHZDGSA-N 2 0 320.496 4.535 20 0 DJADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H]1CCC[C@@H]1CCCF ZINC000510732377 340308551 /nfs/dbraw/zinc/30/85/51/340308551.db2.gz HXIJVEHMPXVOBQ-XLIONFOSSA-N 2 0 320.496 4.535 20 0 DJADRP C[C@@H]([NH2+][C@@H](C)c1cccc(Cl)c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512314123 340356616 /nfs/dbraw/zinc/35/66/16/340356616.db2.gz MKNUNNKMWLOWTQ-ZMSDIMECSA-N 2 0 320.908 4.644 20 0 DJADRP Cc1cc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c(C)s1 ZINC000512317715 340356707 /nfs/dbraw/zinc/35/67/07/340356707.db2.gz FRPDMRJUWRIXGV-VYDXJSESSA-N 2 0 320.546 4.669 20 0 DJADRP C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512330387 340357469 /nfs/dbraw/zinc/35/74/69/340357469.db2.gz UDWYBDBWVKTXIC-ZMSDIMECSA-N 2 0 320.908 4.644 20 0 DJADRP CC[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc(F)cc1 ZINC000513058142 340391364 /nfs/dbraw/zinc/39/13/64/340391364.db2.gz OMUAVJKORUYNER-HXUWFJFHSA-N 2 0 318.480 4.664 20 0 DJADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1cc2c(ccc3ccccc23)o1 ZINC000538396319 340820874 /nfs/dbraw/zinc/82/08/74/340820874.db2.gz ZCJMLXHLDAINDG-HNNXBMFYSA-N 2 0 322.452 4.578 20 0 DJADRP CC(C)[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccccc1 ZINC000539164465 340875337 /nfs/dbraw/zinc/87/53/37/340875337.db2.gz RCPYCJUZNBARDP-JOCHJYFZSA-N 2 0 322.496 4.769 20 0 DJADRP CCCC[NH+]1CCC(N[C@H]2C[C@H](C)Sc3sccc32)CC1 ZINC000130472105 341022647 /nfs/dbraw/zinc/02/26/47/341022647.db2.gz MGMQFZUOIBWGHM-BBRMVZONSA-N 2 0 324.559 4.528 20 0 DJADRP C[NH+](C)CCCC[NH2+][C@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000545275440 341118579 /nfs/dbraw/zinc/11/85/79/341118579.db2.gz WRDCSRZOANAEBB-SFHVURJKSA-N 2 0 308.897 4.503 20 0 DJADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1cccc(F)c1 ZINC000079122125 341253996 /nfs/dbraw/zinc/25/39/96/341253996.db2.gz RMYCVJDLAWFVTC-MRXNPFEDSA-N 2 0 314.448 4.518 20 0 DJADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cc2cc(Cl)ccc2o1 ZINC000552062309 341366252 /nfs/dbraw/zinc/36/62/52/341366252.db2.gz TYFIIONPPIOJGP-JQRITLKVSA-N 2 0 320.864 4.610 20 0 DJADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(C(C)(C)C)cc1 ZINC000552253573 341381693 /nfs/dbraw/zinc/38/16/93/341381693.db2.gz KAGXRRJHQVFSHW-VNCLNFNDSA-N 2 0 302.506 4.508 20 0 DJADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H]2C[C@H](C)c3ccccc32)c1 ZINC000576379971 341843376 /nfs/dbraw/zinc/84/33/76/341843376.db2.gz PHAWDUUKJKGPCA-JTSKRJEESA-N 2 0 322.496 4.867 20 0 DJADRP Cc1cc(C)c(C[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)c(C)c1 ZINC000518265781 332003045 /nfs/dbraw/zinc/00/30/45/332003045.db2.gz CFLUCHCQFYVQBR-UHFFFAOYSA-N 2 0 324.512 4.742 20 0 DJADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+]CC(C)(C)C)cc1 ZINC000518269401 332003497 /nfs/dbraw/zinc/00/34/97/332003497.db2.gz DZSWHZWBBMTBPF-UHFFFAOYSA-N 2 0 310.485 4.551 20 0 DJADRP Cc1ccccc1C[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC000497323797 333236307 /nfs/dbraw/zinc/23/63/07/333236307.db2.gz XHLXQQGZNNKECF-UHFFFAOYSA-N 2 0 322.496 4.661 20 0 DJADRP [NH3+]CCC[C@@H]([NH2+]Cc1ccc(Cl)c(Cl)c1)c1ccccc1 ZINC000415058625 334261933 /nfs/dbraw/zinc/26/19/33/334261933.db2.gz UGJPJRAREWARIX-QGZVFWFLSA-N 2 0 323.267 4.563 20 0 DJADRP CCC[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccsc1 ZINC000187721685 334269645 /nfs/dbraw/zinc/26/96/45/334269645.db2.gz ABLYAWFDPNEWFC-SFHVURJKSA-N 2 0 320.477 4.580 20 0 DJADRP Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCCCC2)cc1 ZINC000531946099 334301294 /nfs/dbraw/zinc/30/12/94/334301294.db2.gz IQFBTICUGPEASC-LJQANCHMSA-N 2 0 322.496 4.832 20 0 DJADRP Cc1ccc(C)c([C@@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)c1 ZINC000531942419 334302408 /nfs/dbraw/zinc/30/24/08/334302408.db2.gz DBUPUBMALCQWEF-LJQANCHMSA-N 2 0 322.496 4.750 20 0 DJADRP CC(C)=CCC[C@@H](C)[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000531950177 334304087 /nfs/dbraw/zinc/30/40/87/334304087.db2.gz DZSAKASTBSEVIO-QGZVFWFLSA-N 2 0 320.546 4.685 20 0 DJADRP C[NH+](C)Cc1ccc(C[NH2+][C@@H](CC2CCC2)c2ccccc2)cc1 ZINC000344095377 335217474 /nfs/dbraw/zinc/21/74/74/335217474.db2.gz FYZBIOZZWPUOMW-QFIPXVFZSA-N 2 0 322.496 4.769 20 0 DJADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1ccc(C(C)C)cc1 ZINC000323887078 335646630 /nfs/dbraw/zinc/64/66/30/335646630.db2.gz VXXOFHRQACPZGI-UHFFFAOYSA-N 2 0 324.512 4.942 20 0 DJADRP C[C@H](c1cccc2ccccc21)[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000519225009 335817840 /nfs/dbraw/zinc/81/78/40/335817840.db2.gz JQUMNMJRSSBCMV-GOSISDBHSA-N 2 0 322.496 4.709 20 0 DJADRP CCC[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1)c1ccsc1 ZINC000443082464 336398348 /nfs/dbraw/zinc/39/83/48/336398348.db2.gz YLOIWMUOTCNYQF-SJLPKXTDSA-N 2 0 308.535 4.547 20 0 DJADRP CCC[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1)c1ccsc1 ZINC000443082468 336398401 /nfs/dbraw/zinc/39/84/01/336398401.db2.gz YLOIWMUOTCNYQF-WMZOPIPTSA-N 2 0 308.535 4.547 20 0 DJADRP CC(C)CC[C@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1ccoc1 ZINC000353432560 336417585 /nfs/dbraw/zinc/41/75/85/336417585.db2.gz CBDPTRXYDZFKST-FQEVSTJZSA-N 2 0 314.473 4.608 20 0 DJADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cc(Cl)cc(Cl)c1 ZINC000421890720 337655352 /nfs/dbraw/zinc/65/53/52/337655352.db2.gz YGDHIZJAOAJYDJ-VHWKEVPUSA-N 2 0 315.288 4.517 20 0 DJADRP Cc1cc2cc([C@@H](C)[NH2+]Cc3ccc([C@@H](C)[NH3+])cc3)oc2cc1C ZINC000423292004 337710069 /nfs/dbraw/zinc/71/00/69/337710069.db2.gz KXKQXXLLTOPMAA-HZPDHXFCSA-N 2 0 322.452 4.920 20 0 DJADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCCc3c(Cl)cccc32)cc1 ZINC000423294786 337710730 /nfs/dbraw/zinc/71/07/30/337710730.db2.gz VKPVCRGMFNCMTP-BFUOFWGJSA-N 2 0 314.860 4.527 20 0 DJADRP CCC[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccsc1 ZINC000423502351 337723307 /nfs/dbraw/zinc/72/33/07/337723307.db2.gz DVWIAAJFJJUVKV-QZTJIDSGSA-N 2 0 302.487 4.659 20 0 DJADRP CSc1ccccc1[C@H](C)[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000423501375 337723330 /nfs/dbraw/zinc/72/33/30/337723330.db2.gz CRSICWQCZFSENK-MAUKXSAKSA-N 2 0 314.498 4.539 20 0 DJADRP Cc1cc([C@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cc(C)c1F ZINC000423507830 337723609 /nfs/dbraw/zinc/72/36/09/337723609.db2.gz QMSOMZDPWMFBCC-QFBILLFUSA-N 2 0 314.448 4.573 20 0 DJADRP Cc1cc([C@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc(C)c1F ZINC000423507829 337723652 /nfs/dbraw/zinc/72/36/52/337723652.db2.gz QMSOMZDPWMFBCC-LPHOPBHVSA-N 2 0 314.448 4.573 20 0 DJADRP C[C@@H]1CC[C@H]([NH2+][C@H](CCC[NH3+])c2ccccc2)c2ccccc21 ZINC000423510088 337723987 /nfs/dbraw/zinc/72/39/87/337723987.db2.gz RZYKSDRSAIEFIG-HBGVWJBISA-N 2 0 308.469 4.695 20 0 DJADRP C[C@@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccc(F)cc1 ZINC000536831620 337734573 /nfs/dbraw/zinc/73/45/73/337734573.db2.gz IPIQNVVWCMJIIW-PBPGXSGUSA-N 2 0 318.480 4.519 20 0 DJADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1ccc(Cl)s1 ZINC000035285807 337742644 /nfs/dbraw/zinc/74/26/44/337742644.db2.gz FNFAHTNJPKNPOP-STQMWFEESA-N 2 0 302.915 4.563 20 0 DJADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1ccc(Cl)c(F)c1 ZINC000212277889 337849185 /nfs/dbraw/zinc/84/91/85/337849185.db2.gz KEEZBQXPFHWAGQ-ZIAGYGMSSA-N 2 0 314.876 4.640 20 0 DJADRP CCC[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(Cl)cc1 ZINC000516557669 338015356 /nfs/dbraw/zinc/01/53/56/338015356.db2.gz ZNVJCNFWYARWEN-ABHNRTSZSA-N 2 0 308.897 4.644 20 0 DJADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc(C(F)F)cc2)CC1 ZINC000461399474 339063130 /nfs/dbraw/zinc/06/31/30/339063130.db2.gz FJYRPASPPZTQSN-UHFFFAOYSA-N 2 0 324.459 4.568 20 0 DJADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1csc(Cl)c1 ZINC000468818361 339271678 /nfs/dbraw/zinc/27/16/78/339271678.db2.gz CZZXAIPGUAEOKH-KGLIPLIRSA-N 2 0 314.926 4.707 20 0 DJADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1csc(Cl)c1 ZINC000469062088 339279017 /nfs/dbraw/zinc/27/90/17/339279017.db2.gz SHZDTTBPYLGXGZ-ZIAGYGMSSA-N 2 0 314.926 4.564 20 0 DJADRP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)[C@@H](C)c1ccc(Cl)cc1 ZINC000474594236 339419270 /nfs/dbraw/zinc/41/92/70/339419270.db2.gz DUSSUHYLGLFNLA-HUUCEWRRSA-N 2 0 322.924 4.685 20 0 DJADRP CC[C@@H]([NH2+][C@@H](C)CCC[NH+](CC)CC)c1ccc(Cl)s1 ZINC000479738343 339547356 /nfs/dbraw/zinc/54/73/56/339547356.db2.gz DYAVRWKHEMROME-UONOGXRCSA-N 2 0 316.942 4.953 20 0 DJADRP Cc1cc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)oc1C ZINC000502686365 340110449 /nfs/dbraw/zinc/11/04/49/340110449.db2.gz LZOIDUGZCBVIKW-MRXNPFEDSA-N 2 0 314.473 4.587 20 0 DJADRP Cc1cccc2c1[C@@H](C)C[C@@H]2[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000504900271 340155223 /nfs/dbraw/zinc/15/52/23/340155223.db2.gz UYYFFDYIXJAJTR-JXFKEZNVSA-N 2 0 312.501 4.540 20 0 DJADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H]2C[C@H](C)c3c2cccc3C)c1 ZINC000504927542 340156541 /nfs/dbraw/zinc/15/65/41/340156541.db2.gz QLNCCOCZDJZQQB-LAUBAEHRSA-N 2 0 322.496 4.785 20 0 DJADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)c1ccsc1 ZINC000509443483 340269716 /nfs/dbraw/zinc/26/97/16/340269716.db2.gz BGJBRKKDTIQBHU-INIZCTEOSA-N 2 0 314.498 4.585 20 0 DJADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2cc(C)c(C)cc2C)cc1 ZINC000302740193 340280338 /nfs/dbraw/zinc/28/03/38/340280338.db2.gz JMTCIXZALAHNCV-UHFFFAOYSA-N 2 0 324.512 4.743 20 0 DJADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCC[C@H]1CCCF ZINC000510732368 340308446 /nfs/dbraw/zinc/30/84/46/340308446.db2.gz HXIJVEHMPXVOBQ-FXAWDEMLSA-N 2 0 320.496 4.535 20 0 DJADRP CCCC[N@H+](C)CC1CC[NH+]([C@H]2CCCc3ccccc32)CC1 ZINC000512266085 340354714 /nfs/dbraw/zinc/35/47/14/340354714.db2.gz CZUUBVFBVXAGFL-NRFANRHFSA-N 2 0 314.517 4.508 20 0 DJADRP CCc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000512314232 340356512 /nfs/dbraw/zinc/35/65/12/340356512.db2.gz NPPUMGSCUIHVEI-ABSDTBQOSA-N 2 0 314.517 4.553 20 0 DJADRP Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1C ZINC000512330509 340357455 /nfs/dbraw/zinc/35/74/55/340357455.db2.gz FDKUFTHQBMXXSY-BJLQDIEVSA-N 2 0 314.517 4.607 20 0 DJADRP Cc1cc(C)cc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000512331825 340357505 /nfs/dbraw/zinc/35/75/05/340357505.db2.gz LCGFSGDNTVDRAV-GBESFXJTSA-N 2 0 314.517 4.607 20 0 DJADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)c1ccccc1 ZINC000078730484 341246966 /nfs/dbraw/zinc/24/69/66/341246966.db2.gz BKJIYFRXHDWWMA-SFHVURJKSA-N 2 0 308.469 4.523 20 0 DJADRP CC[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1ccc(Cl)c(Cl)c1 ZINC000566245013 332276709 /nfs/dbraw/zinc/27/67/09/332276709.db2.gz HRHLLITZLVNCPL-QGZVFWFLSA-N 2 0 323.267 4.693 20 0 DJADRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(-c2ccccc2)cc1 ZINC000378906257 333062308 /nfs/dbraw/zinc/06/23/08/333062308.db2.gz FKTIRYKYHHXCBQ-WTOYTKOKSA-N 2 0 320.480 4.631 20 0 DJADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1cc2ccccc2o1 ZINC000314253606 333096408 /nfs/dbraw/zinc/09/64/08/333096408.db2.gz XTQHHBUCRUJCGO-CVEARBPZSA-N 2 0 302.462 4.594 20 0 DJADRP CC(C)[NH+]1CCC([NH2+][C@H](C)c2ccc(C(C)(C)C)cc2)CC1 ZINC000314321168 333102250 /nfs/dbraw/zinc/10/22/50/333102250.db2.gz HPPNXKFIYDTUBD-MRXNPFEDSA-N 2 0 302.506 4.508 20 0 DJADRP Cc1cc(C)c([C@H](C)[NH2+]C2CC[NH+](C(C)(C)C)CC2)cc1C ZINC000314520070 333136993 /nfs/dbraw/zinc/13/69/93/333136993.db2.gz YABZDEJFJTVRCV-KRWDZBQOSA-N 2 0 302.506 4.525 20 0 DJADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1ccc(SC)cc1 ZINC000021013134 333412155 /nfs/dbraw/zinc/41/21/55/333412155.db2.gz UHBYDIIHSVKFSE-JKSUJKDBSA-N 2 0 308.535 4.570 20 0 DJADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2)cc1 ZINC000320081275 333423931 /nfs/dbraw/zinc/42/39/31/333423931.db2.gz WATVWTLHNRBZQK-MRXNPFEDSA-N 2 0 314.448 4.518 20 0 DJADRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)c1cc(Cl)sc1Cl ZINC000453395281 334265283 /nfs/dbraw/zinc/26/52/83/334265283.db2.gz HNWJVLRSWYBGEW-SNVBAGLBSA-N 2 0 321.317 4.580 20 0 DJADRP C[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cc2ccccc2s1 ZINC000187729158 334269822 /nfs/dbraw/zinc/26/98/22/334269822.db2.gz NBBRRXRVDYEGCN-OAHLLOKOSA-N 2 0 324.493 4.814 20 0 DJADRP CCSc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)cc1 ZINC000534495575 334277559 /nfs/dbraw/zinc/27/75/59/334277559.db2.gz DOKAUZGAIKCUGF-IRXDYDNUSA-N 2 0 320.546 4.570 20 0 DJADRP Cc1ccc(C)c([C@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)c1 ZINC000531942415 334302286 /nfs/dbraw/zinc/30/22/86/334302286.db2.gz DBUPUBMALCQWEF-IBGZPJMESA-N 2 0 322.496 4.750 20 0 DJADRP CC[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cccc(Cl)c1 ZINC000343939857 335203339 /nfs/dbraw/zinc/20/33/39/335203339.db2.gz HQNYCRUQOKHPJO-IBGZPJMESA-N 2 0 316.876 4.643 20 0 DJADRP CCSc1ccc([C@@H](C)[NH2+]CCC2CC[NH+](CC)CC2)cc1 ZINC000535988957 335807130 /nfs/dbraw/zinc/80/71/30/335807130.db2.gz NMMBADHHAAIKAH-MRXNPFEDSA-N 2 0 320.546 4.571 20 0 DJADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H]1CCCc2ccccc21 ZINC000353050725 336391615 /nfs/dbraw/zinc/39/16/15/336391615.db2.gz VSTFMAWBUDTEFI-QFIPXVFZSA-N 2 0 322.496 4.694 20 0 DJADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2)cc1 ZINC000423288922 337709688 /nfs/dbraw/zinc/70/96/88/337709688.db2.gz AALRJBQXYSMBEW-STQMWFEESA-N 2 0 322.374 4.576 20 0 DJADRP Cc1ccc([C@@H]([NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)C2CCCC2)o1 ZINC000423292436 337710261 /nfs/dbraw/zinc/71/02/61/337710261.db2.gz MZSLDRFBFJNNGG-QRWLVFNGSA-N 2 0 312.457 4.629 20 0 DJADRP CC[C@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1cccc(Cl)c1F ZINC000423296489 337710866 /nfs/dbraw/zinc/71/08/66/337710866.db2.gz ZHRMKLNOLMZGDA-SJCJKPOMSA-N 2 0 320.839 4.740 20 0 DJADRP CC[C@@H]([NH2+]Cc1ccc([C@@H](C)[NH3+])cc1)c1cccc(Cl)c1F ZINC000423296542 337710921 /nfs/dbraw/zinc/71/09/21/337710921.db2.gz ZHRMKLNOLMZGDA-SJKOYZFVSA-N 2 0 320.839 4.740 20 0 DJADRP CC[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccc(Cl)s1 ZINC000423497065 337723045 /nfs/dbraw/zinc/72/30/45/337723045.db2.gz FYBOAYHTPWTPFK-GJZGRUSLSA-N 2 0 322.905 4.922 20 0 DJADRP CSc1ccccc1[C@@H](C)[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000423501377 337723316 /nfs/dbraw/zinc/72/33/16/337723316.db2.gz CRSICWQCZFSENK-QAPCUYQASA-N 2 0 314.498 4.539 20 0 DJADRP C[C@@H]1CC[C@H]([NH2+][C@H](CCC[NH3+])c2ccccc2)c2sccc21 ZINC000423506376 337723660 /nfs/dbraw/zinc/72/36/60/337723660.db2.gz INVGJNAPGBHTES-OLMNPRSZSA-N 2 0 314.498 4.756 20 0 DJADRP C[C@@H]1CC[C@H]([NH2+][C@@H](CCC[NH3+])c2ccccc2)c2ccccc21 ZINC000423510086 337723954 /nfs/dbraw/zinc/72/39/54/337723954.db2.gz RZYKSDRSAIEFIG-CZAAIQMYSA-N 2 0 308.469 4.695 20 0 DJADRP CC[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1cccc(Cl)c1 ZINC000423510865 337723961 /nfs/dbraw/zinc/72/39/61/337723961.db2.gz SOLORLNQFBBAMN-MOPGFXCFSA-N 2 0 316.876 4.861 20 0 DJADRP CC[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1cccc(Cl)c1 ZINC000423510866 337724043 /nfs/dbraw/zinc/72/40/43/337724043.db2.gz SOLORLNQFBBAMN-OALUTQOASA-N 2 0 316.876 4.861 20 0 DJADRP C[C@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccc(F)cc1 ZINC000536831599 337734533 /nfs/dbraw/zinc/73/45/33/337734533.db2.gz IPIQNVVWCMJIIW-DZIBYMRMSA-N 2 0 318.480 4.519 20 0 DJADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1)c1ccco1 ZINC000121648555 337896944 /nfs/dbraw/zinc/89/69/44/337896944.db2.gz SWOHCTLCDYILNX-KRWDZBQOSA-N 2 0 312.457 4.506 20 0 DJADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1csc(Cl)c1Cl ZINC000432234126 338149457 /nfs/dbraw/zinc/14/94/57/338149457.db2.gz ULMKWFFIGFPJEG-NSHDSACASA-N 2 0 323.333 4.655 20 0 DJADRP Cc1nccn1CCCC[N@@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC000459577899 339036882 /nfs/dbraw/zinc/03/68/82/339036882.db2.gz MGDRIYCKEVLYJW-HXUWFJFHSA-N 2 0 323.484 4.589 20 0 DJADRP CC1(C)CCC([NH2+]CC2CC[NH+](Cc3cccs3)CC2)CC1 ZINC000462767026 339087654 /nfs/dbraw/zinc/08/76/54/339087654.db2.gz MBGLUSMRTZZEPS-UHFFFAOYSA-N 2 0 320.546 4.519 20 0 DJADRP CCCC[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccccc1 ZINC000467830652 339247115 /nfs/dbraw/zinc/24/71/15/339247115.db2.gz CUMOIIRZVCDEKH-OAQYLSRUSA-N 2 0 310.485 4.769 20 0 DJADRP C[C@@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1csc(Cl)c1 ZINC000469094670 339279991 /nfs/dbraw/zinc/27/99/91/339279991.db2.gz WYAIHEAPLGOEKT-CQSZACIVSA-N 2 0 314.926 4.564 20 0 DJADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H]2CCc3c2cccc3C)cc1 ZINC000480135313 339560144 /nfs/dbraw/zinc/56/01/44/339560144.db2.gz AAVZQUATBUYCRG-QFIPXVFZSA-N 2 0 322.496 4.614 20 0 DJADRP CC[C@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc(C)cc1 ZINC000480170912 339561925 /nfs/dbraw/zinc/56/19/25/339561925.db2.gz OXBSIOVJPLUHCU-QFIPXVFZSA-N 2 0 322.496 4.832 20 0 DJADRP Cc1cccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c1C ZINC000480172451 339561979 /nfs/dbraw/zinc/56/19/79/339561979.db2.gz SXLICDCKXWVXRP-IBGZPJMESA-N 2 0 322.496 4.750 20 0 DJADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2ccc(C)cc2)c1 ZINC000481296092 339600148 /nfs/dbraw/zinc/60/01/48/339600148.db2.gz RBNFDEADEAIOKR-GOSISDBHSA-N 2 0 310.485 4.688 20 0 DJADRP CC[C@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@H](C)[C@H](n2ccnc2)C1 ZINC000503074411 340120317 /nfs/dbraw/zinc/12/03/17/340120317.db2.gz KHBIRICJCYOCCH-BMGDILEWSA-N 2 0 317.864 4.571 20 0 DJADRP CC[C@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@H](C)[C@@H](n2ccnc2)C1 ZINC000503074413 340120374 /nfs/dbraw/zinc/12/03/74/340120374.db2.gz KHBIRICJCYOCCH-QGTPRVQTSA-N 2 0 317.864 4.571 20 0 DJADRP Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000504900274 340155296 /nfs/dbraw/zinc/15/52/96/340155296.db2.gz UYYFFDYIXJAJTR-UZLBHIALSA-N 2 0 312.501 4.540 20 0 DJADRP Fc1ccc2c(c1)nccc2Nc1ccc(N2CCCCC2)nc1 ZINC000507607096 340225973 /nfs/dbraw/zinc/22/59/73/340225973.db2.gz PJMZECZIVKIJAA-UHFFFAOYSA-N 2 0 322.387 4.503 20 0 DJADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1ccc2occc2c1 ZINC000510239753 340293832 /nfs/dbraw/zinc/29/38/32/340293832.db2.gz JYRWUIUUKONLSY-UHFFFAOYSA-N 2 0 322.452 4.564 20 0 DJADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1ccc2occc2c1 ZINC000512097781 340348480 /nfs/dbraw/zinc/34/84/80/340348480.db2.gz FVCTYVHBIVKRGA-UHFFFAOYSA-N 2 0 322.452 4.563 20 0 DJADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2ccc3occc3c2)c1 ZINC000512119018 340349011 /nfs/dbraw/zinc/34/90/11/340349011.db2.gz AIXWNFXOVLLLPE-UHFFFAOYSA-N 2 0 322.452 4.564 20 0 DJADRP CCc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)s1 ZINC000512316178 340356506 /nfs/dbraw/zinc/35/65/06/340356506.db2.gz WZMUMKGOVFYJJM-HRCADAONSA-N 2 0 320.546 4.614 20 0 DJADRP CCc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)s1 ZINC000512316180 340356659 /nfs/dbraw/zinc/35/66/59/340356659.db2.gz WZMUMKGOVFYJJM-OWCLPIDISA-N 2 0 320.546 4.614 20 0 DJADRP CC[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(C)cc1 ZINC000512326902 340357337 /nfs/dbraw/zinc/35/73/37/340357337.db2.gz BDLGFNAGLURIRR-CUWPLCDZSA-N 2 0 314.517 4.689 20 0 DJADRP C[NH+](C)C1CCC([NH2+][C@@H](c2ccccc2F)C2CCCC2)CC1 ZINC000513664923 340418253 /nfs/dbraw/zinc/41/82/53/340418253.db2.gz ACJVCUQNLZKMLS-LBXVMSDZSA-N 2 0 318.480 4.519 20 0 DJADRP CC[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1cccc(C)c1 ZINC000513760474 340423721 /nfs/dbraw/zinc/42/37/21/340423721.db2.gz JLLQSMVIUUGOBC-JOCHJYFZSA-N 2 0 322.496 4.832 20 0 DJADRP CC(C)[C@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccccc1 ZINC000539163894 340875187 /nfs/dbraw/zinc/87/51/87/340875187.db2.gz KENUOCMFJKXZRE-QFIPXVFZSA-N 2 0 322.496 4.769 20 0 DJADRP CC[C@H]1CCC[C@H]([NH2+]CC2CC[NH+](Cc3cccs3)CC2)C1 ZINC000462764836 333109791 /nfs/dbraw/zinc/10/97/91/333109791.db2.gz HDBWPXXQYVETML-WMZOPIPTSA-N 2 0 320.546 4.519 20 0 DJADRP C[C@@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1cc2ccccc2s1 ZINC000170961417 333235949 /nfs/dbraw/zinc/23/59/49/333235949.db2.gz BNABPYLCXPGPLK-OAHLLOKOSA-N 2 0 324.493 4.814 20 0 DJADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2ccc(C)cc2)cc1 ZINC000320241524 333459594 /nfs/dbraw/zinc/45/95/94/333459594.db2.gz YRCVTINZAMTPRQ-SFHVURJKSA-N 2 0 310.485 4.688 20 0 DJADRP CC(C)(C)c1ccc(C[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1 ZINC000415066148 334262450 /nfs/dbraw/zinc/26/24/50/334262450.db2.gz NZECLDVXACCJBO-HXUWFJFHSA-N 2 0 310.485 4.554 20 0 DJADRP [NH3+]CCC[C@H]([NH2+]Cc1cc(Cl)cc(Cl)c1)c1ccccc1 ZINC000415061860 334262470 /nfs/dbraw/zinc/26/24/70/334262470.db2.gz YXAACICFYUSWPC-KRWDZBQOSA-N 2 0 323.267 4.563 20 0 DJADRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)c1cc(Cl)sc1Cl ZINC000453395280 334265098 /nfs/dbraw/zinc/26/50/98/334265098.db2.gz HNWJVLRSWYBGEW-JTQLQIEISA-N 2 0 321.317 4.580 20 0 DJADRP Cc1ccc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCCCC2)cc1 ZINC000531946098 334301286 /nfs/dbraw/zinc/30/12/86/334301286.db2.gz IQFBTICUGPEASC-IBGZPJMESA-N 2 0 322.496 4.832 20 0 DJADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)c1cccs1 ZINC000532457365 336248307 /nfs/dbraw/zinc/24/83/07/336248307.db2.gz KCSXXXVLUSFNSH-MRXNPFEDSA-N 2 0 314.498 4.585 20 0 DJADRP Cc1c2ccccc2oc1[C@H](C)[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000423507680 337723599 /nfs/dbraw/zinc/72/35/99/337723599.db2.gz QBNZACIVYQFCAS-QFBILLFUSA-N 2 0 322.452 4.872 20 0 DJADRP CC(C)[C@H]1C[C@H]([NH2+]Cc2cccc(C[NH+](C)C)c2)c2ccccc21 ZINC000447532892 338554734 /nfs/dbraw/zinc/55/47/34/338554734.db2.gz XXQOKLHCTJBSEK-YADHBBJMSA-N 2 0 322.496 4.722 20 0 DJADRP Cc1cc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cs1 ZINC000453093418 338792998 /nfs/dbraw/zinc/79/29/98/338792998.db2.gz RFXYRNTUHYDZDD-INIZCTEOSA-N 2 0 314.498 4.503 20 0 DJADRP CC[NH+](CC)C[C@H]1CC[N@@H+]([C@H](C)c2ccc3ccccc3c2)C1 ZINC000464772632 339152349 /nfs/dbraw/zinc/15/23/49/339152349.db2.gz FIPPBAAYNAQBKK-QZTJIDSGSA-N 2 0 310.485 4.565 20 0 DJADRP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3)cc2)C1 ZINC000464782556 339153552 /nfs/dbraw/zinc/15/35/52/339153552.db2.gz XXLGGWHBLOQPIH-FQEVSTJZSA-N 2 0 322.496 4.517 20 0 DJADRP CCCC[C@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1ccccc1 ZINC000467842102 339247414 /nfs/dbraw/zinc/24/74/14/339247414.db2.gz PRNKVBAKOXJTLI-NRFANRHFSA-N 2 0 310.485 4.769 20 0 DJADRP C[C@H]([NH2+]CCCCC[NH+]1CCCCC1)c1csc(Cl)c1 ZINC000469307606 339285785 /nfs/dbraw/zinc/28/57/85/339285785.db2.gz WYJLPOQIWWCAGE-AWEZNQCLSA-N 2 0 314.926 4.708 20 0 DJADRP CC(C)c1nc([C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cs1 ZINC000469776058 339298927 /nfs/dbraw/zinc/29/89/27/339298927.db2.gz PGEAJVLPPZGQKK-CVEARBPZSA-N 2 0 323.550 4.572 20 0 DJADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H]1CCc2c1cccc2C ZINC000480445111 339573164 /nfs/dbraw/zinc/57/31/64/339573164.db2.gz YTWIRMSYKBXSLT-QFIPXVFZSA-N 2 0 322.496 4.614 20 0 DJADRP C[C@H]([NH2+]CCCC[NH+](C)C)c1ccc(-c2ccccc2F)s1 ZINC000481960812 339618089 /nfs/dbraw/zinc/61/80/89/339618089.db2.gz MUHIPOXYVBWPEH-AWEZNQCLSA-N 2 0 320.477 4.547 20 0 DJADRP C[C@@H](c1ccc2ccccc2c1)[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000302949542 340289045 /nfs/dbraw/zinc/28/90/45/340289045.db2.gz CRIAILXTWKGSSS-SFHVURJKSA-N 2 0 322.496 4.709 20 0 DJADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2ccc3occc3c2)cc1 ZINC000510231408 340293331 /nfs/dbraw/zinc/29/33/31/340293331.db2.gz VSVJONGHYYEQRK-UHFFFAOYSA-N 2 0 322.452 4.564 20 0 DJADRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1cccc(Cl)c1 ZINC000512314125 340356578 /nfs/dbraw/zinc/35/65/78/340356578.db2.gz MKNUNNKMWLOWTQ-ZOBUZTSGSA-N 2 0 320.908 4.644 20 0 DJADRP Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c(C)c1 ZINC000512330470 340357363 /nfs/dbraw/zinc/35/73/63/340357363.db2.gz DSBFOJPYXDMQFU-GBESFXJTSA-N 2 0 314.517 4.607 20 0 DJADRP Cc1cc(C)cc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000512331824 340357421 /nfs/dbraw/zinc/35/74/21/340357421.db2.gz LCGFSGDNTVDRAV-FHWLQOOXSA-N 2 0 314.517 4.607 20 0 DJADRP CC[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc(F)cc1 ZINC000513058141 340391289 /nfs/dbraw/zinc/39/12/89/340391289.db2.gz OMUAVJKORUYNER-FQEVSTJZSA-N 2 0 318.480 4.664 20 0 DJADRP Cc1cccc(C[NH2+]Cc2ccccc2C[NH+]2CCCCC2)c1C ZINC000517542024 340471578 /nfs/dbraw/zinc/47/15/78/340471578.db2.gz HFWBTOXALVQMNX-UHFFFAOYSA-N 2 0 322.496 4.579 20 0 DJADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H]2C[C@@H](C)c3ccccc32)cc1 ZINC000326557378 340715506 /nfs/dbraw/zinc/71/55/06/340715506.db2.gz QLMHCOINMHOTOW-VGSWGCGISA-N 2 0 322.496 4.867 20 0 DJADRP CC(C)C[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cccs1 ZINC000123677279 340793449 /nfs/dbraw/zinc/79/34/49/340793449.db2.gz URJHYHLCHLCKMV-GOSISDBHSA-N 2 0 316.514 4.687 20 0 DJADRP CC(C)[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccccc1 ZINC000539163892 340875307 /nfs/dbraw/zinc/87/53/07/340875307.db2.gz KENUOCMFJKXZRE-JOCHJYFZSA-N 2 0 322.496 4.769 20 0 DJADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)c1ccccc1 ZINC000078730490 341246927 /nfs/dbraw/zinc/24/69/27/341246927.db2.gz BKJIYFRXHDWWMA-GOSISDBHSA-N 2 0 308.469 4.523 20 0 DJADRP CC(C)[NH+]1CCC([NH2+][C@@H](C)c2ccc(F)c3ccccc32)CC1 ZINC000551063725 341330699 /nfs/dbraw/zinc/33/06/99/341330699.db2.gz ZMZFRSGZYKUJLX-HNNXBMFYSA-N 2 0 314.448 4.502 20 0 DJADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2ccccc2C)cc1 ZINC000390311748 333265323 /nfs/dbraw/zinc/26/53/23/333265323.db2.gz NPRBNUNUGGPSCB-SFHVURJKSA-N 2 0 310.485 4.688 20 0 DJADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2ccccc2C)cc1 ZINC000390311745 333265409 /nfs/dbraw/zinc/26/54/09/333265409.db2.gz NPRBNUNUGGPSCB-GOSISDBHSA-N 2 0 310.485 4.688 20 0 DJADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2cc(C)oc2C)cc1 ZINC000319983685 333420363 /nfs/dbraw/zinc/42/03/63/333420363.db2.gz KWKKHCICEIQHDT-INIZCTEOSA-N 2 0 314.473 4.589 20 0 DJADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCCC2)c1)c1cccs1 ZINC000411538025 333690270 /nfs/dbraw/zinc/69/02/70/333690270.db2.gz SUIHUPZZOPSJGX-MRXNPFEDSA-N 2 0 314.498 4.585 20 0 DJADRP CCSc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)cc1 ZINC000534495574 334277444 /nfs/dbraw/zinc/27/74/44/334277444.db2.gz DOKAUZGAIKCUGF-IAGOWNOFSA-N 2 0 320.546 4.570 20 0 DJADRP CC(C)C[C@@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1ccccc1 ZINC000531944547 334300144 /nfs/dbraw/zinc/30/01/44/334300144.db2.gz YQPRIXBPCWTONU-OAQYLSRUSA-N 2 0 310.485 4.625 20 0 DJADRP C[NH+](C)Cc1ccc(C[NH2+][C@H](CC2CCC2)c2ccccc2)cc1 ZINC000344095363 335217573 /nfs/dbraw/zinc/21/75/73/335217573.db2.gz FYZBIOZZWPUOMW-JOCHJYFZSA-N 2 0 322.496 4.769 20 0 DJADRP CC[C@@H]([NH2+][C@H](C)CCC[NH+](CC)CC)c1cc(F)ccc1F ZINC000479776562 335762961 /nfs/dbraw/zinc/76/29/61/335762961.db2.gz UHQPWJGTHVGPEC-RDTXWAMCSA-N 2 0 312.448 4.516 20 0 DJADRP CC[C@@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1ccc(Cl)s1 ZINC000114505332 335803057 /nfs/dbraw/zinc/80/30/57/335803057.db2.gz SYNRDOQGGHKSSB-OAHLLOKOSA-N 2 0 322.905 4.704 20 0 DJADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H]2CCc3ccc(C)cc32)cc1 ZINC000325224059 336281693 /nfs/dbraw/zinc/28/16/93/336281693.db2.gz ALSSUZVXYRDZGX-QFIPXVFZSA-N 2 0 322.496 4.614 20 0 DJADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c2ccccc21 ZINC000563999530 336394964 /nfs/dbraw/zinc/39/49/64/336394964.db2.gz YAGITCSEBWTXDR-VGOFRKELSA-N 2 0 320.480 4.621 20 0 DJADRP CCSc1ccccc1[C@@H](C)[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000423291750 337710079 /nfs/dbraw/zinc/71/00/79/337710079.db2.gz JSANGQDRCADRRR-HUUCEWRRSA-N 2 0 314.498 4.669 20 0 DJADRP CCSc1ccccc1[C@H](C)[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000423291748 337710101 /nfs/dbraw/zinc/71/01/01/337710101.db2.gz JSANGQDRCADRRR-CABCVRRESA-N 2 0 314.498 4.669 20 0 DJADRP C[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1cccc2ccccc21 ZINC000423497373 337722989 /nfs/dbraw/zinc/72/29/89/337722989.db2.gz GVPFNVICJDTMPR-HTAPYJJXSA-N 2 0 318.464 4.971 20 0 DJADRP CSc1ccccc1[C@H](C)[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000423501378 337723332 /nfs/dbraw/zinc/72/33/32/337723332.db2.gz CRSICWQCZFSENK-YJBOKZPZSA-N 2 0 314.498 4.539 20 0 DJADRP Cc1cc(C)c([C@@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1C ZINC000423509449 337723824 /nfs/dbraw/zinc/72/38/24/337723824.db2.gz RKYITVDJNHPKQW-WIYYLYMNSA-N 2 0 310.485 4.743 20 0 DJADRP CCC[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(Cl)cc1 ZINC000516557670 338015417 /nfs/dbraw/zinc/01/54/17/338015417.db2.gz ZNVJCNFWYARWEN-DAWZGUTISA-N 2 0 308.897 4.644 20 0 DJADRP CC[C@H]([NH2+][C@H]1CCN(C)[C@H](C)C1)c1ccc(Cl)c(Cl)c1 ZINC000156560609 338369122 /nfs/dbraw/zinc/36/91/22/338369122.db2.gz QJUPDJAKQIYVKT-FFSVYQOJSA-N 2 0 315.288 4.517 20 0 DJADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2cc(C)oc2C)c1 ZINC000447528959 338554281 /nfs/dbraw/zinc/55/42/81/338554281.db2.gz KEAQWJSJRGRGKO-INIZCTEOSA-N 2 0 314.473 4.589 20 0 DJADRP CC(C)[C@@H]1C[C@@H]([NH2+]Cc2cccc(C[NH+](C)C)c2)c2ccccc21 ZINC000447532889 338554791 /nfs/dbraw/zinc/55/47/91/338554791.db2.gz XXQOKLHCTJBSEK-FCHUYYIVSA-N 2 0 322.496 4.722 20 0 DJADRP C[C@@H]1CC[C@H]([NH2+]Cc2ccc(C[NH+](C)C)cc2)c2sccc21 ZINC000453080439 338791244 /nfs/dbraw/zinc/79/12/44/338791244.db2.gz JQRMDCPAUIBWJE-KDOFPFPSSA-N 2 0 314.498 4.538 20 0 DJADRP CC[C@@H]1CCC[C@H]([NH2+]CC2CC[NH+](Cc3cccs3)CC2)C1 ZINC000462764823 339087439 /nfs/dbraw/zinc/08/74/39/339087439.db2.gz HDBWPXXQYVETML-AEFFLSMTSA-N 2 0 320.546 4.519 20 0 DJADRP Cc1cc(C)cc(-c2ccc(C[NH2+][C@@H]3CC[N@H+](C)[C@H](C)C3)cc2)c1 ZINC000462763754 339087515 /nfs/dbraw/zinc/08/75/15/339087515.db2.gz PESUWWLKUAMYTG-XMSQKQJNSA-N 2 0 322.496 4.543 20 0 DJADRP CCCC[C@@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1ccccc1 ZINC000467842103 339247349 /nfs/dbraw/zinc/24/73/49/339247349.db2.gz PRNKVBAKOXJTLI-OAQYLSRUSA-N 2 0 310.485 4.769 20 0 DJADRP C[C@H](c1ccc2ccccc2c1)[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000470961606 339333034 /nfs/dbraw/zinc/33/30/34/339333034.db2.gz TYKRYCVWFDGPOB-IEBWSBKVSA-N 2 0 322.496 4.565 20 0 DJADRP C[C@@H](c1ccc2ccccc2c1)[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000470961608 339333163 /nfs/dbraw/zinc/33/31/63/339333163.db2.gz TYKRYCVWFDGPOB-PKOBYXMFSA-N 2 0 322.496 4.565 20 0 DJADRP C[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)[C@@H](C)c1ccc(Cl)cc1 ZINC000474594234 339419173 /nfs/dbraw/zinc/41/91/73/339419173.db2.gz DUSSUHYLGLFNLA-CABCVRRESA-N 2 0 322.924 4.685 20 0 DJADRP CC[C@H]([NH2+][C@@H](C)CCC[NH+](CC)CC)c1ccc(F)cc1F ZINC000479741088 339547505 /nfs/dbraw/zinc/54/75/05/339547505.db2.gz GSTLOQVXUJLOLH-KSSFIOAISA-N 2 0 312.448 4.516 20 0 DJADRP Cc1ccc([C@@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)c(C)c1 ZINC000480277907 339566933 /nfs/dbraw/zinc/56/69/33/339566933.db2.gz YODZGNFFWWFZGW-LJQANCHMSA-N 2 0 322.496 4.750 20 0 DJADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2cccc(F)c2)c1 ZINC000481314921 339600896 /nfs/dbraw/zinc/60/08/96/339600896.db2.gz LTLQXYNWCMMUFX-MRXNPFEDSA-N 2 0 314.448 4.518 20 0 DJADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2ccccc2F)c1 ZINC000495545858 339987065 /nfs/dbraw/zinc/98/70/65/339987065.db2.gz GFHAMQJCVCQWIN-INIZCTEOSA-N 2 0 314.448 4.518 20 0 DJADRP CC[N@H+](CCCCn1ccnc1C)Cc1ccc2ccccc2c1 ZINC000502708898 340111716 /nfs/dbraw/zinc/11/17/16/340111716.db2.gz ZNFLEBQMCJNFTF-UHFFFAOYSA-N 2 0 321.468 4.647 20 0 DJADRP CCc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000512314233 340356610 /nfs/dbraw/zinc/35/66/10/340356610.db2.gz NPPUMGSCUIHVEI-QKLQHJQFSA-N 2 0 314.517 4.553 20 0 DJADRP Cc1cc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c(C)s1 ZINC000512317714 340356690 /nfs/dbraw/zinc/35/66/90/340356690.db2.gz FRPDMRJUWRIXGV-HLLBOEOZSA-N 2 0 320.546 4.669 20 0 DJADRP Cc1cc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c(C)s1 ZINC000512317717 340356768 /nfs/dbraw/zinc/35/67/68/340356768.db2.gz FRPDMRJUWRIXGV-ZOBUZTSGSA-N 2 0 320.546 4.669 20 0 DJADRP C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512330382 340357368 /nfs/dbraw/zinc/35/73/68/340357368.db2.gz UDWYBDBWVKTXIC-UXLLHSPISA-N 2 0 320.908 4.644 20 0 DJADRP Cc1cc(C)cc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000512331826 340357387 /nfs/dbraw/zinc/35/73/87/340357387.db2.gz LCGFSGDNTVDRAV-QYZOEREBSA-N 2 0 314.517 4.607 20 0 DJADRP Cc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c(C)c1 ZINC000512330471 340357497 /nfs/dbraw/zinc/35/74/97/340357497.db2.gz DSBFOJPYXDMQFU-QYZOEREBSA-N 2 0 314.517 4.607 20 0 DJADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H](C)c1cccc(F)c1 ZINC000173915349 340377684 /nfs/dbraw/zinc/37/76/84/340377684.db2.gz JMYZCQORIQESQV-MRXNPFEDSA-N 2 0 314.448 4.517 20 0 DJADRP C/C(=C/c1ccc(Cl)cc1)C[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000512999574 340387714 /nfs/dbraw/zinc/38/77/14/340387714.db2.gz SUUYCGUHZXFHQP-SQFISAMPSA-N 2 0 320.908 4.596 20 0 DJADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2c(C)cc(C)cc2C)c1 ZINC000513104785 340393485 /nfs/dbraw/zinc/39/34/85/340393485.db2.gz NBVQBRSXCBIDBH-UHFFFAOYSA-N 2 0 324.512 4.743 20 0 DJADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1ccc(F)cc1Cl ZINC000037200907 340772737 /nfs/dbraw/zinc/77/27/37/340772737.db2.gz IFMBVJCNSKOGPD-KBPBESRZSA-N 2 0 314.876 4.640 20 0 DJADRP CCCC[NH+]1CCC(N[C@@H]2C[C@H](C)Sc3sccc32)CC1 ZINC000130471908 341022543 /nfs/dbraw/zinc/02/25/43/341022543.db2.gz MGMQFZUOIBWGHM-XJKSGUPXSA-N 2 0 324.559 4.528 20 0 DJADRP CC(C)(C)[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1cc2ccccc2o1 ZINC000577492554 341912528 /nfs/dbraw/zinc/91/25/28/341912528.db2.gz DSNDEWCUYZQMRE-HXUWFJFHSA-N 2 0 322.452 4.769 20 0 DJADRP CC(C)C[C@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1cccs1 ZINC000171132290 332859729 /nfs/dbraw/zinc/85/97/29/332859729.db2.gz ANZCCYJRYZIFII-SFHVURJKSA-N 2 0 316.514 4.687 20 0 DJADRP CC1=CC[C@@H]([NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)CC1 ZINC000559906788 332291434 /nfs/dbraw/zinc/29/14/34/332291434.db2.gz CHXKXRFVCCWJKO-HXUWFJFHSA-N 2 0 324.468 4.500 20 0 DJADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1ccc(-c2ccccc2)o1 ZINC000518748338 332330139 /nfs/dbraw/zinc/33/01/39/332330139.db2.gz MHYXTROSBVZHBT-KRWDZBQOSA-N 2 0 314.473 4.547 20 0 DJADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2cccc(F)c2)cc1 ZINC000320726285 335132734 /nfs/dbraw/zinc/13/27/34/335132734.db2.gz WRDRRABCWORESA-MRXNPFEDSA-N 2 0 314.448 4.518 20 0 DJADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1ccc(Cl)c(Cl)c1 ZINC000021051121 333413489 /nfs/dbraw/zinc/41/34/89/333413489.db2.gz PDAZIDMDTINTGI-ZDUSSCGKSA-N 2 0 317.304 4.594 20 0 DJADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1ccccc1C ZINC000320350329 333518112 /nfs/dbraw/zinc/51/81/12/333518112.db2.gz PVEGMAMFWLMHPF-SFHVURJKSA-N 2 0 310.485 4.688 20 0 DJADRP CCC[C@@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1ccsc1 ZINC000187747126 334271067 /nfs/dbraw/zinc/27/10/67/334271067.db2.gz NUZYYFSGRCCXAP-GOSISDBHSA-N 2 0 306.519 4.586 20 0 DJADRP CC[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cccc(Cl)c1 ZINC000343939868 335203394 /nfs/dbraw/zinc/20/33/94/335203394.db2.gz HQNYCRUQOKHPJO-LJQANCHMSA-N 2 0 316.876 4.643 20 0 DJADRP C[NH+](C)Cc1cccc(C[NH2+][C@H](CC2CCC2)c2ccccc2)c1 ZINC000344144655 335221447 /nfs/dbraw/zinc/22/14/47/335221447.db2.gz VNLLWTHRQGMHAG-JOCHJYFZSA-N 2 0 322.496 4.769 20 0 DJADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1csc(Cl)c1 ZINC000191102221 335593265 /nfs/dbraw/zinc/59/32/65/335593265.db2.gz MEHZZGIAVYWDEX-CHWSQXEVSA-N 2 0 302.915 4.563 20 0 DJADRP CC[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccc(Cl)s1 ZINC000123713001 335804545 /nfs/dbraw/zinc/80/45/45/335804545.db2.gz ZEYBQAYIEIDFDY-OAHLLOKOSA-N 2 0 322.905 4.704 20 0 DJADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2)c1 ZINC000532482896 336251730 /nfs/dbraw/zinc/25/17/30/336251730.db2.gz FDYRZNKHWJGSRO-HNNXBMFYSA-N 2 0 316.876 4.643 20 0 DJADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCCc2ccccc21 ZINC000353050724 336391524 /nfs/dbraw/zinc/39/15/24/336391524.db2.gz VSTFMAWBUDTEFI-JOCHJYFZSA-N 2 0 322.496 4.694 20 0 DJADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c2ccccc21 ZINC000563999531 336394914 /nfs/dbraw/zinc/39/49/14/336394914.db2.gz YAGITCSEBWTXDR-VGSWGCGISA-N 2 0 320.480 4.621 20 0 DJADRP C[C@@H]([NH2+]CC(C)(C)N[C@@H](C)c1ccccc1)c1cccs1 ZINC000482948993 336399903 /nfs/dbraw/zinc/39/99/03/336399903.db2.gz NZMMGUGTKRSXCH-LSDHHAIUSA-N 2 0 302.487 4.528 20 0 DJADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](c2ccccc2)C2CCCC2)cc1 ZINC000423293595 337710447 /nfs/dbraw/zinc/71/04/47/337710447.db2.gz RTKALYAJVSLLBZ-IIBYNOLFSA-N 2 0 308.469 4.727 20 0 DJADRP CC[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1cccc(F)c1 ZINC000446933117 338541087 /nfs/dbraw/zinc/54/10/87/338541087.db2.gz YTGYWLZHMAFGFZ-HXUWFJFHSA-N 2 0 318.480 4.664 20 0 DJADRP Cc1cc(C)cc(-c2ccc(C[NH2+][C@H]3CC[N@H+](C)[C@@H](C)C3)cc2)c1 ZINC000462763748 339087382 /nfs/dbraw/zinc/08/73/82/339087382.db2.gz PESUWWLKUAMYTG-AVRDEDQJSA-N 2 0 322.496 4.543 20 0 DJADRP C[C@@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1ccc(C(C)(C)C)cc1 ZINC000467843445 339247520 /nfs/dbraw/zinc/24/75/20/339247520.db2.gz WJVRGFQUWDFZEX-MRXNPFEDSA-N 2 0 314.517 4.652 20 0 DJADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCCC1)c1csc(Cl)c1 ZINC000469307647 339285834 /nfs/dbraw/zinc/28/58/34/339285834.db2.gz WYJLPOQIWWCAGE-CQSZACIVSA-N 2 0 314.926 4.708 20 0 DJADRP CC[NH+](CC)CCC[C@H](C)[NH2+]C[C@H](C)c1cccc(Cl)c1 ZINC000470196585 339313784 /nfs/dbraw/zinc/31/37/84/339313784.db2.gz VSPRCDDJRDWFJO-HOTGVXAUSA-N 2 0 310.913 4.544 20 0 DJADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]C[C@@H](C)c1cccc(Cl)c1 ZINC000470196587 339313787 /nfs/dbraw/zinc/31/37/87/339313787.db2.gz VSPRCDDJRDWFJO-HZPDHXFCSA-N 2 0 310.913 4.544 20 0 DJADRP CCC[N@H+](C)C[C@H]1CC[NH+]([C@@H](C)c2ccc3ccccc3c2)C1 ZINC000471045993 339335647 /nfs/dbraw/zinc/33/56/47/339335647.db2.gz ALFZLVNVHAZXDF-ZWKOTPCHSA-N 2 0 310.485 4.565 20 0 DJADRP CCC[N@H+](C)C[C@@H]1CC[NH+]([C@@H](C)c2ccc3ccccc3c2)C1 ZINC000471045992 339335679 /nfs/dbraw/zinc/33/56/79/339335679.db2.gz ALFZLVNVHAZXDF-ROUUACIJSA-N 2 0 310.485 4.565 20 0 DJADRP Cc1cc(C)cc([C@@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)c1 ZINC000480243022 339564934 /nfs/dbraw/zinc/56/49/34/339564934.db2.gz CPAAFMKLOIDYIS-LJQANCHMSA-N 2 0 322.496 4.750 20 0 DJADRP Cc1ccc([C@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)c(C)c1 ZINC000480277906 339566945 /nfs/dbraw/zinc/56/69/45/339566945.db2.gz YODZGNFFWWFZGW-IBGZPJMESA-N 2 0 322.496 4.750 20 0 DJADRP CCC[NH+]1CCC(C[NH2+][C@H](CC)c2ccc(Cl)s2)CC1 ZINC000482509787 339633944 /nfs/dbraw/zinc/63/39/44/339633944.db2.gz UJYPNVGASFWFAL-CQSZACIVSA-N 2 0 314.926 4.564 20 0 DJADRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCC[C@@H]3CCCF)CC2)CC1 ZINC000510696930 340307056 /nfs/dbraw/zinc/30/70/56/340307056.db2.gz SKMLMOICCUNKOA-YNIZLOQISA-N 2 0 324.528 4.538 20 0 DJADRP CC[C@H]([NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(F)cc1 ZINC000512326305 340357207 /nfs/dbraw/zinc/35/72/07/340357207.db2.gz ZWDJAEFRBOHJIB-SYNHAJSKSA-N 2 0 318.480 4.519 20 0 DJADRP CC[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(C)cc1 ZINC000512326903 340357214 /nfs/dbraw/zinc/35/72/14/340357214.db2.gz BDLGFNAGLURIRR-DSKINZAPSA-N 2 0 314.517 4.689 20 0 DJADRP Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c(C)c1 ZINC000512330469 340357382 /nfs/dbraw/zinc/35/73/82/340357382.db2.gz DSBFOJPYXDMQFU-FHWLQOOXSA-N 2 0 314.517 4.607 20 0 DJADRP Cc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1C ZINC000512330512 340357432 /nfs/dbraw/zinc/35/74/32/340357432.db2.gz FDKUFTHQBMXXSY-NSHGMRRFSA-N 2 0 314.517 4.607 20 0 DJADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2ccc(C(C)C)cc2)c1 ZINC000513105548 340393548 /nfs/dbraw/zinc/39/35/48/340393548.db2.gz YJBPYVDRJZVOKO-UHFFFAOYSA-N 2 0 324.512 4.942 20 0 DJADRP Cc1ccccc1C[NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1 ZINC000520951821 340477549 /nfs/dbraw/zinc/47/75/49/340477549.db2.gz NSFVBKGMDBSDFV-UHFFFAOYSA-N 2 0 322.496 4.517 20 0 DJADRP C[C@@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1cccc(C2CC2)c1 ZINC000550678725 341321201 /nfs/dbraw/zinc/32/12/01/341321201.db2.gz QGCVHXWNPUTFMD-MRXNPFEDSA-N 2 0 312.501 4.622 20 0 DJADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ccc2ccccc2c1 ZINC000551242598 341335346 /nfs/dbraw/zinc/33/53/46/341335346.db2.gz YSMUOVQYPRRQNO-SFHVURJKSA-N 2 0 310.485 4.584 20 0 DJADRP CC(C)Sc1ccc([C@@H](C)[NH2+]C2CCC([NH+](C)C)CC2)cc1 ZINC000577662790 341928066 /nfs/dbraw/zinc/92/80/66/341928066.db2.gz VQALINWHAVFLTO-FAEJEUNOSA-N 2 0 320.546 4.711 20 0 DJADRP C[C@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1cccc2ccccc21 ZINC000171126751 332854063 /nfs/dbraw/zinc/85/40/63/332854063.db2.gz KFYXTVTUZAGFKV-KRWDZBQOSA-N 2 0 318.464 4.752 20 0 DJADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]Cc2cccc(-c3ccccc3)c2)C1 ZINC000518274451 332004352 /nfs/dbraw/zinc/00/43/52/332004352.db2.gz GRBNDTYAWRHLDQ-FQEVSTJZSA-N 2 0 322.496 4.564 20 0 DJADRP Cc1ccccc1[C@H](C)[NH2+]Cc1ccccc1C[NH+]1CCCCC1 ZINC000409658594 332044288 /nfs/dbraw/zinc/04/42/88/332044288.db2.gz UNXWQZAWFMYKLA-IBGZPJMESA-N 2 0 322.496 4.832 20 0 DJADRP Cc1nccn1CCC[N@@H+](C)[C@@H](c1ccccc1Cl)C(C)C ZINC000536474803 332251128 /nfs/dbraw/zinc/25/11/28/332251128.db2.gz BHVTYPPYGSNUCF-GOSISDBHSA-N 2 0 319.880 4.564 20 0 DJADRP C[C@@H](c1cccc2ccccc21)[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000531101565 332261806 /nfs/dbraw/zinc/26/18/06/332261806.db2.gz MYNYDJJSNOQOGC-HKUYNNGSSA-N 2 0 322.496 4.565 20 0 DJADRP CC[C@@H]([NH2+]CCCCC[NH+]1CCCC1)c1ccc(Cl)s1 ZINC000559894600 332290918 /nfs/dbraw/zinc/29/09/18/332290918.db2.gz RWHODSZECCBJHV-CQSZACIVSA-N 2 0 314.926 4.708 20 0 DJADRP C[C@H]([NH2+]C1CCC([NH3+])CC1)c1ccc(Cl)c(Cl)c1Cl ZINC000051694225 332657635 /nfs/dbraw/zinc/65/76/35/332657635.db2.gz ISWFIXYRGYUIPX-IDKOKCKLSA-N 2 0 321.679 4.567 20 0 DJADRP CC[C@@H]([NH2+]Cc1ccc(C[NH+](CC)CC)cc1)c1cccs1 ZINC000314126052 333087922 /nfs/dbraw/zinc/08/79/22/333087922.db2.gz PZKZCJXDYNDOFQ-GOSISDBHSA-N 2 0 316.514 4.831 20 0 DJADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1cc2ccccc2o1 ZINC000314253613 333096410 /nfs/dbraw/zinc/09/64/10/333096410.db2.gz XTQHHBUCRUJCGO-JKSUJKDBSA-N 2 0 302.462 4.594 20 0 DJADRP C[C@@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccccc1F ZINC000537938944 333337673 /nfs/dbraw/zinc/33/76/73/333337673.db2.gz XQQZBDKCWCHNOZ-WWDZGPRUSA-N 2 0 318.480 4.519 20 0 DJADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2ccc(Cl)s2)cc1 ZINC000020559191 333373018 /nfs/dbraw/zinc/37/30/18/333373018.db2.gz QMYSMMJVWMJMND-UHFFFAOYSA-N 2 0 322.905 4.533 20 0 DJADRP CC[C@@H]([NH2+]C1CC[NH+](CC(C)C)CC1)c1ccc(Cl)cc1 ZINC000221933969 333380879 /nfs/dbraw/zinc/38/08/79/333380879.db2.gz XQOOROCKGCRANK-GOSISDBHSA-N 2 0 308.897 4.501 20 0 DJADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2)cc1 ZINC000320081273 333423874 /nfs/dbraw/zinc/42/38/74/333423874.db2.gz WATVWTLHNRBZQK-INIZCTEOSA-N 2 0 314.448 4.518 20 0 DJADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](c2ccccc2)C2CC2)cc1 ZINC000391965557 335140734 /nfs/dbraw/zinc/14/07/34/335140734.db2.gz FQSYLRBLLSBHAY-JOCHJYFZSA-N 2 0 322.496 4.769 20 0 DJADRP [NH3+]CCC[C@@H]([NH2+]Cc1ccc(Cl)cc1Cl)c1ccccc1 ZINC000415046570 334261198 /nfs/dbraw/zinc/26/11/98/334261198.db2.gz CTQNAMSWCJBCSK-QGZVFWFLSA-N 2 0 323.267 4.563 20 0 DJADRP C[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cc2ccccc2s1 ZINC000187729135 334270065 /nfs/dbraw/zinc/27/00/65/334270065.db2.gz NBBRRXRVDYEGCN-HNNXBMFYSA-N 2 0 324.493 4.814 20 0 DJADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](c1ccccc1)C1CC1 ZINC000324650703 336239849 /nfs/dbraw/zinc/23/98/49/336239849.db2.gz BHOZBNGLFWMOIT-JOCHJYFZSA-N 2 0 322.496 4.769 20 0 DJADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H]2CCc3ccc(C)cc32)cc1 ZINC000325224056 336281669 /nfs/dbraw/zinc/28/16/69/336281669.db2.gz ALSSUZVXYRDZGX-JOCHJYFZSA-N 2 0 322.496 4.614 20 0 DJADRP CC(C)c1ccc([C@@H]([NH2+][C@@H](C)CCC[NH3+])c2cccs2)cc1 ZINC000422786926 337686516 /nfs/dbraw/zinc/68/65/16/337686516.db2.gz PHPJYBUFWAQCMQ-HNAYVOBHSA-N 2 0 316.514 4.678 20 0 DJADRP CCc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000423290478 337709884 /nfs/dbraw/zinc/70/98/84/337709884.db2.gz DDHOICKVRQDUJK-HUUCEWRRSA-N 2 0 322.452 4.866 20 0 DJADRP CCSc1ccc([C@@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000423291507 337710126 /nfs/dbraw/zinc/71/01/26/337710126.db2.gz IQOVCEMFDRBZEH-LSDHHAIUSA-N 2 0 314.498 4.669 20 0 DJADRP C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1cc(Cl)ccc1Cl ZINC000423291812 337710237 /nfs/dbraw/zinc/71/02/37/337710237.db2.gz JYMPYMCCEZVWAS-NWDGAFQWSA-N 2 0 323.267 4.864 20 0 DJADRP C[C@@H]1CC[C@@H]([NH2+][C@@H](CCC[NH3+])c2ccccc2)c2sccc21 ZINC000423506374 337723605 /nfs/dbraw/zinc/72/36/05/337723605.db2.gz INVGJNAPGBHTES-FHLIZLRMSA-N 2 0 314.498 4.756 20 0 DJADRP C[C@@H]1CC[C@H]([NH2+][C@@H](CCC[NH3+])c2ccccc2)c2sccc21 ZINC000423506375 337723760 /nfs/dbraw/zinc/72/37/60/337723760.db2.gz INVGJNAPGBHTES-JLSDUUJJSA-N 2 0 314.498 4.756 20 0 DJADRP Cc1cccc2c1[C@H](C)C[C@H]2[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000423508496 337723927 /nfs/dbraw/zinc/72/39/27/337723927.db2.gz QWPPMOKMTAXILU-LSTHTHJFSA-N 2 0 308.469 4.613 20 0 DJADRP c1cc2c(s1)CCC[C@@H]2[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000468030381 339251744 /nfs/dbraw/zinc/25/17/44/339251744.db2.gz POBDVXPQCNXVRC-SFHVURJKSA-N 2 0 318.530 4.512 20 0 DJADRP CC(C)c1nc([C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cs1 ZINC000469776065 339298860 /nfs/dbraw/zinc/29/88/60/339298860.db2.gz PGEAJVLPPZGQKK-HZPDHXFCSA-N 2 0 323.550 4.572 20 0 DJADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]C[C@H](C)c1cccc(Cl)c1 ZINC000470196588 339313710 /nfs/dbraw/zinc/31/37/10/339313710.db2.gz VSPRCDDJRDWFJO-JKSUJKDBSA-N 2 0 310.913 4.544 20 0 DJADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cccc(C(F)F)c2)CC1 ZINC000470721118 339326087 /nfs/dbraw/zinc/32/60/87/339326087.db2.gz BCRVVNDFLCZCOF-UHFFFAOYSA-N 2 0 324.459 4.568 20 0 DJADRP CCc1ccc([C@H](CC)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1 ZINC000480164444 339561368 /nfs/dbraw/zinc/56/13/68/339561368.db2.gz LVMXTUXWNHEVME-NRFANRHFSA-N 2 0 310.485 4.552 20 0 DJADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H]2CCc3ccc(C)cc32)c1 ZINC000481325078 339601333 /nfs/dbraw/zinc/60/13/33/339601333.db2.gz SMWVARKUEXHJIU-QFIPXVFZSA-N 2 0 322.496 4.614 20 0 DJADRP CC(C)CC[C@@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499162415 340031461 /nfs/dbraw/zinc/03/14/61/340031461.db2.gz AZZMYELGXVWFAC-AYWYSENESA-N 2 0 314.517 4.596 20 0 DJADRP C[C@H](c1ccc2ccccc2c1)[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000302949541 340288939 /nfs/dbraw/zinc/28/89/39/340288939.db2.gz CRIAILXTWKGSSS-GOSISDBHSA-N 2 0 322.496 4.709 20 0 DJADRP CCc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000512314234 340356555 /nfs/dbraw/zinc/35/65/55/340356555.db2.gz NPPUMGSCUIHVEI-SQGPQFPESA-N 2 0 314.517 4.553 20 0 DJADRP Cc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c(C)c1 ZINC000512330468 340357439 /nfs/dbraw/zinc/35/74/39/340357439.db2.gz DSBFOJPYXDMQFU-CEXWTWQISA-N 2 0 314.517 4.607 20 0 DJADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H]2C[C@H](C)c3ccccc32)cc1 ZINC000326557374 340715509 /nfs/dbraw/zinc/71/55/09/340715509.db2.gz QLMHCOINMHOTOW-HTAPYJJXSA-N 2 0 322.496 4.867 20 0 DJADRP CC(C)[C@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccccc1 ZINC000539164467 340875435 /nfs/dbraw/zinc/87/54/35/340875435.db2.gz RCPYCJUZNBARDP-QFIPXVFZSA-N 2 0 322.496 4.769 20 0 DJADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1ccccc1F ZINC000074335557 341144060 /nfs/dbraw/zinc/14/40/60/341144060.db2.gz ZXYIWFUKAJWGKW-INIZCTEOSA-N 2 0 314.448 4.518 20 0 DJADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ccc2ccccc2c1 ZINC000551242597 341335284 /nfs/dbraw/zinc/33/52/84/341335284.db2.gz YSMUOVQYPRRQNO-GOSISDBHSA-N 2 0 310.485 4.584 20 0 DJADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)c1ccco1 ZINC000247180543 341361839 /nfs/dbraw/zinc/36/18/39/341361839.db2.gz VDHDMTLHTUKJFT-IAGOWNOFSA-N 2 0 312.457 4.505 20 0 DJADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(C(C)(C)C)cc1 ZINC000552253572 341381611 /nfs/dbraw/zinc/38/16/11/341381611.db2.gz KAGXRRJHQVFSHW-MNNVXMFVSA-N 2 0 302.506 4.508 20 0 DJADRP CC(C)[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cc2ccccc2o1 ZINC000556871051 331744614 /nfs/dbraw/zinc/74/46/14/331744614.db2.gz IZMHEXBDLYEHEQ-LBXVMSDZSA-N 2 0 314.473 4.592 20 0 DJADRP Cc1cccc(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)c1C ZINC000518272198 332003923 /nfs/dbraw/zinc/00/39/23/332003923.db2.gz VQHBELOXKLCAPJ-UHFFFAOYSA-N 2 0 322.496 4.579 20 0 DJADRP C/C(=C\c1ccccc1)C[NH2+]Cc1ccccc1C[N@@H+](C)C(C)C ZINC000520949015 332119188 /nfs/dbraw/zinc/11/91/88/332119188.db2.gz OJTGGBRPAVDDRE-XMHGGMMESA-N 2 0 322.496 4.720 20 0 DJADRP Cc1nccn1CCC[N@@H+](C)[C@H](c1ccccc1Cl)C(C)C ZINC000536474813 332251108 /nfs/dbraw/zinc/25/11/08/332251108.db2.gz BHVTYPPYGSNUCF-SFHVURJKSA-N 2 0 319.880 4.564 20 0 DJADRP Cc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)cc1 ZINC000537971602 332251877 /nfs/dbraw/zinc/25/18/77/332251877.db2.gz YDJVLGIBBAJMRI-GOSISDBHSA-N 2 0 310.485 4.686 20 0 DJADRP Cc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)cc1 ZINC000537971603 332251887 /nfs/dbraw/zinc/25/18/87/332251887.db2.gz YDJVLGIBBAJMRI-SFHVURJKSA-N 2 0 310.485 4.686 20 0 DJADRP C[NH+](C)C1CCC([NH2+][C@@H](c2ccc(Cl)cc2)C2CCC2)CC1 ZINC000560527121 332351503 /nfs/dbraw/zinc/35/15/03/332351503.db2.gz ACOJQPOYWZFWRI-CTWPCTMYSA-N 2 0 320.908 4.644 20 0 DJADRP C[C@@H]([NH2+]C1CCC([NH3+])CC1)c1ccc(Cl)c(Cl)c1Cl ZINC000051694227 332657639 /nfs/dbraw/zinc/65/76/39/332657639.db2.gz ISWFIXYRGYUIPX-XNWIYYODSA-N 2 0 321.679 4.567 20 0 DJADRP Cc1ccc(C[NH2+]Cc2ccc(C[NH+]3CCC(C)CC3)cc2)cc1 ZINC000518765562 333029001 /nfs/dbraw/zinc/02/90/01/333029001.db2.gz MJTWVQRQAHIDGU-UHFFFAOYSA-N 2 0 322.496 4.517 20 0 DJADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2cccc(F)c2)cc1 ZINC000320726270 335132724 /nfs/dbraw/zinc/13/27/24/335132724.db2.gz WRDRRABCWORESA-INIZCTEOSA-N 2 0 314.448 4.518 20 0 DJADRP CC[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1cccc(C)c1 ZINC000514090700 333316203 /nfs/dbraw/zinc/31/62/03/333316203.db2.gz WFMJIFQGNOBRFJ-JOCHJYFZSA-N 2 0 322.496 4.832 20 0 DJADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2cccc(C)c2)cc1 ZINC000319801368 333407977 /nfs/dbraw/zinc/40/79/77/333407977.db2.gz HKYCYGUYCJETIK-GOSISDBHSA-N 2 0 310.485 4.688 20 0 DJADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](C)CCc2ccc(Cl)s2)cc1 ZINC000414812334 334106293 /nfs/dbraw/zinc/10/62/93/334106293.db2.gz KUXVSULFGKDVRQ-CHWSQXEVSA-N 2 0 322.905 4.532 20 0 DJADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)CCc2ccc(Cl)s2)cc1 ZINC000414812351 334106347 /nfs/dbraw/zinc/10/63/47/334106347.db2.gz KUXVSULFGKDVRQ-STQMWFEESA-N 2 0 322.905 4.532 20 0 DJADRP [NH3+]CCC[C@H]([NH2+]Cc1ccc(Cl)cc1Cl)c1ccccc1 ZINC000415046561 334261188 /nfs/dbraw/zinc/26/11/88/334261188.db2.gz CTQNAMSWCJBCSK-KRWDZBQOSA-N 2 0 323.267 4.563 20 0 DJADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1csc2ccccc12 ZINC000049943170 334359280 /nfs/dbraw/zinc/35/92/80/334359280.db2.gz ICRFBEVJGYTBGD-HNNXBMFYSA-N 2 0 304.503 4.501 20 0 DJADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)C(C)C)c1ccccc1 ZINC000353045317 336390436 /nfs/dbraw/zinc/39/04/36/336390436.db2.gz GWMZQTMVELYJLZ-OAQYLSRUSA-N 2 0 310.485 4.768 20 0 DJADRP CC1CC[NH+](CCC[C@H]([NH2+]C2CCC2)c2ccc(F)cc2)CC1 ZINC000361008604 336732673 /nfs/dbraw/zinc/73/26/73/336732673.db2.gz GHKXWUZAZMHSFS-FQEVSTJZSA-N 2 0 318.480 4.521 20 0 DJADRP C[NH+](CCCCC[N@@H+](C)Cc1cccs1)Cc1cccs1 ZINC000532919859 337305910 /nfs/dbraw/zinc/30/59/10/337305910.db2.gz YOPZOEKBPVXEMW-UHFFFAOYSA-N 2 0 322.543 4.544 20 0 DJADRP CC(C)CC[C@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1ccoc1 ZINC000423292405 337710352 /nfs/dbraw/zinc/71/03/52/337710352.db2.gz MWIPYJIOLNWCCM-KXBFYZLASA-N 2 0 300.446 4.566 20 0 DJADRP Cc1cc([C@@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cc(C)c1F ZINC000423507831 337723756 /nfs/dbraw/zinc/72/37/56/337723756.db2.gz QMSOMZDPWMFBCC-VQIMIIECSA-N 2 0 314.448 4.573 20 0 DJADRP C[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1cc2ccccc2o1 ZINC000423509994 337723977 /nfs/dbraw/zinc/72/39/77/337723977.db2.gz RUPCYKTUXMZLJA-MAUKXSAKSA-N 2 0 308.425 4.564 20 0 DJADRP CC[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1cccc(Cl)c1 ZINC000423510868 337723989 /nfs/dbraw/zinc/72/39/89/337723989.db2.gz SOLORLNQFBBAMN-RTBURBONSA-N 2 0 316.876 4.861 20 0 DJADRP C[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1cc2ccccc2o1 ZINC000423509981 337724026 /nfs/dbraw/zinc/72/40/26/337724026.db2.gz RUPCYKTUXMZLJA-CRAIPNDOSA-N 2 0 308.425 4.564 20 0 DJADRP CSc1ccc([C@@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423519046 337724328 /nfs/dbraw/zinc/72/43/28/337724328.db2.gz ZSWAXRZANCYEHT-BEFAXECRSA-N 2 0 314.498 4.539 20 0 DJADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2cc(C)oc2C)c1 ZINC000447528960 338554290 /nfs/dbraw/zinc/55/42/90/338554290.db2.gz KEAQWJSJRGRGKO-MRXNPFEDSA-N 2 0 314.473 4.589 20 0 DJADRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(C[NH+](C)C)cc2)c2sccc21 ZINC000453080445 338791383 /nfs/dbraw/zinc/79/13/83/338791383.db2.gz JQRMDCPAUIBWJE-RDTXWAMCSA-N 2 0 314.498 4.538 20 0 DJADRP CCCCC/C(=C/c1ccccc1)C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000462762171 339087416 /nfs/dbraw/zinc/08/74/16/339087416.db2.gz PLMVDXGRUKSOEM-PAUGXMEZSA-N 2 0 314.517 4.723 20 0 DJADRP CC[C@H]1CCC[C@@H]([NH2+]CC2CC[NH+](Cc3cccs3)CC2)C1 ZINC000462764833 339087458 /nfs/dbraw/zinc/08/74/58/339087458.db2.gz HDBWPXXQYVETML-FUHWJXTLSA-N 2 0 320.546 4.519 20 0 DJADRP CCC1CCC([NH2+]CC2CC[NH+](Cc3cccs3)CC2)CC1 ZINC000462770280 339087799 /nfs/dbraw/zinc/08/77/99/339087799.db2.gz XTAJYAMZDZZHFH-UHFFFAOYSA-N 2 0 320.546 4.519 20 0 DJADRP C[C@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1ccc(C(C)(C)C)cc1 ZINC000467843444 339247541 /nfs/dbraw/zinc/24/75/41/339247541.db2.gz WJVRGFQUWDFZEX-INIZCTEOSA-N 2 0 314.517 4.652 20 0 DJADRP Cc1ccc(C)c2c1CCC[C@H]2[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000472142248 339364176 /nfs/dbraw/zinc/36/41/76/339364176.db2.gz MMLYJYOVHQWNMB-OAQYLSRUSA-N 2 0 322.496 4.532 20 0 DJADRP CC[C@@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccc(Cl)s1 ZINC000480045015 339556493 /nfs/dbraw/zinc/55/64/93/339556493.db2.gz ZBKHVMCMPPYOPK-GFCCVEGCSA-N 2 0 314.926 4.751 20 0 DJADRP Cc1ccccc1[C@@H](C)[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000480050233 339556661 /nfs/dbraw/zinc/55/66/61/339556661.db2.gz UPIDFQQDQATWFA-LJQANCHMSA-N 2 0 322.496 4.832 20 0 DJADRP Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cc1C ZINC000480158452 339560954 /nfs/dbraw/zinc/56/09/54/339560954.db2.gz JJLNUPPHPGNVPY-LJQANCHMSA-N 2 0 322.496 4.750 20 0 DJADRP C[C@H]([NH2+]CCCCC[NH+]1CCCCC1)c1ccc(Cl)s1 ZINC000498488775 339724783 /nfs/dbraw/zinc/72/47/83/339724783.db2.gz VQXDDMJKIKUBSE-AWEZNQCLSA-N 2 0 314.926 4.708 20 0 DJADRP Cc1cccc2c1[C@@H](C)C[C@H]2[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000504900272 340155359 /nfs/dbraw/zinc/15/53/59/340155359.db2.gz UYYFFDYIXJAJTR-OXJNMPFZSA-N 2 0 312.501 4.540 20 0 DJADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H]1CCC[C@H]1CCCF ZINC000510732376 340308438 /nfs/dbraw/zinc/30/84/38/340308438.db2.gz HXIJVEHMPXVOBQ-PXNSSMCTSA-N 2 0 320.496 4.535 20 0 DJADRP CC[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1ccccc1 ZINC000303556515 340333482 /nfs/dbraw/zinc/33/34/82/340333482.db2.gz WJCOVHWZXJDMKS-QFIPXVFZSA-N 2 0 322.496 4.913 20 0 DJADRP CC[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(F)cc1 ZINC000512326306 340357299 /nfs/dbraw/zinc/35/72/99/340357299.db2.gz ZWDJAEFRBOHJIB-VPWXQRGCSA-N 2 0 318.480 4.519 20 0 DJADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H]1C[C@H](C)c2ccccc21 ZINC000326551610 340715267 /nfs/dbraw/zinc/71/52/67/340715267.db2.gz OJOGKYLFPVSOHF-JTSKRJEESA-N 2 0 322.496 4.867 20 0 DJADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1C[C@H](C)c2ccccc21 ZINC000326551607 340715389 /nfs/dbraw/zinc/71/53/89/340715389.db2.gz OJOGKYLFPVSOHF-HTAPYJJXSA-N 2 0 322.496 4.867 20 0 DJADRP CC[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccc(Cl)s1 ZINC000123712809 340793748 /nfs/dbraw/zinc/79/37/48/340793748.db2.gz ZEYBQAYIEIDFDY-HNNXBMFYSA-N 2 0 322.905 4.704 20 0 DJADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1ccccc1 ZINC000564258580 341019116 /nfs/dbraw/zinc/01/91/16/341019116.db2.gz WBOJJLIQXJCODM-LJQANCHMSA-N 2 0 322.496 4.769 20 0 DJADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1cccc(F)c1 ZINC000079122123 341253892 /nfs/dbraw/zinc/25/38/92/341253892.db2.gz RMYCVJDLAWFVTC-INIZCTEOSA-N 2 0 314.448 4.518 20 0 DJADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cc2cc(Cl)ccc2o1 ZINC000552062310 341366250 /nfs/dbraw/zinc/36/62/50/341366250.db2.gz TYFIIONPPIOJGP-UWTIGNOOSA-N 2 0 320.864 4.610 20 0 DJADRP CC(C)(C)[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1cc2ccccc2o1 ZINC000577492553 341912575 /nfs/dbraw/zinc/91/25/75/341912575.db2.gz DSNDEWCUYZQMRE-FQEVSTJZSA-N 2 0 322.452 4.769 20 0 DJADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1ccccc1 ZINC000560841813 332389696 /nfs/dbraw/zinc/38/96/96/332389696.db2.gz XRYMSVTXVPMEDV-SFHVURJKSA-N 2 0 308.469 4.523 20 0 DJADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2ccc(C)s2)cc1 ZINC000314038348 333083449 /nfs/dbraw/zinc/08/34/49/333083449.db2.gz DJPJNRZZJFPHFL-INIZCTEOSA-N 2 0 316.514 4.749 20 0 DJADRP Cc1cc(C)c([C@@H](C)[NH2+]C2CC[NH+](C(C)(C)C)CC2)cc1C ZINC000314520072 333136949 /nfs/dbraw/zinc/13/69/49/333136949.db2.gz YABZDEJFJTVRCV-QGZVFWFLSA-N 2 0 302.506 4.525 20 0 DJADRP C[C@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccccc1F ZINC000537938943 333337662 /nfs/dbraw/zinc/33/76/62/333337662.db2.gz XQQZBDKCWCHNOZ-AOCRQIFASA-N 2 0 318.480 4.519 20 0 DJADRP CC[C@@H]([NH2+]Cc1ccc(C[NH+](CC)CC)cc1)c1ccccc1 ZINC000320149610 333430275 /nfs/dbraw/zinc/43/02/75/333430275.db2.gz JBNIAFNFOVDHKU-OAQYLSRUSA-N 2 0 310.485 4.769 20 0 DJADRP CC[C@H]([NH2+]Cc1ccc(C[NH+](CC)CC)cc1)c1ccccc1 ZINC000320149606 333430324 /nfs/dbraw/zinc/43/03/24/333430324.db2.gz JBNIAFNFOVDHKU-NRFANRHFSA-N 2 0 310.485 4.769 20 0 DJADRP CCC[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccsc1 ZINC000443085915 338443908 /nfs/dbraw/zinc/44/39/08/338443908.db2.gz MKZCYDVGSUHNHM-IBGZPJMESA-N 2 0 320.546 4.976 20 0 DJADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCCc2ccccc21 ZINC000324173721 336102452 /nfs/dbraw/zinc/10/24/52/336102452.db2.gz OUPPBLLRHNLFDW-JOCHJYFZSA-N 2 0 322.496 4.696 20 0 DJADRP CC[C@H]([NH2+]Cc1cccc(C[N@H+](C)CC)c1)c1ccccc1F ZINC000352684574 336230284 /nfs/dbraw/zinc/23/02/84/336230284.db2.gz OWXPUPZBCDEMIE-FQEVSTJZSA-N 2 0 314.448 4.518 20 0 DJADRP C[C@H]1C[C@H]([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c2ccccc21 ZINC000563999529 336394975 /nfs/dbraw/zinc/39/49/75/336394975.db2.gz YAGITCSEBWTXDR-JTSKRJEESA-N 2 0 320.480 4.621 20 0 DJADRP C[C@H]([NH2+]C1CCC([NH3+])CC1)c1cc2c(ccc3ccccc23)o1 ZINC000423221466 337705437 /nfs/dbraw/zinc/70/54/37/337705437.db2.gz WUOHQUARSFXQHD-JEYLPNPQSA-N 2 0 308.425 4.507 20 0 DJADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)cc1 ZINC000423292595 337710322 /nfs/dbraw/zinc/71/03/22/337710322.db2.gz NKFRTJMGHGKZQG-RYUDHWBXSA-N 2 0 323.267 4.864 20 0 DJADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2ccc(Cl)c(Cl)c2)cc1 ZINC000423293443 337710574 /nfs/dbraw/zinc/71/05/74/337710574.db2.gz RIQDXCXBQNXROU-NEPJUHHUSA-N 2 0 323.267 4.864 20 0 DJADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](CC2CCC2)c2ccccc2)cc1 ZINC000423295400 337710721 /nfs/dbraw/zinc/71/07/21/337710721.db2.gz WXQAGCITQNTDIU-IIBYNOLFSA-N 2 0 308.469 4.727 20 0 DJADRP Cc1ccc([C@H]([NH2+]Cc2ccc3c(c2)C[NH2+]C3)C2CCCC2)cc1 ZINC000423396085 337718700 /nfs/dbraw/zinc/71/87/00/337718700.db2.gz SDMROVVVVNOKEC-JOCHJYFZSA-N 2 0 320.480 4.619 20 0 DJADRP C[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1cccc2ccccc21 ZINC000423497382 337722979 /nfs/dbraw/zinc/72/29/79/337722979.db2.gz GVPFNVICJDTMPR-VGSWGCGISA-N 2 0 318.464 4.971 20 0 DJADRP CC[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccc(Cl)s1 ZINC000423497067 337723003 /nfs/dbraw/zinc/72/30/03/337723003.db2.gz FYBOAYHTPWTPFK-LSDHHAIUSA-N 2 0 322.905 4.922 20 0 DJADRP C[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1cc2ccccc2o1 ZINC000423509995 337724012 /nfs/dbraw/zinc/72/40/12/337724012.db2.gz RUPCYKTUXMZLJA-QAPCUYQASA-N 2 0 308.425 4.564 20 0 DJADRP C[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccc(Cl)s1 ZINC000423514792 337724213 /nfs/dbraw/zinc/72/42/13/337724213.db2.gz WPPOGDIIBZBQGP-TZMCWYRMSA-N 2 0 308.878 4.532 20 0 DJADRP CC(C)[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(Cl)cc1 ZINC000447568622 338557557 /nfs/dbraw/zinc/55/75/57/338557557.db2.gz LEEBPCUETUNZKA-LJQANCHMSA-N 2 0 320.908 4.501 20 0 DJADRP CC(C)[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(Cl)cc1 ZINC000447568621 338557582 /nfs/dbraw/zinc/55/75/82/338557582.db2.gz LEEBPCUETUNZKA-IBGZPJMESA-N 2 0 320.908 4.501 20 0 DJADRP CCCCC/C(=C\c1ccccc1)C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000462762168 339087460 /nfs/dbraw/zinc/08/74/60/339087460.db2.gz PLMVDXGRUKSOEM-APIVKLOHSA-N 2 0 314.517 4.723 20 0 DJADRP Cc1cc(C)cc(-c2ccc(C[NH2+][C@H]3CC[N@H+](C)[C@H](C)C3)cc2)c1 ZINC000462763750 339087533 /nfs/dbraw/zinc/08/75/33/339087533.db2.gz PESUWWLKUAMYTG-GCJKJVERSA-N 2 0 322.496 4.543 20 0 DJADRP CCc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cc1 ZINC000480172340 339561879 /nfs/dbraw/zinc/56/18/79/339561879.db2.gz SQXBNDGHJBLWHQ-GOSISDBHSA-N 2 0 322.496 4.696 20 0 DJADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2sccc2C)c1 ZINC000481316173 339600866 /nfs/dbraw/zinc/60/08/66/339600866.db2.gz CSCWKXHJPSVMFB-INIZCTEOSA-N 2 0 316.514 4.749 20 0 DJADRP CCC[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccccc1 ZINC000483122377 339652660 /nfs/dbraw/zinc/65/26/60/339652660.db2.gz RLIKFMLFQODALJ-FQEVSTJZSA-N 2 0 314.448 4.518 20 0 DJADRP Cc1cc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+](C)C(C)C)oc1C ZINC000502686364 340110464 /nfs/dbraw/zinc/11/04/64/340110464.db2.gz LZOIDUGZCBVIKW-INIZCTEOSA-N 2 0 314.473 4.587 20 0 DJADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2cc(C)c(C)o2)cc1 ZINC000502686398 340110474 /nfs/dbraw/zinc/11/04/74/340110474.db2.gz JUDMYCBDPJBILG-MRXNPFEDSA-N 2 0 314.473 4.589 20 0 DJADRP CCCC[N@H+](C)CC1CC[NH+]([C@@H]2CCCc3ccccc32)CC1 ZINC000512266091 340354607 /nfs/dbraw/zinc/35/46/07/340354607.db2.gz CZUUBVFBVXAGFL-OAQYLSRUSA-N 2 0 314.517 4.508 20 0 DJADRP CCc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)s1 ZINC000512316179 340356560 /nfs/dbraw/zinc/35/65/60/340356560.db2.gz WZMUMKGOVFYJJM-JYJNAYRXSA-N 2 0 320.546 4.614 20 0 DJADRP Cc1cc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c(C)s1 ZINC000512317716 340356792 /nfs/dbraw/zinc/35/67/92/340356792.db2.gz FRPDMRJUWRIXGV-YQQAZPJKSA-N 2 0 320.546 4.669 20 0 DJADRP Cc1cc(C)cc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000512331823 340357410 /nfs/dbraw/zinc/35/74/10/340357410.db2.gz LCGFSGDNTVDRAV-CEXWTWQISA-N 2 0 314.517 4.607 20 0 DJADRP Cc1cccc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1C ZINC000512338582 340357963 /nfs/dbraw/zinc/35/79/63/340357963.db2.gz ZEYNKIRVFNFOFT-CEXWTWQISA-N 2 0 314.517 4.607 20 0 DJADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2cc(C)c(C)cc2C)c1 ZINC000513110387 340393649 /nfs/dbraw/zinc/39/36/49/340393649.db2.gz NXWCVEWWSOMPHA-UHFFFAOYSA-N 2 0 324.512 4.743 20 0 DJADRP CC(C)c1nc([C@H](C)[NH2+]CCCCC[NH+]2CCCCC2)cs1 ZINC000186336084 340511300 /nfs/dbraw/zinc/51/13/00/340511300.db2.gz VRFSFTKEEXFYAI-INIZCTEOSA-N 2 0 323.550 4.573 20 0 DJADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1ccccc1F ZINC000074335562 341144072 /nfs/dbraw/zinc/14/40/72/341144072.db2.gz ZXYIWFUKAJWGKW-MRXNPFEDSA-N 2 0 314.448 4.518 20 0 DJADRP CC[NH+]1CCC(C[NH2+][C@H](C)c2ccc(SC(C)C)cc2)CC1 ZINC000567815170 341634768 /nfs/dbraw/zinc/63/47/68/341634768.db2.gz UBVYHQNSRDKPNO-MRXNPFEDSA-N 2 0 320.546 4.570 20 0 DJADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCc2c1cccc2C ZINC000480445110 517638820 /nfs/dbraw/zinc/63/88/20/517638820.db2.gz YTWIRMSYKBXSLT-JOCHJYFZSA-N 2 0 322.496 4.614 20 0 DJADRP CC1=CC[C@H]([NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)CC1 ZINC000559906787 332291329 /nfs/dbraw/zinc/29/13/29/332291329.db2.gz CHXKXRFVCCWJKO-FQEVSTJZSA-N 2 0 324.468 4.500 20 0 DJADRP CCc1c2ccccc2oc1[C@H](C)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000560529854 332352243 /nfs/dbraw/zinc/35/22/43/332352243.db2.gz LNHBFYOPXOLPRK-FHERZECASA-N 2 0 314.473 4.519 20 0 DJADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1ccccc1 ZINC000560841812 332389578 /nfs/dbraw/zinc/38/95/78/332389578.db2.gz XRYMSVTXVPMEDV-GOSISDBHSA-N 2 0 308.469 4.523 20 0 DJADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2cccc(C)c2)c1 ZINC000525760997 333240692 /nfs/dbraw/zinc/24/06/92/333240692.db2.gz IWKIUSMHCDGBES-GOSISDBHSA-N 2 0 310.485 4.688 20 0 DJADRP CC[C@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1cccc(C)c1 ZINC000514090702 333316071 /nfs/dbraw/zinc/31/60/71/333316071.db2.gz WFMJIFQGNOBRFJ-QFIPXVFZSA-N 2 0 322.496 4.832 20 0 DJADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1ccc(SC)cc1 ZINC000021013131 333412137 /nfs/dbraw/zinc/41/21/37/333412137.db2.gz UHBYDIIHSVKFSE-CVEARBPZSA-N 2 0 308.535 4.570 20 0 DJADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1ccc(Cl)cc1Cl ZINC000021051866 333413421 /nfs/dbraw/zinc/41/34/21/333413421.db2.gz ZUOZXWOPKNIXJN-CYBMUJFWSA-N 2 0 317.304 4.594 20 0 DJADRP Cc1cc2cc([C@H](C)[NH2+]Cc3ccc4c[nH+]cn4c3)oc2cc1C ZINC000414162438 333915478 /nfs/dbraw/zinc/91/54/78/333915478.db2.gz DNLPAEHJKOPPTQ-HNNXBMFYSA-N 2 0 319.408 4.548 20 0 DJADRP [NH3+]CCC[C@H]([NH2+]Cc1cc(Cl)ccc1Cl)c1ccccc1 ZINC000415047139 334261393 /nfs/dbraw/zinc/26/13/93/334261393.db2.gz DVOQBWVJACMYLL-KRWDZBQOSA-N 2 0 323.267 4.563 20 0 DJADRP CC(C)(C)c1ccc(C[NH2+][C@H](CCC[NH3+])c2ccccc2)s1 ZINC000415058138 334262130 /nfs/dbraw/zinc/26/21/30/334262130.db2.gz SPYXMVVLSAGCEX-QGZVFWFLSA-N 2 0 316.514 4.615 20 0 DJADRP [NH3+]CCC[C@@H]([NH2+]Cc1cc(Cl)cc(Cl)c1)c1ccccc1 ZINC000415061862 334262329 /nfs/dbraw/zinc/26/23/29/334262329.db2.gz YXAACICFYUSWPC-QGZVFWFLSA-N 2 0 323.267 4.563 20 0 DJADRP Cc1cc2cc(C[NH2+][C@@H](CCC[NH3+])c3ccccc3)oc2cc1C ZINC000415062132 334262372 /nfs/dbraw/zinc/26/23/72/334262372.db2.gz ZTPKXMIXONUBRJ-FQEVSTJZSA-N 2 0 322.452 4.619 20 0 DJADRP CCC[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccsc1 ZINC000187721702 334269597 /nfs/dbraw/zinc/26/95/97/334269597.db2.gz ABLYAWFDPNEWFC-GOSISDBHSA-N 2 0 320.477 4.580 20 0 DJADRP Cc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)s1 ZINC000162898066 338469637 /nfs/dbraw/zinc/46/96/37/338469637.db2.gz PFTXMOMPRZAVMC-INIZCTEOSA-N 2 0 314.498 4.503 20 0 DJADRP CC[C@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1ccc(Cl)cc1 ZINC000532200075 335914868 /nfs/dbraw/zinc/91/48/68/335914868.db2.gz FQBFNESTNJLORV-IBGZPJMESA-N 2 0 316.876 4.643 20 0 DJADRP Cc1cc2cc([C@H](C)[NH2+]Cc3ccc([C@H](C)[NH3+])cc3)oc2cc1C ZINC000423292003 337710159 /nfs/dbraw/zinc/71/01/59/337710159.db2.gz KXKQXXLLTOPMAA-HOTGVXAUSA-N 2 0 322.452 4.920 20 0 DJADRP C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1cc(Cl)cc(Cl)c1 ZINC000423293203 337710451 /nfs/dbraw/zinc/71/04/51/337710451.db2.gz QGPNAMJMYZQCAX-NWDGAFQWSA-N 2 0 323.267 4.864 20 0 DJADRP CCC[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccc(Cl)cc1 ZINC000423359419 337714317 /nfs/dbraw/zinc/71/43/17/337714317.db2.gz PFCVRMNILQHUIT-IBGZPJMESA-N 2 0 314.860 4.574 20 0 DJADRP CSc1ccccc1[C@@H](C)[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000423501373 337723427 /nfs/dbraw/zinc/72/34/27/337723427.db2.gz CRSICWQCZFSENK-CRAIPNDOSA-N 2 0 314.498 4.539 20 0 DJADRP Cc1cc([C@@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc(C)c1F ZINC000423507827 337723583 /nfs/dbraw/zinc/72/35/83/337723583.db2.gz QMSOMZDPWMFBCC-APWZRJJASA-N 2 0 314.448 4.573 20 0 DJADRP Cc1c2ccccc2oc1[C@H](C)[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000423507679 337723612 /nfs/dbraw/zinc/72/36/12/337723612.db2.gz QBNZACIVYQFCAS-LPHOPBHVSA-N 2 0 322.452 4.872 20 0 DJADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](c2ccccc2)C2CC2)c1 ZINC000537013739 337865153 /nfs/dbraw/zinc/86/51/53/337865153.db2.gz PYNBMJBQGXLFOD-QFIPXVFZSA-N 2 0 322.496 4.769 20 0 DJADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+][C@@H]1CC[C@H](c2ccccc2)C1 ZINC000436271674 338264825 /nfs/dbraw/zinc/26/48/25/338264825.db2.gz RAQDQUOCKPKHMD-HLAWJBBLSA-N 2 0 314.517 4.567 20 0 DJADRP CC[NH+](CC)C[C@@H]1CC[N@@H+]([C@H](C)c2ccc3ccccc3c2)C1 ZINC000464772631 339152339 /nfs/dbraw/zinc/15/23/39/339152339.db2.gz FIPPBAAYNAQBKK-MSOLQXFVSA-N 2 0 310.485 4.565 20 0 DJADRP C[C@@H](CC[NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccccc1 ZINC000467417910 339237548 /nfs/dbraw/zinc/23/75/48/339237548.db2.gz MEHLONYNRWNDPJ-SFHVURJKSA-N 2 0 314.517 4.567 20 0 DJADRP C[C@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1csc(Cl)c1 ZINC000469094400 339280079 /nfs/dbraw/zinc/28/00/79/339280079.db2.gz WYAIHEAPLGOEKT-AWEZNQCLSA-N 2 0 314.926 4.564 20 0 DJADRP Cc1ccc(C)c2c1CCC[C@H]2[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000472129822 339363836 /nfs/dbraw/zinc/36/38/36/339363836.db2.gz GUOXKMWKADANGT-OAQYLSRUSA-N 2 0 322.496 4.532 20 0 DJADRP CC[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc(C)cc1 ZINC000480246891 339565162 /nfs/dbraw/zinc/56/51/62/339565162.db2.gz AAFYBMSFDAXYMQ-JOCHJYFZSA-N 2 0 322.496 4.832 20 0 DJADRP c1sc2ccccc2c1C[NH2+]CCCCC[NH+]1CCCCC1 ZINC000500893772 340069425 /nfs/dbraw/zinc/06/94/25/340069425.db2.gz RXCRWJKQIOZQKQ-UHFFFAOYSA-N 2 0 316.514 4.647 20 0 DJADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2cc(C)c(C)o2)cc1 ZINC000502686397 340110349 /nfs/dbraw/zinc/11/03/49/340110349.db2.gz JUDMYCBDPJBILG-INIZCTEOSA-N 2 0 314.473 4.589 20 0 DJADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H]2C[C@@H](C)c3c2cccc3C)c1 ZINC000504927541 340156501 /nfs/dbraw/zinc/15/65/01/340156501.db2.gz QLNCCOCZDJZQQB-DYESRHJHSA-N 2 0 322.496 4.785 20 0 DJADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)c1ccsc1 ZINC000509443484 340269672 /nfs/dbraw/zinc/26/96/72/340269672.db2.gz BGJBRKKDTIQBHU-MRXNPFEDSA-N 2 0 314.498 4.585 20 0 DJADRP CC[C@H]([NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(F)cc1 ZINC000512326304 340357317 /nfs/dbraw/zinc/35/73/17/340357317.db2.gz ZWDJAEFRBOHJIB-MDYRTPRTSA-N 2 0 318.480 4.519 20 0 DJADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(Cl)cc1 ZINC000512330383 340357489 /nfs/dbraw/zinc/35/74/89/340357489.db2.gz UDWYBDBWVKTXIC-YQQAZPJKSA-N 2 0 320.908 4.644 20 0 DJADRP Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1C ZINC000512330510 340357516 /nfs/dbraw/zinc/35/75/16/340357516.db2.gz FDKUFTHQBMXXSY-CMKODMSKSA-N 2 0 314.517 4.607 20 0 DJADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H](C)c1cccc(F)c1 ZINC000173915331 340377669 /nfs/dbraw/zinc/37/76/69/340377669.db2.gz JMYZCQORIQESQV-INIZCTEOSA-N 2 0 314.448 4.517 20 0 DJADRP C[C@H](CC(C)(C)c1ccccc1)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000237602826 340672566 /nfs/dbraw/zinc/67/25/66/340672566.db2.gz RQNLBPUALIMZPZ-QGZVFWFLSA-N 2 0 316.533 4.595 20 0 DJADRP CC[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000397558759 340713045 /nfs/dbraw/zinc/71/30/45/340713045.db2.gz RPVQOAYIHCHTMM-JOCHJYFZSA-N 2 0 322.496 4.640 20 0 DJADRP C[C@H]([NH2+]CCCC[NH+](C)C)c1cc2c(ccc3ccccc23)o1 ZINC000539498664 340887780 /nfs/dbraw/zinc/88/77/80/340887780.db2.gz NRUGQAMCCPQEJL-HNNXBMFYSA-N 2 0 310.441 4.578 20 0 DJADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1ccc(F)cc1 ZINC000072895518 341110154 /nfs/dbraw/zinc/11/01/54/341110154.db2.gz HERVJSFBWPBKSX-MRXNPFEDSA-N 2 0 314.448 4.518 20 0 DJADRP CC(C)[NH+]1CCC([NH2+][C@H](C)c2ccc(F)c3ccccc32)CC1 ZINC000551063726 341330717 /nfs/dbraw/zinc/33/07/17/341330717.db2.gz ZMZFRSGZYKUJLX-OAHLLOKOSA-N 2 0 314.448 4.502 20 0 DJADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)c1ccoc1 ZINC000247026168 341359988 /nfs/dbraw/zinc/35/99/88/341359988.db2.gz LYLCFKUCIPDWES-DLBZAZTESA-N 2 0 312.457 4.505 20 0 DJADRP CC[NH+]1CCC(C[NH2+][C@@H](C)c2ccc(SC(C)C)cc2)CC1 ZINC000567815169 341634855 /nfs/dbraw/zinc/63/48/55/341634855.db2.gz UBVYHQNSRDKPNO-INIZCTEOSA-N 2 0 320.546 4.570 20 0 DJADRP [NH3+]Cc1ccc(C[NH2+][C@H]2CCCc3c4ccccc4sc32)cc1 ZINC000575869322 341811846 /nfs/dbraw/zinc/81/18/46/341811846.db2.gz OWIBBBIRHAKKNW-SFHVURJKSA-N 2 0 322.477 4.527 20 0 DJADRP CC(C)Sc1ccc([C@H](C)[NH2+]C2CCC([NH+](C)C)CC2)cc1 ZINC000577662791 341928051 /nfs/dbraw/zinc/92/80/51/341928051.db2.gz VQALINWHAVFLTO-ZLPCBKJTSA-N 2 0 320.546 4.711 20 0 DJADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1ccccc1SC ZINC000442652678 334996446 /nfs/dbraw/zinc/99/64/46/334996446.db2.gz RIBYWGCCZNZKNZ-CVEARBPZSA-N 2 0 308.535 4.570 20 0 DJADRP CC(C)C[NH+]1CCC([NH2+]Cc2cccc(-c3ccccc3)c2)CC1 ZINC000518269709 332003468 /nfs/dbraw/zinc/00/34/68/332003468.db2.gz KZEUTYUUMVELQX-UHFFFAOYSA-N 2 0 322.496 4.564 20 0 DJADRP Cc1ccc(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)c(C)c1 ZINC000520954334 332253176 /nfs/dbraw/zinc/25/31/76/332253176.db2.gz UITBGGZIGDBKMP-UHFFFAOYSA-N 2 0 322.496 4.579 20 0 DJADRP C[C@@H](c1cccc2ccccc21)[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000531101570 332261891 /nfs/dbraw/zinc/26/18/91/332261891.db2.gz MYNYDJJSNOQOGC-PKOBYXMFSA-N 2 0 322.496 4.565 20 0 DJADRP C[NH+](C)C1CCC([NH2+][C@H](c2ccc(Cl)cc2)C2CCC2)CC1 ZINC000560527120 332351486 /nfs/dbraw/zinc/35/14/86/332351486.db2.gz ACOJQPOYWZFWRI-ACBHZAAOSA-N 2 0 320.908 4.644 20 0 DJADRP C[C@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1cc2ccccc2s1 ZINC000170961415 333236109 /nfs/dbraw/zinc/23/61/09/333236109.db2.gz BNABPYLCXPGPLK-HNNXBMFYSA-N 2 0 324.493 4.814 20 0 DJADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCCC2)c1)c1cccs1 ZINC000411538021 333690254 /nfs/dbraw/zinc/69/02/54/333690254.db2.gz SUIHUPZZOPSJGX-INIZCTEOSA-N 2 0 314.498 4.585 20 0 DJADRP CC(C)(C)c1ccc(C[NH2+][C@@H](CCC[NH3+])c2ccccc2)s1 ZINC000415058137 334261798 /nfs/dbraw/zinc/26/17/98/334261798.db2.gz SPYXMVVLSAGCEX-KRWDZBQOSA-N 2 0 316.514 4.615 20 0 DJADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCc2ccc(C)cc21 ZINC000325260074 336281971 /nfs/dbraw/zinc/28/19/71/336281971.db2.gz NOWBCDLYTUOWQZ-JOCHJYFZSA-N 2 0 322.496 4.614 20 0 DJADRP C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1cc2ccccc2s1 ZINC000423291341 337709875 /nfs/dbraw/zinc/70/98/75/337709875.db2.gz HWTPLJQVSMZNLC-UONOGXRCSA-N 2 0 310.466 4.772 20 0 DJADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2ccc(C(F)(F)F)cc2)cc1 ZINC000423292555 337710336 /nfs/dbraw/zinc/71/03/36/337710336.db2.gz NIBXEOCKZACXCR-STQMWFEESA-N 2 0 322.374 4.576 20 0 DJADRP CC[C@@H]([NH2+]Cc1ccc([C@@H](C)[NH3+])cc1)c1ccc(Cl)s1 ZINC000423296566 337710898 /nfs/dbraw/zinc/71/08/98/337710898.db2.gz ZKSVTQSIPLXQPR-BXUZGUMPSA-N 2 0 308.878 4.662 20 0 DJADRP CC(C)C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1cccs1 ZINC000423296563 337710965 /nfs/dbraw/zinc/71/09/65/337710965.db2.gz ZKPOFZDRNJROTK-WMLDXEAASA-N 2 0 302.487 4.645 20 0 DJADRP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccc(SC2CCCC2)cc1 ZINC000423371747 337715305 /nfs/dbraw/zinc/71/53/05/337715305.db2.gz HWBPTLXPFMKSGS-BFYDXBDKSA-N 2 0 318.530 4.512 20 0 DJADRP C[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1cccc2ccccc21 ZINC000423497378 337723054 /nfs/dbraw/zinc/72/30/54/337723054.db2.gz GVPFNVICJDTMPR-JTSKRJEESA-N 2 0 318.464 4.971 20 0 DJADRP CSc1ccc([C@@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423519047 337724336 /nfs/dbraw/zinc/72/43/36/337724336.db2.gz ZSWAXRZANCYEHT-DNVCBOLYSA-N 2 0 314.498 4.539 20 0 DJADRP C[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1csc(Cl)c1 ZINC000423522650 337724468 /nfs/dbraw/zinc/72/44/68/337724468.db2.gz VDLBTHWNMYYOEY-IUODEOHRSA-N 2 0 308.878 4.532 20 0 DJADRP Cc1cc(C)cc(-c2ccc(C[NH2+][C@@H]3CC[N@H+](C)[C@@H](C)C3)cc2)c1 ZINC000462763752 339087480 /nfs/dbraw/zinc/08/74/80/339087480.db2.gz PESUWWLKUAMYTG-PGRDOPGGSA-N 2 0 322.496 4.543 20 0 DJADRP CCCCC/C(=C/c1ccccc1)C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000462762170 339087501 /nfs/dbraw/zinc/08/75/01/339087501.db2.gz PLMVDXGRUKSOEM-KIWKJEFJSA-N 2 0 314.517 4.723 20 0 DJADRP CCCCC/C(=C\c1ccccc1)C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000462762169 339087520 /nfs/dbraw/zinc/08/75/20/339087520.db2.gz PLMVDXGRUKSOEM-GPLMZXIKSA-N 2 0 314.517 4.723 20 0 DJADRP CC[NH+](CC)C[C@@H]1CC[N@@H+]([C@@H](C)c2ccc3ccccc3c2)C1 ZINC000464772633 339152449 /nfs/dbraw/zinc/15/24/49/339152449.db2.gz FIPPBAAYNAQBKK-ROUUACIJSA-N 2 0 310.485 4.565 20 0 DJADRP CCCC[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccccc1 ZINC000467830651 339247091 /nfs/dbraw/zinc/24/70/91/339247091.db2.gz CUMOIIRZVCDEKH-NRFANRHFSA-N 2 0 310.485 4.769 20 0 DJADRP CC(C)c1nc([C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cs1 ZINC000469776062 339298903 /nfs/dbraw/zinc/29/89/03/339298903.db2.gz PGEAJVLPPZGQKK-HOTGVXAUSA-N 2 0 323.550 4.572 20 0 DJADRP Cc1ccc(C)c2c1CCC[C@@H]2[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000472129821 339363713 /nfs/dbraw/zinc/36/37/13/339363713.db2.gz GUOXKMWKADANGT-NRFANRHFSA-N 2 0 322.496 4.532 20 0 DJADRP CC[C@@H]([NH2+][C@@H](C)CCC[NH+](CC)CC)c1ccc(F)cc1F ZINC000479741086 339547396 /nfs/dbraw/zinc/54/73/96/339547396.db2.gz GSTLOQVXUJLOLH-KBXCAEBGSA-N 2 0 312.448 4.516 20 0 DJADRP CCc1ccc([C@@H](CC)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1 ZINC000480164445 339561295 /nfs/dbraw/zinc/56/12/95/339561295.db2.gz LVMXTUXWNHEVME-OAQYLSRUSA-N 2 0 310.485 4.552 20 0 DJADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1c2ccccc2C[C@H]1C ZINC000480455460 339573622 /nfs/dbraw/zinc/57/36/22/339573622.db2.gz UFFVGNQIQAKENF-VGSWGCGISA-N 2 0 322.496 4.552 20 0 DJADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2sccc2C)c1 ZINC000481316176 339600814 /nfs/dbraw/zinc/60/08/14/339600814.db2.gz CSCWKXHJPSVMFB-MRXNPFEDSA-N 2 0 316.514 4.749 20 0 DJADRP C[C@@H]([NH2+]CCCC[NH+](C)C)c1ccc(SC2CCCC2)cc1 ZINC000481948559 339617740 /nfs/dbraw/zinc/61/77/40/339617740.db2.gz ARJGCCZGPFRENH-MRXNPFEDSA-N 2 0 320.546 4.714 20 0 DJADRP CCC[NH+]1CCC(C[NH2+][C@@H](CC)c2ccc(Cl)s2)CC1 ZINC000482509784 339633866 /nfs/dbraw/zinc/63/38/66/339633866.db2.gz UJYPNVGASFWFAL-AWEZNQCLSA-N 2 0 314.926 4.564 20 0 DJADRP CC[C@@H]([NH2+]Cc1cccc(C[NH+](CC)CC)c1)c1ccccc1 ZINC000495547937 339987153 /nfs/dbraw/zinc/98/71/53/339987153.db2.gz NYHFOMDTUBXPHS-OAQYLSRUSA-N 2 0 310.485 4.769 20 0 DJADRP CC[C@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@@H](C)[C@H](n2ccnc2)C1 ZINC000503074414 340120364 /nfs/dbraw/zinc/12/03/64/340120364.db2.gz KHBIRICJCYOCCH-ZTFGCOKTSA-N 2 0 317.864 4.571 20 0 DJADRP CC(C)Sc1ccc([C@H](C)[NH2+]CC2(C)CC[NH+](C)CC2)cc1 ZINC000507471165 340221343 /nfs/dbraw/zinc/22/13/43/340221343.db2.gz BJVCMDPXEPLCDB-INIZCTEOSA-N 2 0 320.546 4.570 20 0 DJADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1cccc(Cl)c1 ZINC000512314121 340356520 /nfs/dbraw/zinc/35/65/20/340356520.db2.gz MKNUNNKMWLOWTQ-YQQAZPJKSA-N 2 0 320.908 4.644 20 0 DJADRP Cc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1C ZINC000512330511 340357351 /nfs/dbraw/zinc/35/73/51/340357351.db2.gz FDKUFTHQBMXXSY-NLWGTHIKSA-N 2 0 314.517 4.607 20 0 DJADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1cc2c(ccc3ccccc23)o1 ZINC000538396323 340820936 /nfs/dbraw/zinc/82/09/36/340820936.db2.gz ZCJMLXHLDAINDG-OAHLLOKOSA-N 2 0 322.452 4.578 20 0 DJADRP Cc1ccsc1[C@H](C)[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC000540141981 340916519 /nfs/dbraw/zinc/91/65/19/340916519.db2.gz MNHPANVMFGSZGA-AOCRQIFASA-N 2 0 320.546 4.750 20 0 DJADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(Cl)cc1Cl ZINC000556860207 331742849 /nfs/dbraw/zinc/74/28/49/331742849.db2.gz XJVWFACLXRJCTP-LMWSTFAQSA-N 2 0 315.288 4.517 20 0 DJADRP Cc1ccc(C[NH2+]Cc2ccccc2C[N@H+]2CCC[C@@H](C)C2)cc1 ZINC000518267785 332003138 /nfs/dbraw/zinc/00/31/38/332003138.db2.gz TYFWXDZGJIHVRB-LJQANCHMSA-N 2 0 322.496 4.517 20 0 DJADRP C[C@H](c1cccc2ccccc21)[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000531101569 332261762 /nfs/dbraw/zinc/26/17/62/332261762.db2.gz MYNYDJJSNOQOGC-MJGOQNOKSA-N 2 0 322.496 4.565 20 0 DJADRP Cc1ccc([C@H]([NH2+]Cc2ccc(C[NH+](C)C)cc2)C2CCC2)cc1 ZINC000427580089 332455440 /nfs/dbraw/zinc/45/54/40/332455440.db2.gz XGZJTRIUVXONSH-JOCHJYFZSA-N 2 0 322.496 4.688 20 0 DJADRP CC(C)[NH+]1CCC([NH2+][C@@H](C)c2ccc(C(C)(C)C)cc2)CC1 ZINC000314321167 333102427 /nfs/dbraw/zinc/10/24/27/333102427.db2.gz HPPNXKFIYDTUBD-INIZCTEOSA-N 2 0 302.506 4.508 20 0 DJADRP C/C(=C/c1ccccc1)C[NH2+][C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000518775913 333128611 /nfs/dbraw/zinc/12/86/11/333128611.db2.gz ISYIDHNLWFHTSU-AWLAMKMTSA-N 2 0 320.480 4.515 20 0 DJADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2cccc(C)c2)c1 ZINC000525760998 333240709 /nfs/dbraw/zinc/24/07/09/333240709.db2.gz IWKIUSMHCDGBES-SFHVURJKSA-N 2 0 310.485 4.688 20 0 DJADRP CC(C)(C)c1ccc(C[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1 ZINC000415066145 334262398 /nfs/dbraw/zinc/26/23/98/334262398.db2.gz NZECLDVXACCJBO-FQEVSTJZSA-N 2 0 310.485 4.554 20 0 DJADRP C[NH+](C)Cc1cccc(C[NH2+][C@@H](CC2CCC2)c2ccccc2)c1 ZINC000344144659 335221694 /nfs/dbraw/zinc/22/16/94/335221694.db2.gz VNLLWTHRQGMHAG-QFIPXVFZSA-N 2 0 322.496 4.769 20 0 DJADRP Cc1ccsc1[C@@H](C)[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000162916974 338504774 /nfs/dbraw/zinc/50/47/74/338504774.db2.gz ITUHHLCFNNHRKZ-MRXNPFEDSA-N 2 0 314.498 4.503 20 0 DJADRP CC[C@H]([NH2+]Cc1ccccc1C[N@H+](C)C(C)C)c1ccccc1 ZINC000353045316 336390531 /nfs/dbraw/zinc/39/05/31/336390531.db2.gz GWMZQTMVELYJLZ-NRFANRHFSA-N 2 0 310.485 4.768 20 0 DJADRP C[C@H]([NH2+]CC(C)(C)N[C@@H](C)c1ccccc1)c1cccs1 ZINC000482948990 336399935 /nfs/dbraw/zinc/39/99/35/336399935.db2.gz NZMMGUGTKRSXCH-GJZGRUSLSA-N 2 0 302.487 4.528 20 0 DJADRP C[C@H]([NH2+]CCCC[NH+](C)C)c1ccc(Cl)c(Cl)c1Cl ZINC000045664046 337826930 /nfs/dbraw/zinc/82/69/30/337826930.db2.gz VRYHSGLKAHTCEB-JTQLQIEISA-N 2 0 323.695 4.639 20 0 DJADRP Cc1nccn1CCCC[N@@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC000459577890 339036977 /nfs/dbraw/zinc/03/69/77/339036977.db2.gz MGDRIYCKEVLYJW-FQEVSTJZSA-N 2 0 323.484 4.589 20 0 DJADRP C[C@H]1CC[C@H]([NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)C1 ZINC000462679213 339083850 /nfs/dbraw/zinc/08/38/50/339083850.db2.gz HKGDBDFSHLQNCD-UWJYYQICSA-N 2 0 322.496 4.693 20 0 DJADRP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3)cc2)C1 ZINC000464782557 339153609 /nfs/dbraw/zinc/15/36/09/339153609.db2.gz XXLGGWHBLOQPIH-HXUWFJFHSA-N 2 0 322.496 4.517 20 0 DJADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1csc(Cl)c1 ZINC000469061789 339278951 /nfs/dbraw/zinc/27/89/51/339278951.db2.gz SHZDTTBPYLGXGZ-KGLIPLIRSA-N 2 0 314.926 4.564 20 0 DJADRP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)[C@H](C)c1ccc(Cl)cc1 ZINC000474594237 339419225 /nfs/dbraw/zinc/41/92/25/339419225.db2.gz DUSSUHYLGLFNLA-LSDHHAIUSA-N 2 0 322.924 4.685 20 0 DJADRP CCSc1ccccc1[C@H](C)[NH2+]CCC1CC[NH+](CC)CC1 ZINC000483739064 339673567 /nfs/dbraw/zinc/67/35/67/339673567.db2.gz FFGWMRDJIYSYSP-INIZCTEOSA-N 2 0 320.546 4.571 20 0 DJADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCCC1)c1ccc(Cl)s1 ZINC000498488777 339724812 /nfs/dbraw/zinc/72/48/12/339724812.db2.gz VQXDDMJKIKUBSE-CQSZACIVSA-N 2 0 314.926 4.708 20 0 DJADRP CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CCC[C@H](c3ccccc3)C2)CC1 ZINC000488378950 339779116 /nfs/dbraw/zinc/77/91/16/339779116.db2.gz KQKSDFFIHRUGAY-AZUAARDMSA-N 2 0 314.517 4.565 20 0 DJADRP Cc1cc([C@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)oc1C ZINC000502405488 340102026 /nfs/dbraw/zinc/10/20/26/340102026.db2.gz JFZXSUBQCXVUMH-IVMQYODDSA-N 2 0 318.505 4.590 20 0 DJADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1cc(C)c(C)o1 ZINC000502698133 340111123 /nfs/dbraw/zinc/11/11/23/340111123.db2.gz LDWBVQFHLAAGFQ-MRXNPFEDSA-N 2 0 314.473 4.589 20 0 DJADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H]2C[C@@H](C)c3c2cccc3C)c1 ZINC000504927543 340156436 /nfs/dbraw/zinc/15/64/36/340156436.db2.gz QLNCCOCZDJZQQB-UTKZUKDTSA-N 2 0 322.496 4.785 20 0 DJADRP CC[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1ccccc1 ZINC000303556514 340333477 /nfs/dbraw/zinc/33/34/77/340333477.db2.gz WJCOVHWZXJDMKS-JOCHJYFZSA-N 2 0 322.496 4.913 20 0 DJADRP CCc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)s1 ZINC000512316181 340356634 /nfs/dbraw/zinc/35/66/34/340356634.db2.gz WZMUMKGOVFYJJM-PMPSAXMXSA-N 2 0 320.546 4.614 20 0 DJADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2sccc2Cl)cc1 ZINC000192985758 340571297 /nfs/dbraw/zinc/57/12/97/340571297.db2.gz ZXBOCGZVXMKWRR-UHFFFAOYSA-N 2 0 322.905 4.533 20 0 DJADRP C[C@@H]([NH2+]CCCC[NH+](C)C)c1cc2c(ccc3ccccc23)o1 ZINC000539498665 340887779 /nfs/dbraw/zinc/88/77/79/340887779.db2.gz NRUGQAMCCPQEJL-OAHLLOKOSA-N 2 0 310.441 4.578 20 0 DJADRP Cc1ccsc1[C@@H](C)[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC000540141982 340916527 /nfs/dbraw/zinc/91/65/27/340916527.db2.gz MNHPANVMFGSZGA-WWDZGPRUSA-N 2 0 320.546 4.750 20 0 DJADRP C[C@@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1cccc2ccccc21 ZINC000171126755 332854756 /nfs/dbraw/zinc/85/47/56/332854756.db2.gz KFYXTVTUZAGFKV-QGZVFWFLSA-N 2 0 318.464 4.752 20 0 DJADRP C[C@H](c1cccc2ccccc21)[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000531101567 332261737 /nfs/dbraw/zinc/26/17/37/332261737.db2.gz MYNYDJJSNOQOGC-IEBWSBKVSA-N 2 0 322.496 4.565 20 0 DJADRP CC[C@H]([NH2+]CCCCC[NH+]1CCCC1)c1ccc(Cl)s1 ZINC000559894592 332290832 /nfs/dbraw/zinc/29/08/32/332290832.db2.gz RWHODSZECCBJHV-AWEZNQCLSA-N 2 0 314.926 4.708 20 0 DJADRP CC[C@H]([NH2+]Cc1ccc(C[NH+](CC)CC)cc1)c1cccs1 ZINC000314126053 333087950 /nfs/dbraw/zinc/08/79/50/333087950.db2.gz PZKZCJXDYNDOFQ-SFHVURJKSA-N 2 0 316.514 4.831 20 0 DJADRP [NH3+]CCC[C@H]([NH2+]Cc1ccc(Cl)c(Cl)c1)c1ccccc1 ZINC000415058622 334262113 /nfs/dbraw/zinc/26/21/13/334262113.db2.gz UGJPJRAREWARIX-KRWDZBQOSA-N 2 0 323.267 4.563 20 0 DJADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H]1CCCc2ccccc21 ZINC000324173724 336102406 /nfs/dbraw/zinc/10/24/06/336102406.db2.gz OUPPBLLRHNLFDW-QFIPXVFZSA-N 2 0 322.496 4.696 20 0 DJADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)c1cccs1 ZINC000532457364 336248358 /nfs/dbraw/zinc/24/83/58/336248358.db2.gz KCSXXXVLUSFNSH-INIZCTEOSA-N 2 0 314.498 4.585 20 0 DJADRP C[C@H]1C[C@@H]([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c2ccccc21 ZINC000563999528 336394874 /nfs/dbraw/zinc/39/48/74/336394874.db2.gz YAGITCSEBWTXDR-HTAPYJJXSA-N 2 0 320.480 4.621 20 0 DJADRP C[C@@H]([NH2+]CC(C)(C)N[C@H](C)c1ccccc1)c1cccs1 ZINC000482948992 336399993 /nfs/dbraw/zinc/39/99/93/336399993.db2.gz NZMMGUGTKRSXCH-HUUCEWRRSA-N 2 0 302.487 4.528 20 0 DJADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cc(Cl)sc1Cl ZINC000421881581 337658664 /nfs/dbraw/zinc/65/86/64/337658664.db2.gz RHUXUPXLIMXDQI-KPPDAEKUSA-N 2 0 321.317 4.578 20 0 DJADRP CCc1c2ccccc2oc1[C@H](C)[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000423290477 337709894 /nfs/dbraw/zinc/70/98/94/337709894.db2.gz DDHOICKVRQDUJK-GJZGRUSLSA-N 2 0 322.452 4.866 20 0 DJADRP CC(C)[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1cc2ccccc2o1 ZINC000423293197 337710564 /nfs/dbraw/zinc/71/05/64/337710564.db2.gz QGMZPRKSTNPXAJ-YCRPNKLZSA-N 2 0 322.452 4.939 20 0 DJADRP CC(C)[C@H]([NH2+]Cc1ccc([C@@H](C)[NH3+])cc1)c1ccc(Cl)cc1 ZINC000423295124 337710689 /nfs/dbraw/zinc/71/06/89/337710689.db2.gz WEFJXLPMRXCFRD-KUHUBIRLSA-N 2 0 316.876 4.847 20 0 DJADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@H](CC2CCC2)c2ccccc2)cc1 ZINC000423295398 337710723 /nfs/dbraw/zinc/71/07/23/337710723.db2.gz WXQAGCITQNTDIU-HRAATJIYSA-N 2 0 308.469 4.727 20 0 DJADRP Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000423508492 337723794 /nfs/dbraw/zinc/72/37/94/337723794.db2.gz QWPPMOKMTAXILU-AHRSYUTCSA-N 2 0 308.469 4.613 20 0 DJADRP CC[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1cccc(Cl)c1 ZINC000423510867 337723993 /nfs/dbraw/zinc/72/39/93/337723993.db2.gz SOLORLNQFBBAMN-RBUKOAKNSA-N 2 0 316.876 4.861 20 0 DJADRP C[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccc(Cl)s1 ZINC000423514450 337724270 /nfs/dbraw/zinc/72/42/70/337724270.db2.gz WPPOGDIIBZBQGP-JSGCOSHPSA-N 2 0 308.878 4.532 20 0 DJADRP C[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1csc(Cl)c1 ZINC000423522651 337724536 /nfs/dbraw/zinc/72/45/36/337724536.db2.gz VDLBTHWNMYYOEY-SWLSCSKDSA-N 2 0 308.878 4.532 20 0 DJADRP Cc1ccc2cc([C@H](C)[NH2+][C@H](CCC[NH3+])c3ccccc3)oc2c1 ZINC000423526586 337724565 /nfs/dbraw/zinc/72/45/65/337724565.db2.gz ZMZOEUVCZUNRPD-QFBILLFUSA-N 2 0 322.452 4.872 20 0 DJADRP CC(C)c1nc([C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cs1 ZINC000469776067 339298989 /nfs/dbraw/zinc/29/89/89/339298989.db2.gz PGEAJVLPPZGQKK-JKSUJKDBSA-N 2 0 323.550 4.572 20 0 DJADRP CCC[N@H+](C)C[C@@H]1CC[NH+]([C@H](C)c2ccc3ccccc3c2)C1 ZINC000471045990 339335736 /nfs/dbraw/zinc/33/57/36/339335736.db2.gz ALFZLVNVHAZXDF-MSOLQXFVSA-N 2 0 310.485 4.565 20 0 DJADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1c2ccccc2C[C@@H]1C ZINC000480455458 339573581 /nfs/dbraw/zinc/57/35/81/339573581.db2.gz UFFVGNQIQAKENF-JTSKRJEESA-N 2 0 322.496 4.552 20 0 DJADRP Cc1ccc2cc([C@H](C)[NH2+]Cc3ccc(C[NH+](C)C)cc3)oc2c1 ZINC000495258829 339979837 /nfs/dbraw/zinc/97/98/37/339979837.db2.gz GGYVPRCCGLIXCC-INIZCTEOSA-N 2 0 322.452 4.654 20 0 DJADRP Cc1cc([C@@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)oc1C ZINC000502405483 340102076 /nfs/dbraw/zinc/10/20/76/340102076.db2.gz JFZXSUBQCXVUMH-IPJUCJBFSA-N 2 0 318.505 4.590 20 0 DJADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1cc(C)c(C)o1 ZINC000502698132 340111066 /nfs/dbraw/zinc/11/10/66/340111066.db2.gz LDWBVQFHLAAGFQ-INIZCTEOSA-N 2 0 314.473 4.589 20 0 DJADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H]2C[C@H](C)c3c2cccc3C)c1 ZINC000504927544 340156522 /nfs/dbraw/zinc/15/65/22/340156522.db2.gz QLNCCOCZDJZQQB-UWJYYQICSA-N 2 0 322.496 4.785 20 0 DJADRP CC(C)Sc1ccc([C@@H](C)[NH2+]CC2(C)CC[NH+](C)CC2)cc1 ZINC000507471168 340221360 /nfs/dbraw/zinc/22/13/60/340221360.db2.gz BJVCMDPXEPLCDB-MRXNPFEDSA-N 2 0 320.546 4.570 20 0 DJADRP CC1CC[NH+](C2CCC([NH2+][C@H]3CCC[C@H]3CCCF)CC2)CC1 ZINC000510696928 340307102 /nfs/dbraw/zinc/30/71/02/340307102.db2.gz SKMLMOICCUNKOA-FVELJTHGSA-N 2 0 324.528 4.538 20 0 DJADRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(Cl)cc1 ZINC000512330389 340357415 /nfs/dbraw/zinc/35/74/15/340357415.db2.gz UDWYBDBWVKTXIC-ZOBUZTSGSA-N 2 0 320.908 4.644 20 0 DJADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)c1ccoc1 ZINC000247026183 341360054 /nfs/dbraw/zinc/36/00/54/341360054.db2.gz LYLCFKUCIPDWES-IAGOWNOFSA-N 2 0 312.457 4.505 20 0 DJADRP Cc1ccc(C[NH2+]Cc2ccccc2C[N@H+]2CCC[C@H](C)C2)cc1 ZINC000518267782 332003274 /nfs/dbraw/zinc/00/32/74/332003274.db2.gz TYFWXDZGJIHVRB-IBGZPJMESA-N 2 0 322.496 4.517 20 0 DJADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1cc2ccccc2o1 ZINC000314253609 333096461 /nfs/dbraw/zinc/09/64/61/333096461.db2.gz XTQHHBUCRUJCGO-HOTGVXAUSA-N 2 0 302.462 4.594 20 0 DJADRP CC[C@H]([NH2+]C1CC[NH+](CC(C)C)CC1)c1ccc(Cl)cc1 ZINC000221934024 333380835 /nfs/dbraw/zinc/38/08/35/333380835.db2.gz XQOOROCKGCRANK-SFHVURJKSA-N 2 0 308.897 4.501 20 0 DJADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1cc(C)oc1C ZINC000319884459 333415613 /nfs/dbraw/zinc/41/56/13/333415613.db2.gz AFQRXKKUSMXXEW-MRXNPFEDSA-N 2 0 314.473 4.589 20 0 DJADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1ccc(F)c(Cl)c1 ZINC000021812168 333452737 /nfs/dbraw/zinc/45/27/37/333452737.db2.gz CKZIPGRNNRHAJY-ZIAGYGMSSA-N 2 0 314.876 4.640 20 0 DJADRP Cc1cc(Cl)cc(C)c1C[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000415061926 334262424 /nfs/dbraw/zinc/26/24/24/334262424.db2.gz ZEKYUXKLVDTDSA-LJQANCHMSA-N 2 0 316.876 4.527 20 0 DJADRP Cc1cc(Cl)cc(C)c1C[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000415061925 334262523 /nfs/dbraw/zinc/26/25/23/334262523.db2.gz ZEKYUXKLVDTDSA-IBGZPJMESA-N 2 0 316.876 4.527 20 0 DJADRP CC(C)C[C@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1ccccc1 ZINC000531944545 334300211 /nfs/dbraw/zinc/30/02/11/334300211.db2.gz YQPRIXBPCWTONU-NRFANRHFSA-N 2 0 310.485 4.625 20 0 DJADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](CC2CC2)c2ccccc2)c1 ZINC000531959223 334314795 /nfs/dbraw/zinc/31/47/95/334314795.db2.gz RTHLFPMTLNDEAI-QFIPXVFZSA-N 2 0 322.496 4.769 20 0 DJADRP CC[C@@H]([NH2+]Cc1cccc(C[N@H+](C)CC)c1)c1ccccc1F ZINC000352684575 336230194 /nfs/dbraw/zinc/23/01/94/336230194.db2.gz OWXPUPZBCDEMIE-HXUWFJFHSA-N 2 0 314.448 4.518 20 0 DJADRP CCC[C@H]([NH2+]C1CCN(C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000532454799 336248266 /nfs/dbraw/zinc/24/82/66/336248266.db2.gz RIHOENSRVBDPHC-INIZCTEOSA-N 2 0 315.288 4.518 20 0 DJADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(Cl)cc2)c1 ZINC000532482897 336251596 /nfs/dbraw/zinc/25/15/96/336251596.db2.gz FDYRZNKHWJGSRO-OAHLLOKOSA-N 2 0 316.876 4.643 20 0 DJADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cc(Cl)cc(Cl)c1 ZINC000421890716 337655346 /nfs/dbraw/zinc/65/53/46/337655346.db2.gz YGDHIZJAOAJYDJ-SOISORPOSA-N 2 0 315.288 4.517 20 0 DJADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cc(Cl)sc1Cl ZINC000421881593 337658638 /nfs/dbraw/zinc/65/86/38/337658638.db2.gz RHUXUPXLIMXDQI-WHXUTIOJSA-N 2 0 321.317 4.578 20 0 DJADRP CC[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1ccc(Cl)cc1 ZINC000423290494 337709896 /nfs/dbraw/zinc/70/98/96/337709896.db2.gz DGAOFAXXURVJHH-SCLBCKFNSA-N 2 0 302.849 4.601 20 0 DJADRP Cc1ccc2cc([C@@H](C)[NH2+]Cc3ccc([C@H](C)[NH3+])cc3)oc2c1 ZINC000423292025 337710071 /nfs/dbraw/zinc/71/00/71/337710071.db2.gz KZSDNJPSRFLXTH-LSDHHAIUSA-N 2 0 308.425 4.612 20 0 DJADRP Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000423291808 337710120 /nfs/dbraw/zinc/71/01/20/337710120.db2.gz JXAPJMHRIQTXEU-HUUCEWRRSA-N 2 0 308.425 4.612 20 0 DJADRP CC(C)C[C@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1cccs1 ZINC000423296564 337710850 /nfs/dbraw/zinc/71/08/50/337710850.db2.gz ZKPOFZDRNJROTK-YOEHRIQHSA-N 2 0 302.487 4.645 20 0 DJADRP CC[C@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1ccc(Cl)s1 ZINC000423296567 337711022 /nfs/dbraw/zinc/71/10/22/337711022.db2.gz ZKSVTQSIPLXQPR-FZMZJTMJSA-N 2 0 308.878 4.662 20 0 DJADRP c1ccc([C@@H]([NH2+]Cc2ccc3c(c2)C[NH2+]C3)C2CCCCC2)cc1 ZINC000423389116 337718192 /nfs/dbraw/zinc/71/81/92/337718192.db2.gz OAEDEHFOLYWQNW-JOCHJYFZSA-N 2 0 320.480 4.701 20 0 DJADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+][C@H]1CC[C@H](c2ccccc2)C1 ZINC000436271673 338264732 /nfs/dbraw/zinc/26/47/32/338264732.db2.gz RAQDQUOCKPKHMD-GIVPXCGWSA-N 2 0 314.517 4.567 20 0 DJADRP CC[C@H]([NH2+][C@@H]1CCN(C)[C@H](C)C1)c1ccc(Cl)c(Cl)c1 ZINC000156560353 338369043 /nfs/dbraw/zinc/36/90/43/338369043.db2.gz QJUPDJAKQIYVKT-KFNAQCHYSA-N 2 0 315.288 4.517 20 0 DJADRP Cc1cc([C@@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)cs1 ZINC000453072089 338790316 /nfs/dbraw/zinc/79/03/16/338790316.db2.gz NGSPQMBPKJNCAB-MRXNPFEDSA-N 2 0 314.498 4.503 20 0 DJADRP C[C@H](CC[NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccccc1 ZINC000467417909 339237513 /nfs/dbraw/zinc/23/75/13/339237513.db2.gz MEHLONYNRWNDPJ-GOSISDBHSA-N 2 0 314.517 4.567 20 0 DJADRP CCC[N@H+](C)C[C@H]1CC[NH+]([C@H](C)c2ccc3ccccc3c2)C1 ZINC000471045991 339335693 /nfs/dbraw/zinc/33/56/93/339335693.db2.gz ALFZLVNVHAZXDF-QZTJIDSGSA-N 2 0 310.485 4.565 20 0 DJADRP Cc1cc([C@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)c(C)s1 ZINC000480247730 339565147 /nfs/dbraw/zinc/56/51/47/339565147.db2.gz BYNWBVGFLYULQI-HNNXBMFYSA-N 2 0 320.546 4.813 20 0 DJADRP C[C@@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1cc2ccccc2o1 ZINC000480637998 339580902 /nfs/dbraw/zinc/58/09/02/339580902.db2.gz IDRMAXUOEJDWFL-QGZVFWFLSA-N 2 0 314.473 4.596 20 0 DJADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2ccc3occc3c2)c1 ZINC000512046280 340346512 /nfs/dbraw/zinc/34/65/12/340346512.db2.gz SJGKUBPGVARKDM-UHFFFAOYSA-N 2 0 322.452 4.563 20 0 DJADRP CC[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(F)cc1 ZINC000512326303 340357225 /nfs/dbraw/zinc/35/72/25/340357225.db2.gz ZWDJAEFRBOHJIB-KNBMTAEXSA-N 2 0 318.480 4.519 20 0 DJADRP CC[C@H]([NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(C)cc1 ZINC000512326904 340357323 /nfs/dbraw/zinc/35/73/23/340357323.db2.gz BDLGFNAGLURIRR-LMNJBCLMSA-N 2 0 314.517 4.689 20 0 DJADRP Cc1cccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1C ZINC000512338584 340357986 /nfs/dbraw/zinc/35/79/86/340357986.db2.gz ZEYNKIRVFNFOFT-FHWLQOOXSA-N 2 0 314.517 4.607 20 0 DJADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2sccc2Cl)c1 ZINC000193011120 340571514 /nfs/dbraw/zinc/57/15/14/340571514.db2.gz HLIJDCBWQNVHKX-UHFFFAOYSA-N 2 0 322.905 4.533 20 0 DJADRP CC(C)(C)[NH+]1CCC([NH2+]C2CCC(c3ccccc3)CC2)CC1 ZINC000236643679 340663277 /nfs/dbraw/zinc/66/32/77/340663277.db2.gz AKKOIPHVPQXCFG-UHFFFAOYSA-N 2 0 314.517 4.565 20 0 DJADRP C[C@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1cccc(C2CC2)c1 ZINC000550678724 341321106 /nfs/dbraw/zinc/32/11/06/341321106.db2.gz QGCVHXWNPUTFMD-INIZCTEOSA-N 2 0 312.501 4.622 20 0 DJADRP Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000171130459 518186273 /nfs/dbraw/zinc/18/62/73/518186273.db2.gz VIHLAOCQEGULQV-MRXNPFEDSA-N 2 0 322.452 4.654 20 0 DJADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cccc(Cl)c1Cl ZINC000560523865 332350796 /nfs/dbraw/zinc/35/07/96/332350796.db2.gz FYUPZYYMYIZWAX-PNESKVBLSA-N 2 0 315.288 4.517 20 0 DJADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cc(Cl)ccc1Cl ZINC000560528337 332351773 /nfs/dbraw/zinc/35/17/73/332351773.db2.gz PXBFHAIPLDHMSJ-LMWSTFAQSA-N 2 0 315.288 4.517 20 0 DJADRP CCc1c2ccccc2oc1[C@@H](C)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000560529858 332352270 /nfs/dbraw/zinc/35/22/70/332352270.db2.gz LNHBFYOPXOLPRK-QQFBHYJXSA-N 2 0 314.473 4.519 20 0 DJADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2ccc(C)s2)cc1 ZINC000314038349 333083547 /nfs/dbraw/zinc/08/35/47/333083547.db2.gz DJPJNRZZJFPHFL-MRXNPFEDSA-N 2 0 316.514 4.749 20 0 DJADRP Cc1cccc(C[NH2+]Cc2ccccc2C[NH+]2CCCCCC2)c1 ZINC000497228559 333224664 /nfs/dbraw/zinc/22/46/64/333224664.db2.gz MAUCWGNJHXCLFW-UHFFFAOYSA-N 2 0 322.496 4.661 20 0 DJADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1ccc(Cl)s1 ZINC000021514677 333388924 /nfs/dbraw/zinc/38/89/24/333388924.db2.gz XSALVOJBFZOQFR-UHFFFAOYSA-N 2 0 322.905 4.533 20 0 DJADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1ccccc1C ZINC000320350328 333517949 /nfs/dbraw/zinc/51/79/49/333517949.db2.gz PVEGMAMFWLMHPF-GOSISDBHSA-N 2 0 310.485 4.688 20 0 DJADRP Cc1cc2cc(C[NH2+][C@H](CCC[NH3+])c3ccccc3)oc2cc1C ZINC000415062133 334262479 /nfs/dbraw/zinc/26/24/79/334262479.db2.gz ZTPKXMIXONUBRJ-HXUWFJFHSA-N 2 0 322.452 4.619 20 0 DJADRP CCSc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)cc1 ZINC000534495576 334277580 /nfs/dbraw/zinc/27/75/80/334277580.db2.gz DOKAUZGAIKCUGF-SJORKVTESA-N 2 0 320.546 4.570 20 0 DJADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1csc2ccccc12 ZINC000049943169 334359322 /nfs/dbraw/zinc/35/93/22/334359322.db2.gz ICRFBEVJGYTBGD-OAHLLOKOSA-N 2 0 304.503 4.501 20 0 DJADRP C[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccc(Cl)c(F)c1 ZINC000519766252 335894944 /nfs/dbraw/zinc/89/49/44/335894944.db2.gz QNFVJVMXYFUMFJ-ACJLOTCBSA-N 2 0 320.839 4.610 20 0 DJADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000324650706 336239890 /nfs/dbraw/zinc/23/98/90/336239890.db2.gz BHOZBNGLFWMOIT-QFIPXVFZSA-N 2 0 322.496 4.769 20 0 DJADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H]1CCc2ccc(C)cc21 ZINC000325260075 336281951 /nfs/dbraw/zinc/28/19/51/336281951.db2.gz NOWBCDLYTUOWQZ-QFIPXVFZSA-N 2 0 322.496 4.614 20 0 DJADRP CCC[C@H]([NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1)c1ccsc1 ZINC000443082454 336398465 /nfs/dbraw/zinc/39/84/65/336398465.db2.gz YLOIWMUOTCNYQF-AEFFLSMTSA-N 2 0 308.535 4.547 20 0 DJADRP CC(C)CC[C@@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1ccoc1 ZINC000353432576 336417523 /nfs/dbraw/zinc/41/75/23/336417523.db2.gz CBDPTRXYDZFKST-HXUWFJFHSA-N 2 0 314.473 4.608 20 0 DJADRP CC(C)c1ccc([C@H]([NH2+][C@H](C)CCC[NH3+])c2cccs2)cc1 ZINC000422786920 337686595 /nfs/dbraw/zinc/68/65/95/337686595.db2.gz PHPJYBUFWAQCMQ-BEFAXECRSA-N 2 0 316.514 4.678 20 0 DJADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](c1ccsc1)c1ccc(Cl)cc1 ZINC000422948663 337694350 /nfs/dbraw/zinc/69/43/50/337694350.db2.gz RUZQPDXLOSTYSZ-CXAGYDPISA-N 2 0 322.905 4.598 20 0 DJADRP CCSc1ccc([C@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000423291504 337710067 /nfs/dbraw/zinc/71/00/67/337710067.db2.gz IQOVCEMFDRBZEH-CABCVRRESA-N 2 0 314.498 4.669 20 0 DJADRP Cc1cc2cc([C@@H](C)[NH2+]Cc3ccc([C@H](C)[NH3+])cc3)oc2cc1C ZINC000423292005 337710087 /nfs/dbraw/zinc/71/00/87/337710087.db2.gz KXKQXXLLTOPMAA-JKSUJKDBSA-N 2 0 322.452 4.920 20 0 DJADRP CC[C@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1cccc(Cl)c1 ZINC000423293985 337710576 /nfs/dbraw/zinc/71/05/76/337710576.db2.gz STTOOMBKEQDSEK-UGSOOPFHSA-N 2 0 302.849 4.601 20 0 DJADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@H]2CCCc3c(Cl)cccc32)cc1 ZINC000423294787 337710741 /nfs/dbraw/zinc/71/07/41/337710741.db2.gz VKPVCRGMFNCMTP-DJJJIMSYSA-N 2 0 314.860 4.527 20 0 DJADRP C[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccc(F)c(Cl)c1 ZINC000423497589 337723285 /nfs/dbraw/zinc/72/32/85/337723285.db2.gz HABFTDVJSVRUAD-SCLBCKFNSA-N 2 0 320.839 4.610 20 0 DJADRP C[C@@H](c1cccc2ccccc21)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000516299912 338010066 /nfs/dbraw/zinc/01/00/66/338010066.db2.gz QITJYMAIJBAILE-KRWDZBQOSA-N 2 0 310.485 4.565 20 0 DJADRP CC(C)[C@H]1C[C@@H]([NH2+]Cc2cccc(C[NH+](C)C)c2)c2ccccc21 ZINC000447532890 338554740 /nfs/dbraw/zinc/55/47/40/338554740.db2.gz XXQOKLHCTJBSEK-FGZHOGPDSA-N 2 0 322.496 4.722 20 0 DJADRP C[C@@H]1CC[C@H]([NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)C1 ZINC000462679212 339083858 /nfs/dbraw/zinc/08/38/58/339083858.db2.gz HKGDBDFSHLQNCD-UTKZUKDTSA-N 2 0 322.496 4.693 20 0 DJADRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)C1 ZINC000462679210 339083922 /nfs/dbraw/zinc/08/39/22/339083922.db2.gz HKGDBDFSHLQNCD-DYESRHJHSA-N 2 0 322.496 4.693 20 0 DJADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1csc(Cl)c1 ZINC000468818306 339271682 /nfs/dbraw/zinc/27/16/82/339271682.db2.gz CZZXAIPGUAEOKH-KBPBESRZSA-N 2 0 314.926 4.707 20 0 DJADRP CC[NH+](CC)CCC[C@H](C)[NH2+]C[C@@H](C)c1cccc(Cl)c1 ZINC000470196584 339313700 /nfs/dbraw/zinc/31/37/00/339313700.db2.gz VSPRCDDJRDWFJO-CVEARBPZSA-N 2 0 310.913 4.544 20 0 DJADRP C[C@@H](c1ccc2ccccc2c1)[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000470961605 339333069 /nfs/dbraw/zinc/33/30/69/339333069.db2.gz TYKRYCVWFDGPOB-HKUYNNGSSA-N 2 0 322.496 4.565 20 0 DJADRP Cc1ccc(C)c2c1CCC[C@@H]2[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000472142247 339364250 /nfs/dbraw/zinc/36/42/50/339364250.db2.gz MMLYJYOVHQWNMB-NRFANRHFSA-N 2 0 322.496 4.532 20 0 DJADRP CC[C@H]([NH2+][C@H](C)CCC[NH+](CC)CC)c1ccc(Cl)s1 ZINC000479738342 339547227 /nfs/dbraw/zinc/54/72/27/339547227.db2.gz DYAVRWKHEMROME-KGLIPLIRSA-N 2 0 316.942 4.953 20 0 DJADRP CC[C@@H]([NH2+][C@H](C)CCC[NH+](CC)CC)c1ccc(Cl)s1 ZINC000479738344 339547353 /nfs/dbraw/zinc/54/73/53/339547353.db2.gz DYAVRWKHEMROME-ZIAGYGMSSA-N 2 0 316.942 4.953 20 0 DJADRP Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1C ZINC000480143223 339560436 /nfs/dbraw/zinc/56/04/36/339560436.db2.gz NZMBNOCMPYSYHH-GOSISDBHSA-N 2 0 310.485 4.524 20 0 DJADRP CC(C)CC[C@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499162417 340031488 /nfs/dbraw/zinc/03/14/88/340031488.db2.gz AZZMYELGXVWFAC-WJMWBRGCSA-N 2 0 314.517 4.596 20 0 DJADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2cc(C)c(C)o2)c1 ZINC000502685446 340110371 /nfs/dbraw/zinc/11/03/71/340110371.db2.gz JGDPZELNWBBCBD-MRXNPFEDSA-N 2 0 314.473 4.589 20 0 DJADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2cc(C)c(C)o2)c1 ZINC000502685445 340110497 /nfs/dbraw/zinc/11/04/97/340110497.db2.gz JGDPZELNWBBCBD-INIZCTEOSA-N 2 0 314.473 4.589 20 0 DJADRP CC[C@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000503074412 340120206 /nfs/dbraw/zinc/12/02/06/340120206.db2.gz KHBIRICJCYOCCH-OLMNPRSZSA-N 2 0 317.864 4.571 20 0 DJADRP CC(C)[NH+]1CCC([N@H+](C)Cc2ccc(-c3ccccc3)cc2)CC1 ZINC000507324885 340217243 /nfs/dbraw/zinc/21/72/43/340217243.db2.gz JWGUEXVUSMFWMF-UHFFFAOYSA-N 2 0 322.496 4.658 20 0 DJADRP CCc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000512314235 340356542 /nfs/dbraw/zinc/35/65/42/340356542.db2.gz NPPUMGSCUIHVEI-ZWOKBUDYSA-N 2 0 314.517 4.553 20 0 DJADRP C[C@@H]([NH2+][C@@H](C)c1cccc(Cl)c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512314116 340356605 /nfs/dbraw/zinc/35/66/05/340356605.db2.gz MKNUNNKMWLOWTQ-UXLLHSPISA-N 2 0 320.908 4.644 20 0 DJADRP CC[C@H]([NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(C)cc1 ZINC000512326905 340357282 /nfs/dbraw/zinc/35/72/82/340357282.db2.gz BDLGFNAGLURIRR-QFUCXCTJSA-N 2 0 314.517 4.689 20 0 DJADRP Cc1cccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1C ZINC000512338586 340358031 /nfs/dbraw/zinc/35/80/31/340358031.db2.gz ZEYNKIRVFNFOFT-GBESFXJTSA-N 2 0 314.517 4.607 20 0 DJADRP Cc1cccc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1C ZINC000512338587 340358037 /nfs/dbraw/zinc/35/80/37/340358037.db2.gz ZEYNKIRVFNFOFT-QYZOEREBSA-N 2 0 314.517 4.607 20 0 DJADRP C/C(=C\c1ccc(Cl)cc1)C[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000512999570 340387623 /nfs/dbraw/zinc/38/76/23/340387623.db2.gz SUUYCGUHZXFHQP-FYWRMAATSA-N 2 0 320.908 4.596 20 0 DJADRP C[NH+](C)C1CCC([NH2+][C@H](c2ccc(F)cc2)C2CCCC2)CC1 ZINC000513652370 340417189 /nfs/dbraw/zinc/41/71/89/340417189.db2.gz AEWPAKGYJPAOIE-MHJFOBGBSA-N 2 0 318.480 4.519 20 0 DJADRP CC[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccccc1 ZINC000397558760 340713062 /nfs/dbraw/zinc/71/30/62/340713062.db2.gz RPVQOAYIHCHTMM-QFIPXVFZSA-N 2 0 322.496 4.640 20 0 DJADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1C[C@@H](C)c2ccccc21 ZINC000326551612 340715272 /nfs/dbraw/zinc/71/52/72/340715272.db2.gz OJOGKYLFPVSOHF-VGOFRKELSA-N 2 0 322.496 4.867 20 0 DJADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H]2C[C@@H](C)c3ccccc32)cc1 ZINC000326557377 340715603 /nfs/dbraw/zinc/71/56/03/340715603.db2.gz QLMHCOINMHOTOW-VGOFRKELSA-N 2 0 322.496 4.867 20 0 DJADRP C[NH+](C)CCCC[NH2+][C@@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000545275439 341118614 /nfs/dbraw/zinc/11/86/14/341118614.db2.gz WRDCSRZOANAEBB-GOSISDBHSA-N 2 0 308.897 4.503 20 0 DJADRP CC[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccccc1 ZINC000112518289 522875271 /nfs/dbraw/zinc/87/52/71/522875271.db2.gz RLYGJGULNJKASD-OAQYLSRUSA-N 2 0 308.469 4.523 20 0 DJADRP